$ SET NOVERIFY %DCL-I-SUPERSEDE, previous value of POOLKU2A has been superseded %DCL-W-UNDSYM, undefined symbol - check validity and spelling %DCL-W-PARMDEL, invalid parameter delimiter - check use of special characters \$\ $ IF "BATCH" .EQS. "BATCH" THEN EXIT $set4700 $assign sys$input for010 $assign sys$output for009 $assign poolg:hf470007.dat for007 $assign poolg:hf470001.dat for001 $assign poolg:hf470002.dat for002 $assign poolg:hf470004.dat for004 $assign hf4700.pun for011 $assign hf4700.dat for013 $assign hf4700e.dat for014 $assign poolg:hf470031.dat for031 $assign poolg:hf470032.dat for032 $run cray:rcn32c 2 -5 0 10 1.0 5.e-08 1.e-11-2 150 1.0 0.65 0.1 0.50 0.0 0.70 47 1ag i d10 5s 4d10 5s ag i d10 5s nconf= 1 z= 47 ncores= 9 nvales= 1 ion= 0 r(i)/x(i)=0.24532669 ca1=0.700 tolstb=1.000 tolk-2=1.00000 tolend= 0.5E-07 thresh= 0.1E-10 kut= 0 exf=1.000 corrf=0.000 ca0= 0.500 rcn mod 32 ihf1= 0 mesh=2601 idb= 481 rdb= 100.461 emx= 0.10 r(mesh)=5426.209 irel= 1 ib=2600 t(run)= 14.44, t(job)= 14.44 seconds nl wnl ee az (r-3) (r-2) (r-1) (r+1) (r+2) (r+3) (r+4) (r+6) 1s 2. -1884.53679 881.508 0.000E+00 5.213E+03 4.936E+01 3.112E-02 1.308E-03 6.934E-05 4.438E-06 2.867E-08 2s 2. -279.81477 295.095 0.000E+00 5.731E+02 1.123E+01 1.350E-01 2.146E-02 3.880E-03 7.892E-04 4.505E-05 2p 6. -253.68193 3360.664 3.659E+03 1.600E+02 1.083E+01 1.175E-01 1.683E-02 2.853E-03 5.593E-04 3.126E-05 3s 2. -52.02796 127.555 0.000E+00 1.088E+02 3.931E+00 3.700E-01 1.565E-01 7.318E-02 3.748E-02 1.276E-02 3p 6. -42.91822 1500.471 6.406E+02 3.004E+01 3.735E+00 3.687E-01 1.577E-01 7.538E-02 3.987E-02 1.484E-02 3d 10. -28.67197 3211.847 9.186E+01 1.571E+01 3.533E+00 3.450E-01 1.415E-01 6.772E-02 3.720E-02 1.614E-02 4s 2. -7.67972 56.049 0.000E+00 2.151E+01 1.517E+00 9.135E-01 9.466E-01 1.081E+00 1.351E+00 2.759E+00 4p 6. -4.93679 620.513 1.073E+02 5.518E+00 1.357E+00 1.003E+00 1.155E+00 1.484E+00 2.117E+00 5.851E+00 4d 10. -0.97088 1027.853 8.265E+00 1.797E+00 9.617E-01 1.423E+00 2.491E+00 5.271E+00 1.336E+01 1.402E+02 5s 1. -0.54383 13.935 0.000E+00 1.430E+00 3.996E-01 3.194E+00 1.182E+01 4.997E+01 2.396E+02 7.808E+03 47. 1.318E+04 2.730E+02 3.270E+01 4.837E+01 1.150E+02 3.894E+02 9.251E+03 1. 2.805E+02 5.808E+00 6.958E-01 1.029E+00 2.448E+00 8.284E+00 1.968E+02 --------------------zeta--------------------- nl wnl ----blume-watson---- -----(r*vi)----- i (ryd) eps s evel edar evel+edar erel (ryd) (cm-1) (ryd) (cm-1) 1s 2. 0.00000 0.000 0.00000 0.000-2274.99737 -1876.27311 -398.58109 331.78514 -66.796 -1943.06905 2s 2. 0.00000 0.000 0.00000 0.000 -567.83934 -281.09963 -54.20979 36.23405 -17.976 -299.07536 2p 6. 8.55145 938412.975 8.80402 966129.559 -555.32045 -253.82914 -7.22327 -0.01376 -7.223 -261.05241 3s 2. 0.00000 0.000 0.00000 0.000 -234.94589 -53.63327 -10.56437 6.74688 -3.817 -57.45076 3p 6. 1.49480 164035.364 1.53299 168226.001 -227.35027 -44.48111 -1.64596 -0.00221 -1.646 -46.12707 3d 10. 0.17193 18866.771 0.18431 20225.993 -218.95567 -29.89777 -0.37680 -0.01081 -0.377 -30.27457 4s 2. 0.00000 0.000 0.00000 0.000 -108.25849 -8.44113 -2.06248 1.30199 -0.760 -9.20163 4p 6. 0.25010 27445.332 0.25620 28114.413 -99.42699 -5.65566 -0.29161 -0.00026 -0.292 -5.94727 4d 10. 0.01522 1669.844 0.01617 1774.733 -75.19444 -1.49678 -0.03889 -0.00094 -0.039 -1.53566 5s 1. 0.00000 0.000 0.00000 0.000 -34.86942 -0.59126 -0.12773 0.08048 -0.047 -0.63851 ag i d10 5s nconf= 1 z= 47 ion= 0 kut=-1 exf=0.650 corrf=0.000 ca1=0.700 ca0=0.500 without correlation with correlation ----------------------- ----------------------- nl wnl eps fg eps fgr corr eps fg eps fgr n*r n*rc ect ec----------------- 1s 2. -1885.38302 -1885.38302-0.08290 -1885.46592 -1885.46592 0.0230 0.0230 -0.08267 0.00000-0.08267 2s 2. -284.16413 -284.16413-0.08232 -284.24646 -284.24646 0.0593 0.0593 -0.23110 -0.06744-0.08099 2p 6. -254.79693 -254.79693-0.08242 -254.87935 -254.87935 0.0626 0.0626 -0.72297 -0.08169-0.08186-0.08197-0.08206-0.08218 3s 2. -54.97047 -54.97047-0.08107 -55.05154 -55.05154 0.1349 0.1348 -0.86759 -0.06668-0.07795 3p 6. -45.01557 -45.01557-0.08107 -45.09663 -45.09663 0.1490 0.1489 -1.34526 -0.07880-0.07928-0.07960-0.07983-0.08015 3d 10. -29.22144 -29.22144-0.08120 -29.30264 -29.30264 0.1850 0.1847 -2.15235 -0.08039-0.08049-0.08057-0.08064-0.08095 4s 2. -8.71682 -8.71682-0.07796 -8.79478 -8.79478 0.3387 0.3372 -2.28894 -0.06403-0.07256 4p 6. -5.64136 -5.64136-0.07742 -5.71878 -5.71878 0.4210 0.4182 -2.73484 -0.07233-0.07356-0.07431-0.07484-0.07559 4d 10. -1.11293 -1.11293-0.07420 -1.18713 -1.18713 0.9479 0.9178 -3.45694 -0.06878-0.07061-0.07143-0.07201-0.07384 5s 1. -0.50014 -0.50014-0.05403 -0.55417 -0.55417 1.4140 1.3433 -3.51097 -0.05403 ecorrt= -3.70198 (old) ect= -3.51097 (new) etotrl= 0.00000 + 0.00000 + 0.00000 etot= -10622.03741 -10622.03741 -10625.73939 -10625.73939 -10625.54838 -10625.54838 -10625.54838 ag i d10 5s 1 -10625.5484 0 t(run)= 18.94, t(job)= 18.94 seconds 47 1ag i d10 6s 4d10 6s ag i d10 6s nconf= 2 z= 47 ncores= 9 nvales= 1 ion= 0 r(i)/x(i)=0.24532669 ca1=0.700 tolstb=1.000 tolk-2=1.00000 tolend= 0.5E-07 thresh= 0.1E-10 kut= 0 exf=1.000 corrf=0.000 ca0= 0.500 rcn mod 32 ihf1= 0 mesh=2601 idb= 481 rdb= 100.461 emx= 0.10 r(mesh)=5426.209 irel= 1 ib=2600 t(run)= 12.91, t(job)= 31.85 seconds nl wnl ee az (r-3) (r-2) (r-1) (r+1) (r+2) (r+3) (r+4) (r+6) 1s 2. -1884.89289 881.508 0.000E+00 5.213E+03 4.936E+01 3.112E-02 1.308E-03 6.934E-05 4.438E-06 2.867E-08 2s 2. -280.16456 295.095 0.000E+00 5.731E+02 1.123E+01 1.350E-01 2.146E-02 3.880E-03 7.892E-04 4.505E-05 2p 6. -254.03215 3360.690 3.659E+03 1.600E+02 1.083E+01 1.175E-01 1.683E-02 2.853E-03 5.593E-04 3.126E-05 3s 2. -52.38056 127.553 0.000E+00 1.088E+02 3.931E+00 3.700E-01 1.565E-01 7.318E-02 3.748E-02 1.276E-02 3p 6. -43.27078 1500.441 6.406E+02 3.004E+01 3.735E+00 3.687E-01 1.577E-01 7.538E-02 3.987E-02 1.484E-02 3d 10. -29.02370 3211.684 9.185E+01 1.570E+01 3.533E+00 3.450E-01 1.415E-01 6.773E-02 3.720E-02 1.614E-02 4s 2. -8.03767 56.018 0.000E+00 2.149E+01 1.517E+00 9.139E-01 9.475E-01 1.082E+00 1.354E+00 2.767E+00 4p 6. -5.29642 619.998 1.071E+02 5.510E+00 1.356E+00 1.004E+00 1.156E+00 1.486E+00 2.119E+00 5.844E+00 4d 10. -1.33502 1035.660 8.390E+00 1.822E+00 9.706E-01 1.400E+00 2.385E+00 4.840E+00 1.158E+01 1.034E+02 6s 1. -0.16566 4.893 0.000E+00 1.837E-01 1.367E-01 9.278E+00 9.682E+01 1.108E+03 1.379E+04 2.711E+06 47. 1.318E+04 2.728E+02 3.856E+01 1.323E+02 1.169E+03 1.393E+04 2.712E+06 1. 2.804E+02 5.804E+00 8.205E-01 2.815E+00 2.486E+01 2.963E+02 5.770E+04 --------------------zeta--------------------- nl wnl ----blume-watson---- -----(r*vi)----- i (ryd) eps s evel edar evel+edar erel (ryd) (cm-1) (ryd) (cm-1) 1s 2. 0.00000 0.000 0.00000 0.000-2274.99734 -1876.62931 -398.58175 331.78521 -66.797 -1943.42585 2s 2. 0.00000 0.000 0.00000 0.000 -567.83948 -281.44958 -54.21007 36.23415 -17.976 -299.42549 2p 6. 8.55156 938425.158 8.80414 966143.052 -555.32079 -254.17944 -7.22338 -0.01376 -7.223 -261.40282 3s 2. 0.00000 0.000 0.00000 0.000 -234.94462 -53.98572 -10.56402 6.74665 -3.817 -57.80309 3p 6. 1.49474 164028.528 1.53293 168219.308 -227.34862 -44.83354 -1.64589 -0.00221 -1.646 -46.47943 3d 10. 0.17191 18865.104 0.18430 20224.177 -218.95213 -30.24956 -0.37676 -0.01081 -0.377 -30.62632 4s 2. 0.00000 0.000 0.00000 0.000 -108.22382 -8.79974 -2.06020 1.30055 -0.760 -9.55939 4p 6. 0.24969 27400.001 0.25577 28067.972 -99.38034 -6.01538 -0.29112 -0.00026 -0.291 -6.30650 4d 10. 0.01545 1695.177 0.01642 1801.725 -75.80675 -1.85950 -0.03948 -0.00095 -0.039 -1.89897 6s 1. 0.00000 0.000 0.00000 0.000 -12.44807 -0.14738 -0.01575 0.00992 -0.006 -0.15321 ag i d10 6s nconf= 2 z= 47 ion= 0 kut=-1 exf=0.650 corrf=0.000 ca1=0.700 ca0=0.500 without correlation with correlation ----------------------- ----------------------- nl wnl eps fg eps fgr corr eps fg eps fgr n*r n*rc ect ec----------------- 1s 2. -1885.73859 -1885.73859-0.08290 -1885.82149 -1885.82149 0.0230 0.0230 -0.08267 0.00000-0.08267 2s 2. -284.51298 -284.51298-0.08232 -284.59530 -284.59530 0.0593 0.0593 -0.23110 -0.06744-0.08099 2p 6. -255.14758 -255.14758-0.08242 -255.23000 -255.23000 0.0626 0.0626 -0.72296 -0.08169-0.08186-0.08197-0.08206-0.08218 3s 2. -55.31989 -55.31989-0.08107 -55.40095 -55.40095 0.1344 0.1344 -0.86759 -0.06668-0.07795 3p 6. -45.36732 -45.36732-0.08107 -45.44838 -45.44838 0.1485 0.1483 -1.34526 -0.07880-0.07928-0.07960-0.07983-0.08015 3d 10. -29.57441 -29.57441-0.08120 -29.65561 -29.65561 0.1839 0.1836 -2.15235 -0.08039-0.08049-0.08057-0.08064-0.08095 4s 2. -9.07074 -9.07074-0.07796 -9.14870 -9.14870 0.3320 0.3306 -2.28891 -0.06401-0.07255 4p 6. -6.00573 -6.00573-0.07741 -6.08314 -6.08314 0.4081 0.4054 -2.73478 -0.07233-0.07355-0.07430-0.07484-0.07559 4d 10. -1.48101 -1.48101-0.07409 -1.55511 -1.55511 0.8217 0.8019 -3.45965 -0.06928-0.07093-0.07172-0.07228-0.07406 6s 1. -0.15946 -0.15946-0.00747 -0.16693 -0.16693 2.5043 2.4476 -3.46713 -0.00747 ecorrt= -3.65423 (old) ect= -3.46713 (new) etotrl= 0.00000 + 0.00000 + 0.00000 etot= -10621.73387 -10621.73387 -10625.38810 -10625.38810 -10625.20100 -10625.20100 -10625.20100 ag i d10 6s 1 -10625.2010 0 t(run)= 16.84, t(job)= 35.77 seconds 47 1ag i d10 7s 4d10 7s ag i d10 7s nconf= 3 z= 47 ncores= 9 nvales= 1 ion= 0 r(i)/x(i)=0.24532669 ca1=0.700 tolstb=1.000 tolk-2=1.00000 tolend= 0.5E-07 thresh= 0.1E-10 kut= 0 exf=1.000 corrf=0.000 ca0= 0.500 rcn mod 32 ihf1= 0 mesh=2601 idb= 481 rdb= 100.461 emx= 0.10 r(mesh)=5426.209 irel= 1 ib=2600 t(run)= 12.84, t(job)= 48.61 seconds nl wnl ee az (r-3) (r-2) (r-1) (r+1) (r+2) (r+3) (r+4) (r+6) 1s 2. -1885.00832 881.508 0.000E+00 5.213E+03 4.936E+01 3.112E-02 1.308E-03 6.934E-05 4.438E-06 2.867E-08 2s 2. -280.27947 295.095 0.000E+00 5.731E+02 1.123E+01 1.350E-01 2.146E-02 3.880E-03 7.892E-04 4.505E-05 2p 6. -254.14710 3360.691 3.659E+03 1.600E+02 1.083E+01 1.175E-01 1.683E-02 2.853E-03 5.593E-04 3.126E-05 3s 2. -52.49564 127.553 0.000E+00 1.088E+02 3.931E+00 3.700E-01 1.565E-01 7.318E-02 3.748E-02 1.276E-02 3p 6. -43.38585 1500.440 6.406E+02 3.004E+01 3.735E+00 3.687E-01 1.577E-01 7.538E-02 3.987E-02 1.484E-02 3d 10. -29.13872 3211.675 9.185E+01 1.570E+01 3.533E+00 3.450E-01 1.415E-01 6.773E-02 3.720E-02 1.614E-02 4s 2. -8.15296 56.016 0.000E+00 2.149E+01 1.517E+00 9.139E-01 9.475E-01 1.082E+00 1.354E+00 2.767E+00 4p 6. -5.41180 619.975 1.071E+02 5.509E+00 1.356E+00 1.004E+00 1.156E+00 1.486E+00 2.119E+00 5.842E+00 4d 10. -1.45049 1036.263 8.399E+00 1.824E+00 9.713E-01 1.398E+00 2.378E+00 4.814E+00 1.148E+01 1.015E+02 7s 1. -0.08293 2.893 0.000E+00 6.459E-02 7.252E-02 1.824E+01 3.729E+02 8.199E+03 1.915E+05 1.232E+08 47. 1.318E+04 2.727E+02 4.751E+01 4.083E+02 8.260E+03 1.916E+05 1.232E+08 1. 2.804E+02 5.803E+00 1.011E+00 8.688E+00 1.757E+02 4.076E+03 2.621E+06 --------------------zeta--------------------- nl wnl ----blume-watson---- -----(r*vi)----- i (ryd) eps s evel edar evel+edar erel (ryd) (cm-1) (ryd) (cm-1) 1s 2. 0.00000 0.000 0.00000 0.000-2274.99732 -1876.74474 -398.58177 331.78507 -66.797 -1943.54144 2s 2. 0.00000 0.000 0.00000 0.000 -567.83949 -281.56450 -54.21009 36.23415 -17.976 -299.54044 2p 6. 8.55157 938426.212 8.80415 966144.220 -555.32082 -254.29440 -7.22339 -0.01376 -7.223 -261.51779 3s 2. 0.00000 0.000 0.00000 0.000 -234.94458 -54.10078 -10.56400 6.74663 -3.817 -57.91815 3p 6. 1.49474 164028.222 1.53292 168219.022 -227.34856 -44.94860 -1.64589 -0.00221 -1.646 -46.59448 3d 10. 0.17191 18865.014 0.18430 20224.079 -218.95195 -30.36457 -0.37676 -0.01081 -0.377 -30.74133 4s 2. 0.00000 0.000 0.00000 0.000 -108.22206 -8.91507 -2.06008 1.30047 -0.760 -9.67468 4p 6. 0.24967 27397.959 0.25576 28065.881 -99.37850 -6.13075 -0.29110 -0.00026 -0.291 -6.42185 4d 10. 0.01547 1697.140 0.01644 1803.816 -75.85023 -1.97491 -0.03953 -0.00095 -0.040 -2.01444 7s 1. 0.00000 0.000 0.00000 0.000 -6.65219 -0.07088 -0.00551 0.00347 -0.002 -0.07291 ag i d10 7s nconf= 3 z= 47 ion= 0 kut=-1 exf=0.650 corrf=0.000 ca1=0.700 ca0=0.500 without correlation with correlation ----------------------- ----------------------- nl wnl eps fg eps fgr corr eps fg eps fgr n*r n*rc ect ec----------------- 1s 2. -1885.85397 -1885.85397-0.08290 -1885.93688 -1885.93688 0.0230 0.0230 -0.08267 0.00000-0.08267 2s 2. -284.62780 -284.62780-0.08232 -284.71012 -284.71012 0.0593 0.0593 -0.23110 -0.06744-0.08099 2p 6. -255.26256 -255.26256-0.08242 -255.34498 -255.34498 0.0626 0.0626 -0.72296 -0.08169-0.08186-0.08197-0.08206-0.08218 3s 2. -55.43468 -55.43468-0.08107 -55.51575 -55.51575 0.1343 0.1342 -0.86759 -0.06668-0.07795 3p 6. -45.48232 -45.48232-0.08107 -45.56338 -45.56338 0.1483 0.1481 -1.34526 -0.07880-0.07928-0.07960-0.07983-0.08015 3d 10. -29.68952 -29.68952-0.08120 -29.77072 -29.77072 0.1835 0.1833 -2.15235 -0.08039-0.08049-0.08057-0.08064-0.08095 4s 2. -9.18562 -9.18562-0.07796 -9.26358 -9.26358 0.3299 0.3286 -2.28891 -0.06401-0.07255 4p 6. -6.12141 -6.12141-0.07741 -6.19882 -6.19882 0.4042 0.4016 -2.73478 -0.07233-0.07355-0.07430-0.07484-0.07559 4d 10. -1.59681 -1.59681-0.07409 -1.67090 -1.67090 0.7914 0.7736 -3.45983 -0.06931-0.07095-0.07174-0.07229-0.07407 7s 1. -0.08079 -0.08079-0.00233 -0.08312 -0.08312 3.5183 3.4686 -3.46216 -0.00233 ecorrt= -3.64901 (old) ect= -3.46216 (new) etotrl= 0.00000 + 0.00000 + 0.00000 etot= -10621.65713 -10621.65713 -10625.30613 -10625.30613 -10625.11928 -10625.11928 -10625.11928 ag i d10 7s 1 -10625.1193 0 t(run)= 16.86, t(job)= 52.63 seconds 47 1ag i d10 8s 4d10 8s ag i d10 8s nconf= 4 z= 47 ncores= 9 nvales= 1 ion= 0 r(i)/x(i)=0.24532669 ca1=0.700 tolstb=1.000 tolk-2=1.00000 tolend= 0.5E-07 thresh= 0.1E-10 kut= 0 exf=1.000 corrf=0.000 ca0= 0.500 rcn mod 32 ihf1= 0 mesh=2601 idb= 481 rdb= 100.461 emx= 0.10 r(mesh)=5426.209 irel= 1 ib=2600 t(run)= 13.79, t(job)= 66.42 seconds nl wnl ee az (r-3) (r-2) (r-1) (r+1) (r+2) (r+3) (r+4) (r+6) 1s 2. -1885.05975 881.507 0.000E+00 5.213E+03 4.936E+01 3.112E-02 1.308E-03 6.934E-05 4.438E-06 2.867E-08 2s 2. -280.33077 295.095 0.000E+00 5.731E+02 1.123E+01 1.350E-01 2.146E-02 3.880E-03 7.892E-04 4.505E-05 2p 6. -254.19841 3360.692 3.659E+03 1.600E+02 1.083E+01 1.175E-01 1.683E-02 2.853E-03 5.593E-04 3.126E-05 3s 2. -52.54697 127.553 0.000E+00 1.088E+02 3.931E+00 3.700E-01 1.565E-01 7.318E-02 3.748E-02 1.276E-02 3p 6. -43.43719 1500.439 6.406E+02 3.004E+01 3.735E+00 3.687E-01 1.577E-01 7.538E-02 3.987E-02 1.484E-02 3d 10. -29.19003 3211.672 9.185E+01 1.570E+01 3.533E+00 3.450E-01 1.415E-01 6.773E-02 3.720E-02 1.614E-02 4s 2. -8.20435 56.016 0.000E+00 2.149E+01 1.516E+00 9.139E-01 9.475E-01 1.082E+00 1.354E+00 2.767E+00 4p 6. -5.46320 619.969 1.071E+02 5.509E+00 1.356E+00 1.004E+00 1.156E+00 1.486E+00 2.119E+00 5.842E+00 4d 10. -1.50192 1036.431 8.402E+00 1.825E+00 9.715E-01 1.398E+00 2.376E+00 4.808E+00 1.145E+01 1.010E+02 8s 1. -0.04988 1.974 0.000E+00 3.015E-02 4.500E-02 3.019E+01 1.019E+03 3.667E+04 1.385E+06 2.240E+09 47. 1.318E+04 2.727E+02 5.946E+01 1.055E+03 3.673E+04 1.385E+06 2.240E+09 1. 2.804E+02 5.802E+00 1.265E+00 2.244E+01 7.814E+02 2.946E+04 4.766E+07 --------------------zeta--------------------- nl wnl ----blume-watson---- -----(r*vi)----- i (ryd) eps s evel edar evel+edar erel (ryd) (cm-1) (ryd) (cm-1) 1s 2. 0.00000 0.000 0.00000 0.000-2274.99731 -1876.79618 -398.58176 331.78500 -66.797 -1943.59294 2s 2. 0.00000 0.000 0.00000 0.000 -567.83950 -281.61580 -54.21010 36.23414 -17.976 -299.59175 2p 6. 8.55157 938426.512 8.80416 966144.554 -555.32083 -254.34571 -7.22339 -0.01376 -7.223 -261.56910 3s 2. 0.00000 0.000 0.00000 0.000 -234.94456 -54.15211 -10.56400 6.74663 -3.817 -57.96948 3p 6. 1.49473 164028.151 1.53292 168218.957 -227.34854 -44.99993 -1.64589 -0.00221 -1.646 -46.64581 3d 10. 0.17191 18864.991 0.18430 20224.054 -218.95191 -30.41589 -0.37676 -0.01081 -0.377 -30.79265 4s 2. 0.00000 0.000 0.00000 0.000 -108.22162 -8.96647 -2.06005 1.30045 -0.760 -9.72606 4p 6. 0.24966 27397.464 0.25575 28065.374 -99.37807 -6.18215 -0.29110 -0.00026 -0.291 -6.47325 4d 10. 0.01547 1697.686 0.01644 1804.397 -75.86221 -2.02631 -0.03954 -0.00095 -0.040 -2.06585 8s 1. 0.00000 0.000 0.00000 0.000 -4.14180 -0.04194 -0.00256 0.00162 -0.001 -0.04289 ag i d10 8s nconf= 4 z= 47 ion= 0 kut=-1 exf=0.650 corrf=0.000 ca1=0.700 ca0=0.500 without correlation with correlation ----------------------- ----------------------- nl wnl eps fg eps fgr corr eps fg eps fgr n*r n*rc ect ec----------------- 1s 2. -1885.90539 -1885.90539-0.08290 -1885.98830 -1885.98830 0.0230 0.0230 -0.08267 0.00000-0.08267 2s 2. -284.67907 -284.67907-0.08232 -284.76139 -284.76139 0.0593 0.0593 -0.23110 -0.06744-0.08099 2p 6. -255.31388 -255.31388-0.08242 -255.39630 -255.39630 0.0626 0.0626 -0.72296 -0.08169-0.08186-0.08197-0.08206-0.08218 3s 2. -55.48594 -55.48594-0.08107 -55.56700 -55.56700 0.1342 0.1342 -0.86759 -0.06668-0.07795 3p 6. -45.53363 -45.53363-0.08107 -45.61470 -45.61470 0.1482 0.1481 -1.34526 -0.07880-0.07928-0.07960-0.07983-0.08015 3d 10. -29.74087 -29.74087-0.08120 -29.82206 -29.82206 0.1834 0.1831 -2.15235 -0.08039-0.08049-0.08057-0.08064-0.08095 4s 2. -9.23688 -9.23688-0.07796 -9.31484 -9.31484 0.3290 0.3277 -2.28891 -0.06401-0.07255 4p 6. -6.17290 -6.17290-0.07741 -6.25031 -6.25031 0.4025 0.4000 -2.73478 -0.07233-0.07355-0.07430-0.07484-0.07559 4d 10. -1.64832 -1.64832-0.07408 -1.72241 -1.72241 0.7789 0.7620 -3.45988 -0.06932-0.07096-0.07175-0.07230-0.07407 8s 1. -0.04887 -0.04887-0.00105 -0.04992 -0.04992 4.5238 4.4759 -3.46093 -0.00105 ecorrt= -3.64769 (old) ect= -3.46093 (new) etotrl= 0.00000 + 0.00000 + 0.00000 etot= -10621.62571 -10621.62571 -10625.27341 -10625.27341 -10625.08664 -10625.08664 -10625.08664 ag i d10 8s 1 -10625.0866 0 t(run)= 17.75, t(job)= 70.38 seconds 47 1ag i d10 9s 4d10 9s ag i d10 9s nconf= 5 z= 47 ncores= 9 nvales= 1 ion= 0 r(i)/x(i)=0.24532669 ca1=0.700 tolstb=1.000 tolk-2=1.00000 tolend= 0.5E-07 thresh= 0.1E-10 kut= 0 exf=1.000 corrf=0.000 ca0= 0.500 rcn mod 32 ihf1= 0 mesh=2601 idb= 481 rdb= 100.461 emx= 0.10 r(mesh)=5426.209 irel= 1 ib=2600 t(run)= 13.98, t(job)= 84.36 seconds nl wnl ee az (r-3) (r-2) (r-1) (r+1) (r+2) (r+3) (r+4) (r+6) 1s 2. -1885.08706 881.507 0.000E+00 5.213E+03 4.936E+01 3.112E-02 1.308E-03 6.934E-05 4.438E-06 2.867E-08 2s 2. -280.35802 295.095 0.000E+00 5.731E+02 1.123E+01 1.350E-01 2.146E-02 3.880E-03 7.892E-04 4.505E-05 2p 6. -254.22567 3360.692 3.659E+03 1.600E+02 1.083E+01 1.175E-01 1.683E-02 2.853E-03 5.593E-04 3.126E-05 3s 2. -52.57424 127.553 0.000E+00 1.088E+02 3.931E+00 3.700E-01 1.565E-01 7.318E-02 3.748E-02 1.276E-02 3p 6. -43.46446 1500.439 6.406E+02 3.004E+01 3.735E+00 3.687E-01 1.577E-01 7.538E-02 3.987E-02 1.484E-02 3d 10. -29.21730 3211.671 9.185E+01 1.570E+01 3.533E+00 3.450E-01 1.415E-01 6.773E-02 3.720E-02 1.614E-02 4s 2. -8.23163 56.016 0.000E+00 2.149E+01 1.516E+00 9.139E-01 9.475E-01 1.082E+00 1.354E+00 2.767E+00 4p 6. -5.49050 619.967 1.071E+02 5.509E+00 1.356E+00 1.004E+00 1.156E+00 1.486E+00 2.119E+00 5.842E+00 4d 10. -1.52922 1036.497 8.403E+00 1.825E+00 9.715E-01 1.397E+00 2.376E+00 4.805E+00 1.144E+01 1.008E+02 9s 1. -0.03330 1.459 0.000E+00 1.648E-02 3.063E-02 4.514E+01 2.274E+03 1.215E+05 6.775E+06 2.334E+10 47. 1.318E+04 2.727E+02 7.440E+01 2.310E+03 1.216E+05 6.775E+06 2.334E+10 1. 2.804E+02 5.802E+00 1.583E+00 4.914E+01 2.587E+03 1.441E+05 4.967E+08 --------------------zeta--------------------- nl wnl ----blume-watson---- -----(r*vi)----- i (ryd) eps s evel edar evel+edar erel (ryd) (cm-1) (ryd) (cm-1) 1s 2. 0.00000 0.000 0.00000 0.000-2274.99730 -1876.82349 -398.58176 331.78496 -66.797 -1943.62029 2s 2. 0.00000 0.000 0.00000 0.000 -567.83950 -281.64306 -54.21010 36.23414 -17.976 -299.61901 2p 6. 8.55157 938426.631 8.80416 966144.686 -555.32083 -254.37297 -7.22339 -0.01376 -7.223 -261.59636 3s 2. 0.00000 0.000 0.00000 0.000 -234.94456 -54.17938 -10.56400 6.74663 -3.817 -57.99675 3p 6. 1.49473 164028.126 1.53292 168218.934 -227.34854 -45.02720 -1.64589 -0.00221 -1.646 -46.67308 3d 10. 0.17191 18864.983 0.18430 20224.045 -218.95189 -30.44315 -0.37676 -0.01081 -0.377 -30.81991 4s 2. 0.00000 0.000 0.00000 0.000 -108.22145 -8.99376 -2.06004 1.30045 -0.760 -9.75335 4p 6. 0.24966 27397.282 0.25575 28065.188 -99.37792 -6.20945 -0.29109 -0.00026 -0.291 -6.50054 4d 10. 0.01547 1697.900 0.01644 1804.624 -75.86686 -2.05360 -0.03954 -0.00095 -0.040 -2.09315 9s 1. 0.00000 0.000 0.00000 0.000 -2.82559 -0.02776 -0.00140 0.00088 -0.001 -0.02828 ag i d10 9s nconf= 5 z= 47 ion= 0 kut=-1 exf=0.650 corrf=0.000 ca1=0.700 ca0=0.500 without correlation with correlation ----------------------- ----------------------- nl wnl eps fg eps fgr corr eps fg eps fgr n*r n*rc ect ec----------------- 1s 2. -1885.93270 -1885.93270-0.08290 -1886.01560 -1886.01560 0.0230 0.0230 -0.08267 0.00000-0.08267 2s 2. -284.70631 -284.70631-0.08232 -284.78864 -284.78864 0.0593 0.0593 -0.23110 -0.06744-0.08099 2p 6. -255.34114 -255.34114-0.08242 -255.42356 -255.42356 0.0626 0.0626 -0.72296 -0.08169-0.08186-0.08197-0.08206-0.08218 3s 2. -55.51318 -55.51318-0.08107 -55.59424 -55.59424 0.1342 0.1341 -0.86759 -0.06668-0.07795 3p 6. -45.56090 -45.56090-0.08107 -45.64196 -45.64196 0.1482 0.1480 -1.34526 -0.07880-0.07928-0.07960-0.07983-0.08015 3d 10. -29.76814 -29.76814-0.08120 -29.84934 -29.84934 0.1833 0.1830 -2.15235 -0.08039-0.08049-0.08057-0.08064-0.08095 4s 2. -9.26412 -9.26412-0.07796 -9.34208 -9.34208 0.3285 0.3272 -2.28891 -0.06401-0.07255 4p 6. -6.20023 -6.20023-0.07741 -6.27764 -6.27764 0.4016 0.3991 -2.73478 -0.07233-0.07355-0.07430-0.07484-0.07559 4d 10. -1.67566 -1.67566-0.07408 -1.74974 -1.74974 0.7725 0.7560 -3.45989 -0.06933-0.07096-0.07175-0.07230-0.07408 9s 1. -0.03275 -0.03275-0.00056 -0.03331 -0.03331 5.5260 5.4789 -3.46046 -0.00056 ecorrt= -3.64719 (old) ect= -3.46046 (new) etotrl= 0.00000 + 0.00000 + 0.00000 etot= -10621.60979 -10621.60979 -10625.25698 -10625.25698 -10625.07025 -10625.07025 -10625.07025 ag i d10 9s 1 -10625.0702 0 t(run)= 18.23, t(job)= 88.61 seconds 47 1ag i d9 5s2 4d9 5s2 ag i d9 5s2 nconf= 6 z= 47 ncores= 9 nvales= 1 ion= 0 r(i)/x(i)=0.24532669 ca1=0.700 tolstb=1.000 tolk-2=1.00000 tolend= 0.5E-07 thresh= 0.1E-10 kut= 0 exf=1.000 corrf=0.000 ca0= 0.500 rcn mod 32 ihf1= 0 mesh=2601 idb= 481 rdb= 100.461 emx= 0.10 r(mesh)=5426.209 irel= 1 ib=2600 t(run)= 9.95, t(job)= 98.55 seconds nl wnl ee az (r-3) (r-2) (r-1) (r+1) (r+2) (r+3) (r+4) (r+6) 1s 2. -1884.85593 881.505 0.000E+00 5.213E+03 4.936E+01 3.112E-02 1.308E-03 6.934E-05 4.438E-06 2.867E-08 2s 2. -280.14926 295.092 0.000E+00 5.731E+02 1.123E+01 1.350E-01 2.146E-02 3.880E-03 7.892E-04 4.505E-05 2p 6. -254.01517 3360.592 3.659E+03 1.600E+02 1.083E+01 1.175E-01 1.684E-02 2.853E-03 5.593E-04 3.126E-05 3s 2. -52.35798 127.559 0.000E+00 1.088E+02 3.931E+00 3.700E-01 1.565E-01 7.317E-02 3.748E-02 1.276E-02 3p 6. -43.24829 1500.515 6.406E+02 3.005E+01 3.735E+00 3.687E-01 1.577E-01 7.538E-02 3.986E-02 1.483E-02 3d 10. -29.00376 3212.112 9.187E+01 1.571E+01 3.533E+00 3.449E-01 1.415E-01 6.770E-02 3.719E-02 1.613E-02 4s 2. -7.99456 56.182 0.000E+00 2.161E+01 1.521E+00 9.112E-01 9.414E-01 1.071E+00 1.332E+00 2.683E+00 4p 6. -5.24329 623.503 1.083E+02 5.566E+00 1.363E+00 9.982E-01 1.142E+00 1.455E+00 2.055E+00 5.527E+00 4d 9. -1.24750 1066.470 8.877E+00 1.911E+00 9.963E-01 1.359E+00 2.241E+00 4.386E+00 1.012E+01 8.474E+01 5s 2. -0.59050 15.291 0.000E+00 1.705E+00 4.257E-01 3.024E+00 1.060E+01 4.238E+01 1.922E+02 5.613E+03 47. 1.318E+04 2.728E+02 3.353E+01 5.292E+01 1.364E+02 4.912E+02 1.203E+04 1. 2.805E+02 5.805E+00 7.135E-01 1.126E+00 2.902E+00 1.045E+01 2.559E+02 --------------------zeta--------------------- nl wnl ----blume-watson---- -----(r*vi)----- i (ryd) eps s evel edar evel+edar erel (ryd) (cm-1) (ryd) (cm-1) 1s 2. 0.00000 0.000 0.00000 0.000-2274.99718 -1876.59213 -398.57915 331.78319 -66.796 -1943.38809 2s 2. 0.00000 0.000 0.00000 0.000 -567.83880 -281.43378 -54.20889 36.23349 -17.975 -299.40918 2p 6. 8.55116 938380.855 8.80370 966094.597 -555.31946 -254.16228 -7.22298 -0.01378 -7.223 -261.38526 3s 2. 0.00000 0.000 0.00000 0.000 -234.94775 -53.96366 -10.56492 6.74723 -3.818 -57.78135 3p 6. 1.49490 164046.194 1.53308 168236.463 -227.35268 -44.81154 -1.64607 -0.00221 -1.646 -46.45761 3d 10. 0.17195 18869.586 0.18434 20229.084 -218.96163 -30.22952 -0.37686 -0.01081 -0.377 -30.60638 4s 2. 0.00000 0.000 0.00000 0.000 -108.42107 -8.75190 -2.07228 1.30817 -0.764 -9.51601 4p 6. 0.25251 27709.804 0.25867 28385.433 -99.74795 -5.95850 -0.29444 -0.00026 -0.294 -6.25294 4d 9. 0.01637 1796.313 0.01740 1908.916 -77.41350 -1.78400 -0.04186 -0.00100 -0.042 -1.82587 5s 2. 0.00000 0.000 0.00000 0.000 -36.79686 -0.72014 -0.15382 0.09691 -0.057 -0.77706 ag i d9 5s2 nconf= 6 z= 47 ion= 0 kut=-1 exf=0.650 corrf=0.000 ca1=0.700 ca0=0.500 without correlation with correlation ----------------------- ----------------------- nl wnl eps fg eps fgr corr eps fg eps fgr n*r n*rc ect ec----------------- 1s 2. -1885.70325 -1885.70325-0.08290 -1885.78616 -1885.78616 0.0230 0.0230 -0.08267 0.00000-0.08267 2s 2. -284.50007 -284.50007-0.08232 -284.58239 -284.58239 0.0593 0.0593 -0.23110 -0.06744-0.08099 2p 6. -255.12952 -255.12952-0.08242 -255.21194 -255.21194 0.0626 0.0626 -0.72296 -0.08169-0.08186-0.08197-0.08206-0.08218 3s 2. -55.30626 -55.30626-0.08107 -55.38733 -55.38733 0.1345 0.1344 -0.86760 -0.06668-0.07795 3p 6. -45.34767 -45.34767-0.08107 -45.42873 -45.42873 0.1485 0.1484 -1.34526 -0.07880-0.07928-0.07960-0.07983-0.08016 3d 10. -29.55027 -29.55027-0.08120 -29.63147 -29.63147 0.1840 0.1837 -2.15235 -0.08039-0.08049-0.08057-0.08064-0.08095 4s 2. -9.02788 -9.02788-0.07794 -9.10583 -9.10583 0.3328 0.3314 -2.28910 -0.06415-0.07260 4p 6. -5.91968 -5.91968-0.07742 -5.99709 -5.99709 0.4110 0.4083 -2.73539 -0.07242-0.07363-0.07437-0.07490-0.07565 4d 9. -1.39747 -1.39747-0.07474 -1.47222 -1.47222 0.8459 0.8242 -3.38977 -0.06995-0.07141-0.07214-0.07266-0.07415 5s 2. -0.56281 -0.56281-0.05878 -0.62159 -0.62159 1.3330 1.2684 -3.50242 -0.05388-0.05878 ecorrt= -3.69610 (old) ect= -3.50242 (new) etotrl= 0.00000 + 0.00000 + 0.00000 etot= -10621.76168 -10621.76168 -10625.45778 -10625.45778 -10625.26410 -10625.26410 -10625.26410 ag i d9 5s2 2 -10625.2641 0 1.7963 2 t(run)= 14.43, t(job)= 103.04 seconds 47 1ag i d9 5s6s 4d9 5s 6s ag i d9 5s6s nconf= 7 z= 47 ncores=10 nvales= 1 ion= 0 r(i)/x(i)=0.24532669 ca1=0.700 tolstb=1.000 tolk-2=1.00000 tolend= 0.5E-07 thresh= 0.1E-10 kut= 0 exf=1.000 corrf=0.000 ca0= 0.500 rcn mod 32 ihf1= 0 mesh=2601 idb= 481 rdb= 100.461 emx= 0.10 r(mesh)=5426.209 irel= 1 ib=2600 t(run)= 11.59, t(job)= 114.63 seconds nl wnl ee az (r-3) (r-2) (r-1) (r+1) (r+2) (r+3) (r+4) (r+6) 1s 2. -1885.22204 881.505 0.000E+00 5.213E+03 4.936E+01 3.112E-02 1.308E-03 6.934E-05 4.438E-06 2.867E-08 2s 2. -280.51023 295.093 0.000E+00 5.731E+02 1.123E+01 1.350E-01 2.146E-02 3.880E-03 7.892E-04 4.505E-05 2p 6. -254.37650 3360.613 3.659E+03 1.600E+02 1.083E+01 1.175E-01 1.684E-02 2.853E-03 5.593E-04 3.126E-05 3s 2. -52.72059 127.558 0.000E+00 1.088E+02 3.931E+00 3.700E-01 1.565E-01 7.317E-02 3.748E-02 1.276E-02 3p 6. -43.61088 1500.501 6.406E+02 3.005E+01 3.735E+00 3.687E-01 1.577E-01 7.538E-02 3.986E-02 1.483E-02 3d 10. -29.36577 3212.022 9.187E+01 1.571E+01 3.533E+00 3.449E-01 1.415E-01 6.771E-02 3.719E-02 1.613E-02 4s 2. -8.35938 56.167 0.000E+00 2.160E+01 1.520E+00 9.114E-01 9.418E-01 1.071E+00 1.333E+00 2.684E+00 4p 6. -5.60885 623.308 1.083E+02 5.563E+00 1.363E+00 9.983E-01 1.142E+00 1.455E+00 2.053E+00 5.501E+00 4d 9. -1.61368 1072.884 8.982E+00 1.932E+00 1.003E+00 1.344E+00 2.176E+00 4.144E+00 9.205E+00 6.909E+01 5s 1. -0.94686 16.964 0.000E+00 2.081E+00 4.640E-01 2.757E+00 8.637E+00 3.023E+01 1.175E+02 2.397E+03 6s 1. -0.17384 5.107 0.000E+00 1.993E-01 1.423E-01 8.857E+00 8.822E+01 9.655E+02 1.152E+04 2.092E+06 47. 1.318E+04 2.726E+02 3.896E+01 1.280E+02 1.045E+03 1.174E+04 2.095E+06 1. 2.805E+02 5.801E+00 8.290E-01 2.723E+00 2.224E+01 2.497E+02 4.458E+04 --------------------zeta--------------------- nl wnl ----blume-watson---- -----(r*vi)----- i (ryd) eps s evel edar evel+edar erel (ryd) (cm-1) (ryd) (cm-1) 1s 2. 0.00000 0.000 0.00000 0.000-2274.99714 -1876.95834 -398.57966 331.78312 -66.797 -1943.75487 2s 2. 0.00000 0.000 0.00000 0.000 -567.83895 -281.79486 -54.20914 36.23358 -17.976 -299.77043 2p 6. 8.55125 938391.011 8.80380 966105.871 -555.31976 -254.52367 -7.22308 -0.01377 -7.223 -261.74674 3s 2. 0.00000 0.000 0.00000 0.000 -234.94722 -54.32613 -10.56476 6.74711 -3.818 -58.14377 3p 6. 1.49487 164042.943 1.53306 168233.399 -227.35199 -45.17400 -1.64604 -0.00221 -1.646 -46.82003 3d 10. 0.17194 18868.652 0.18433 20228.065 -218.95978 -30.59154 -0.37684 -0.01081 -0.377 -30.96838 4s 2. 0.00000 0.000 0.00000 0.000 -108.40535 -9.11704 -2.07118 1.30748 -0.764 -9.88075 4p 6. 0.25235 27692.530 0.25851 28367.744 -99.73378 -6.32395 -0.29425 -0.00026 -0.294 -6.61821 4d 9. 0.01657 1817.804 0.01760 1931.812 -77.86994 -2.14914 -0.04237 -0.00102 -0.042 -2.19151 5s 1. 0.00000 0.000 0.00000 0.000 -39.63911 -1.01677 -0.18931 0.11926 -0.070 -1.08682 6s 1. 0.00000 0.000 0.00000 0.000 -12.94206 -0.16049 -0.01716 0.01081 -0.006 -0.16685 ag i d9 5s6s nconf= 7 z= 47 ion= 0 kut=-1 exf=0.650 corrf=0.000 ca1=0.700 ca0=0.500 without correlation with correlation ----------------------- ----------------------- nl wnl eps fg eps fgr corr eps fg eps fgr n*r n*rc ect ec----------------- 1s 2. -1886.06892 -1886.06892-0.08290 -1886.15182 -1886.15182 0.0230 0.0230 -0.08267 0.00000-0.08267 2s 2. -284.86014 -284.86014-0.08232 -284.94247 -284.94247 0.0592 0.0592 -0.23110 -0.06744-0.08099 2p 6. -255.49118 -255.49118-0.08242 -255.57360 -255.57360 0.0626 0.0626 -0.72296 -0.08169-0.08186-0.08197-0.08206-0.08218 3s 2. -55.66610 -55.66610-0.08107 -55.74717 -55.74717 0.1340 0.1339 -0.86760 -0.06668-0.07795 3p 6. -45.70960 -45.70960-0.08107 -45.79066 -45.79066 0.1479 0.1478 -1.34526 -0.07880-0.07928-0.07960-0.07983-0.08015 3d 10. -29.91319 -29.91319-0.08120 -29.99439 -29.99439 0.1828 0.1826 -2.15235 -0.08039-0.08049-0.08057-0.08064-0.08095 4s 2. -9.38829 -9.38829-0.07794 -9.46623 -9.46623 0.3264 0.3250 -2.28909 -0.06414-0.07260 4p 6. -6.28783 -6.28783-0.07741 -6.36524 -6.36524 0.3988 0.3964 -2.73538 -0.07242-0.07363-0.07437-0.07490-0.07565 4d 9. -1.76553 -1.76553-0.07469 -1.84023 -1.84023 0.7526 0.7372 -3.39147 -0.07027-0.07163-0.07233-0.07284-0.07430 5s 1. -0.90354 -0.90354-0.05815 -0.96169 -0.96169 1.0520 1.0197 -3.44849 -0.05702 6s 1. -0.17417 -0.17417-0.01270 -0.18687 -0.18687 2.3961 2.3133 -3.46119 -0.01270 ecorrt= -3.64885 (old) ect= -3.46119 (new) etotrl= 0.00000 + 0.00000 + 0.00000 etot= -10621.40848 -10621.40848 -10625.05733 -10625.05733 -10624.86966 -10624.86966 -10624.86966 ag i d9 5s6s 5 -10624.8697 0 1.8178 2 14.0423 4 1.0404 4 1.9921 4 t(run)= 16.25, t(job)= 119.29 seconds 47 1ag i d9 5s7s 4d9 5s 7s ag i d9 5s7s nconf= 8 z= 47 ncores=10 nvales= 1 ion= 0 r(i)/x(i)=0.24532669 ca1=0.700 tolstb=1.000 tolk-2=1.00000 tolend= 0.5E-07 thresh= 0.1E-10 kut= 0 exf=1.000 corrf=0.000 ca0= 0.500 rcn mod 32 ihf1= 0 mesh=2601 idb= 481 rdb= 100.461 emx= 0.10 r(mesh)=5426.209 irel= 1 ib=2600 t(run)= 13.45, t(job)= 132.74 seconds nl wnl ee az (r-3) (r-2) (r-1) (r+1) (r+2) (r+3) (r+4) (r+6) 1s 2. -1885.34286 881.505 0.000E+00 5.213E+03 4.936E+01 3.112E-02 1.308E-03 6.934E-05 4.438E-06 2.867E-08 2s 2. -280.63066 295.093 0.000E+00 5.731E+02 1.123E+01 1.350E-01 2.146E-02 3.880E-03 7.892E-04 4.505E-05 2p 6. -254.49697 3360.614 3.659E+03 1.600E+02 1.083E+01 1.175E-01 1.684E-02 2.853E-03 5.593E-04 3.126E-05 3s 2. -52.84109 127.558 0.000E+00 1.088E+02 3.931E+00 3.700E-01 1.565E-01 7.317E-02 3.748E-02 1.276E-02 3p 6. -43.73137 1500.501 6.406E+02 3.005E+01 3.735E+00 3.687E-01 1.577E-01 7.538E-02 3.986E-02 1.483E-02 3d 10. -29.48623 3212.019 9.187E+01 1.571E+01 3.533E+00 3.449E-01 1.415E-01 6.771E-02 3.719E-02 1.613E-02 4s 2. -8.47985 56.166 0.000E+00 2.160E+01 1.520E+00 9.114E-01 9.418E-01 1.071E+00 1.333E+00 2.683E+00 4p 6. -5.72934 623.306 1.083E+02 5.563E+00 1.363E+00 9.982E-01 1.142E+00 1.455E+00 2.052E+00 5.498E+00 4d 9. -1.73405 1073.350 8.990E+00 1.933E+00 1.004E+00 1.343E+00 2.172E+00 4.130E+00 9.153E+00 6.824E+01 5s 1. -1.06289 17.069 0.000E+00 2.106E+00 4.664E-01 2.741E+00 8.523E+00 2.953E+01 1.134E+02 2.232E+03 7s 1. -0.08582 3.026 0.000E+00 7.025E-02 7.495E-02 1.763E+01 3.485E+02 7.415E+03 1.677E+05 1.015E+08 47. 1.318E+04 2.726E+02 4.771E+01 3.881E+02 7.494E+03 1.679E+05 1.015E+08 1. 2.805E+02 5.799E+00 1.015E+00 8.258E+00 1.594E+02 3.573E+03 2.161E+06 --------------------zeta--------------------- nl wnl ----blume-watson---- -----(r*vi)----- i (ryd) eps s evel edar evel+edar erel (ryd) (cm-1) (ryd) (cm-1) 1s 2. 0.00000 0.000 0.00000 0.000-2274.99712 -1877.07917 -398.57966 331.78297 -66.797 -1943.87586 2s 2. 0.00000 0.000 0.00000 0.000 -567.83896 -281.91530 -54.20916 36.23357 -17.976 -299.89089 2p 6. 8.55126 938391.863 8.80381 966106.816 -555.31979 -254.64413 -7.22308 -0.01377 -7.223 -261.86721 3s 2. 0.00000 0.000 0.00000 0.000 -234.94723 -54.44661 -10.56476 6.74711 -3.818 -58.26425 3p 6. 1.49487 164042.926 1.53306 168233.403 -227.35201 -45.29448 -1.64604 -0.00221 -1.646 -46.94051 3d 10. 0.17194 18868.622 0.18433 20228.032 -218.95974 -30.71199 -0.37684 -0.01081 -0.377 -31.08884 4s 2. 0.00000 0.000 0.00000 0.000 -108.40497 -9.23752 -2.07115 1.30746 -0.764 -10.00122 4p 6. 0.25235 27692.442 0.25851 28367.655 -99.73410 -6.44442 -0.29425 -0.00026 -0.294 -6.73868 4d 9. 0.01658 1819.368 0.01762 1933.478 -77.90077 -2.26948 -0.04240 -0.00102 -0.042 -2.31188 5s 1. 0.00000 0.000 0.00000 0.000 -39.81490 -1.13201 -0.19166 0.12074 -0.071 -1.20293 7s 1. 0.00000 0.000 0.00000 0.000 -6.86674 -0.07522 -0.00603 0.00380 -0.002 -0.07745 ag i d9 5s7s nconf= 8 z= 47 ion= 0 kut=-1 exf=0.650 corrf=0.000 ca1=0.700 ca0=0.500 without correlation with correlation ----------------------- ----------------------- nl wnl eps fg eps fgr corr eps fg eps fgr n*r n*rc ect ec----------------- 1s 2. -1886.18971 -1886.18971-0.08290 -1886.27261 -1886.27261 0.0230 0.0230 -0.08267 0.00000-0.08267 2s 2. -284.98049 -284.98049-0.08232 -285.06282 -285.06282 0.0592 0.0592 -0.23110 -0.06744-0.08099 2p 6. -255.61167 -255.61167-0.08242 -255.69409 -255.69409 0.0625 0.0625 -0.72296 -0.08169-0.08186-0.08197-0.08206-0.08218 3s 2. -55.78636 -55.78636-0.08107 -55.86742 -55.86742 0.1339 0.1338 -0.86760 -0.06668-0.07795 3p 6. -45.83003 -45.83003-0.08107 -45.91110 -45.91110 0.1477 0.1476 -1.34526 -0.07880-0.07928-0.07960-0.07983-0.08015 3d 10. -30.03371 -30.03371-0.08120 -30.11491 -30.11491 0.1825 0.1822 -2.15235 -0.08039-0.08049-0.08057-0.08064-0.08095 4s 2. -9.50834 -9.50834-0.07794 -9.58628 -9.58628 0.3243 0.3230 -2.28909 -0.06414-0.07260 4p 6. -6.40847 -6.40847-0.07740 -6.48587 -6.48587 0.3950 0.3927 -2.73538 -0.07242-0.07363-0.07437-0.07491-0.07565 4d 9. -1.88608 -1.88608-0.07469 -1.96077 -1.96077 0.7281 0.7141 -3.39158 -0.07029-0.07164-0.07234-0.07285-0.07431 5s 1. -1.01541 -1.01541-0.05790 -1.07331 -1.07331 0.9924 0.9652 -3.44879 -0.05721 7s 1. -0.08542 -0.08542-0.00343 -0.08885 -0.08885 3.4215 3.3549 -3.45222 -0.00343 ecorrt= -3.63931 (old) ect= -3.45222 (new) etotrl= 0.00000 + 0.00000 + 0.00000 etot= -10621.32071 -10621.32071 -10624.96002 -10624.96002 -10624.77293 -10624.77293 -10624.77293 ag i d9 5s7s 5 -10624.7729 0 1.8194 2 14.1494 4 0.3504 4 0.6129 4 t(run)= 17.93, t(job)= 137.22 seconds 47 1ag i d9 5s8s 4d9 5s 8s ag i d9 5s8s nconf= 9 z= 47 ncores=10 nvales= 1 ion= 0 r(i)/x(i)=0.24532669 ca1=0.700 tolstb=1.000 tolk-2=1.00000 tolend= 0.5E-07 thresh= 0.1E-10 kut= 0 exf=1.000 corrf=0.000 ca0= 0.500 rcn mod 32 ihf1= 0 mesh=2601 idb= 481 rdb= 100.461 emx= 0.10 r(mesh)=5426.209 irel= 1 ib=2600 t(run)= 10.82, t(job)= 148.04 seconds nl wnl ee az (r-3) (r-2) (r-1) (r+1) (r+2) (r+3) (r+4) (r+6) 1s 2. -1885.39634 881.505 0.000E+00 5.213E+03 4.936E+01 3.112E-02 1.308E-03 6.934E-05 4.438E-06 2.867E-08 2s 2. -280.68403 295.093 0.000E+00 5.731E+02 1.123E+01 1.350E-01 2.146E-02 3.880E-03 7.892E-04 4.505E-05 2p 6. -254.55034 3360.614 3.659E+03 1.600E+02 1.083E+01 1.175E-01 1.684E-02 2.853E-03 5.593E-04 3.126E-05 3s 2. -52.89447 127.558 0.000E+00 1.088E+02 3.931E+00 3.700E-01 1.565E-01 7.317E-02 3.748E-02 1.276E-02 3p 6. -43.78475 1500.501 6.406E+02 3.005E+01 3.735E+00 3.687E-01 1.577E-01 7.538E-02 3.986E-02 1.483E-02 3d 10. -29.53960 3212.018 9.187E+01 1.571E+01 3.533E+00 3.449E-01 1.415E-01 6.771E-02 3.719E-02 1.613E-02 4s 2. -8.53321 56.166 0.000E+00 2.160E+01 1.520E+00 9.114E-01 9.418E-01 1.071E+00 1.333E+00 2.683E+00 4p 6. -5.78270 623.307 1.083E+02 5.563E+00 1.363E+00 9.982E-01 1.142E+00 1.455E+00 2.052E+00 5.497E+00 4d 9. -1.78738 1073.483 8.992E+00 1.934E+00 1.004E+00 1.343E+00 2.171E+00 4.126E+00 9.139E+00 6.801E+01 5s 1. -1.11501 17.097 0.000E+00 2.113E+00 4.670E-01 2.737E+00 8.493E+00 2.935E+01 1.123E+02 2.194E+03 8s 1. -0.05125 2.065 0.000E+00 3.275E-02 4.625E-02 2.938E+01 9.655E+02 3.383E+04 1.245E+06 1.915E+09 47. 1.318E+04 2.725E+02 5.946E+01 1.005E+03 3.391E+04 1.245E+06 1.915E+09 1. 2.805E+02 5.799E+00 1.265E+00 2.139E+01 7.215E+02 2.649E+04 4.075E+07 --------------------zeta--------------------- nl wnl ----blume-watson---- -----(r*vi)----- i (ryd) eps s evel edar evel+edar erel (ryd) (cm-1) (ryd) (cm-1) 1s 2. 0.00000 0.000 0.00000 0.000-2274.99710 -1877.13265 -398.57965 331.78289 -66.797 -1943.92940 2s 2. 0.00000 0.000 0.00000 0.000 -567.83896 -281.96866 -54.20917 36.23356 -17.976 -299.94427 2p 6. 8.55126 938392.113 8.80382 966107.093 -555.31980 -254.69751 -7.22309 -0.01377 -7.223 -261.92059 3s 2. 0.00000 0.000 0.00000 0.000 -234.94724 -54.49998 -10.56476 6.74711 -3.818 -58.31763 3p 6. 1.49487 164042.934 1.53306 168233.418 -227.35201 -45.34785 -1.64604 -0.00221 -1.646 -46.99389 3d 10. 0.17194 18868.616 0.18433 20228.025 -218.95974 -30.76536 -0.37684 -0.01081 -0.377 -31.14220 4s 2. 0.00000 0.000 0.00000 0.000 -108.40490 -9.29089 -2.07114 1.30745 -0.764 -10.05458 4p 6. 0.25235 27692.467 0.25851 28367.681 -99.73425 -6.49778 -0.29425 -0.00026 -0.294 -6.79204 4d 9. 0.01658 1819.814 0.01762 1933.952 -77.90949 -2.32279 -0.04242 -0.00102 -0.042 -2.36521 5s 1. 0.00000 0.000 0.00000 0.000 -39.86254 -1.18356 -0.19230 0.12114 -0.071 -1.25471 8s 1. 0.00000 0.000 0.00000 0.000 -4.25277 -0.04409 -0.00281 0.00177 -0.001 -0.04513 ag i d9 5s8s nconf= 9 z= 47 ion= 0 kut=-1 exf=0.650 corrf=0.000 ca1=0.700 ca0=0.500 without correlation with correlation ----------------------- ----------------------- nl wnl eps fg eps fgr corr eps fg eps fgr n*r n*rc ect ec----------------- 1s 2. -1886.24317 -1886.24317-0.08290 -1886.32607 -1886.32607 0.0230 0.0230 -0.08267 0.00000-0.08267 2s 2. -285.03383 -285.03383-0.08232 -285.11616 -285.11616 0.0592 0.0592 -0.23110 -0.06744-0.08099 2p 6. -255.66505 -255.66505-0.08242 -255.74747 -255.74747 0.0625 0.0625 -0.72296 -0.08169-0.08186-0.08197-0.08206-0.08218 3s 2. -55.83967 -55.83967-0.08107 -55.92074 -55.92074 0.1338 0.1337 -0.86760 -0.06668-0.07795 3p 6. -45.88340 -45.88340-0.08107 -45.96446 -45.96446 0.1476 0.1475 -1.34526 -0.07880-0.07928-0.07960-0.07983-0.08015 3d 10. -30.08710 -30.08710-0.08120 -30.16829 -30.16829 0.1823 0.1821 -2.15235 -0.08039-0.08049-0.08057-0.08064-0.08095 4s 2. -9.56159 -9.56159-0.07794 -9.63953 -9.63953 0.3234 0.3221 -2.28909 -0.06414-0.07260 4p 6. -6.46188 -6.46188-0.07740 -6.53928 -6.53928 0.3934 0.3911 -2.73538 -0.07242-0.07363-0.07437-0.07491-0.07565 4d 9. -1.93946 -1.93946-0.07469 -2.01415 -2.01415 0.7181 0.7046 -3.39161 -0.07030-0.07164-0.07235-0.07285-0.07431 5s 1. -1.06653 -1.06653-0.05772 -1.12425 -1.12425 0.9683 0.9431 -3.44887 -0.05726 8s 1. -0.05094 -0.05094-0.00149 -0.05243 -0.05243 4.4308 4.3672 -3.45037 -0.00149 ecorrt= -3.63719 (old) ect= -3.45037 (new) etotrl= 0.00000 + 0.00000 + 0.00000 etot= -10621.28646 -10621.28646 -10624.92365 -10624.92365 -10624.73683 -10624.73683 -10624.73683 ag i d9 5s8s 5 -10624.7368 0 1.8198 2 14.1784 4 0.1606 4 0.2707 4 t(run)= 15.63, t(job)= 152.84 seconds 47 1ag i d9 5s9s 4d9 5s 9s ag i d9 5s9s nconf= 10 z= 47 ncores=10 nvales= 1 ion= 0 r(i)/x(i)=0.24532669 ca1=0.700 tolstb=1.000 tolk-2=1.00000 tolend= 0.5E-07 thresh= 0.1E-10 kut= 0 exf=1.000 corrf=0.000 ca0= 0.500 rcn mod 32 ihf1= 0 mesh=2601 idb= 481 rdb= 100.461 emx= 0.10 r(mesh)=5426.209 irel= 1 ib=2600 t(run)= 10.68, t(job)= 163.52 seconds nl wnl ee az (r-3) (r-2) (r-1) (r+1) (r+2) (r+3) (r+4) (r+6) 1s 2. -1885.42459 881.504 0.000E+00 5.213E+03 4.936E+01 3.112E-02 1.308E-03 6.934E-05 4.438E-06 2.867E-08 2s 2. -280.71224 295.093 0.000E+00 5.731E+02 1.123E+01 1.350E-01 2.146E-02 3.880E-03 7.892E-04 4.505E-05 2p 6. -254.57856 3360.614 3.659E+03 1.600E+02 1.083E+01 1.175E-01 1.684E-02 2.853E-03 5.593E-04 3.126E-05 3s 2. -52.92268 127.558 0.000E+00 1.088E+02 3.931E+00 3.700E-01 1.565E-01 7.317E-02 3.748E-02 1.276E-02 3p 6. -43.81297 1500.501 6.406E+02 3.005E+01 3.735E+00 3.687E-01 1.577E-01 7.538E-02 3.986E-02 1.483E-02 3d 10. -29.56781 3212.018 9.187E+01 1.571E+01 3.533E+00 3.449E-01 1.415E-01 6.771E-02 3.719E-02 1.613E-02 4s 2. -8.56142 56.166 0.000E+00 2.160E+01 1.520E+00 9.114E-01 9.418E-01 1.071E+00 1.333E+00 2.683E+00 4p 6. -5.81091 623.307 1.083E+02 5.563E+00 1.363E+00 9.982E-01 1.142E+00 1.455E+00 2.052E+00 5.497E+00 4d 9. -1.81557 1073.536 8.993E+00 1.934E+00 1.004E+00 1.343E+00 2.170E+00 4.125E+00 9.133E+00 6.792E+01 5s 1. -1.14273 17.108 0.000E+00 2.116E+00 4.672E-01 2.735E+00 8.483E+00 2.929E+01 1.120E+02 2.181E+03 9s 1. -0.03406 1.525 0.000E+00 1.786E-02 3.136E-02 4.413E+01 2.174E+03 1.136E+05 6.195E+06 2.045E+10 47. 1.318E+04 2.725E+02 7.420E+01 2.213E+03 1.137E+05 6.195E+06 2.045E+10 1. 2.805E+02 5.799E+00 1.579E+00 4.709E+01 2.419E+03 1.318E+05 4.351E+08 --------------------zeta--------------------- nl wnl ----blume-watson---- -----(r*vi)----- i (ryd) eps s evel edar evel+edar erel (ryd) (cm-1) (ryd) (cm-1) 1s 2. 0.00000 0.000 0.00000 0.000-2274.99710 -1877.16090 -398.57964 331.78285 -66.797 -1943.95769 2s 2. 0.00000 0.000 0.00000 0.000 -567.83896 -281.99687 -54.20917 36.23356 -17.976 -299.97248 2p 6. 8.55126 938392.213 8.80382 966107.205 -555.31980 -254.72572 -7.22309 -0.01377 -7.223 -261.94881 3s 2. 0.00000 0.000 0.00000 0.000 -234.94724 -54.52820 -10.56476 6.74711 -3.818 -58.34584 3p 6. 1.49487 164042.938 1.53306 168233.425 -227.35202 -45.37607 -1.64604 -0.00221 -1.646 -47.02210 3d 10. 0.17194 18868.614 0.18433 20228.023 -218.95974 -30.79357 -0.37684 -0.01081 -0.377 -31.17041 4s 2. 0.00000 0.000 0.00000 0.000 -108.40488 -9.31910 -2.07114 1.30745 -0.764 -10.08279 4p 6. 0.25235 27692.485 0.25851 28367.699 -99.73432 -6.52599 -0.29425 -0.00026 -0.294 -6.82024 4d 9. 0.01658 1819.991 0.01763 1934.141 -77.91295 -2.35098 -0.04242 -0.00102 -0.042 -2.39340 5s 1. 0.00000 0.000 0.00000 0.000 -39.87987 -1.21093 -0.19254 0.12129 -0.071 -1.28217 9s 1. 0.00000 0.000 0.00000 0.000 -2.89004 -0.02900 -0.00153 0.00096 -0.001 -0.02957 ag i d9 5s9s nconf= 10 z= 47 ion= 0 kut=-1 exf=0.650 corrf=0.000 ca1=0.700 ca0=0.500 without correlation with correlation ----------------------- ----------------------- nl wnl eps fg eps fgr corr eps fg eps fgr n*r n*rc ect ec----------------- 1s 2. -1886.27142 -1886.27142-0.08290 -1886.35433 -1886.35433 0.0230 0.0230 -0.08267 0.00000-0.08267 2s 2. -285.06203 -285.06203-0.08232 -285.14435 -285.14435 0.0592 0.0592 -0.23110 -0.06744-0.08099 2p 6. -255.69327 -255.69327-0.08242 -255.77569 -255.77569 0.0625 0.0625 -0.72296 -0.08169-0.08186-0.08197-0.08206-0.08218 3s 2. -55.86786 -55.86786-0.08107 -55.94892 -55.94892 0.1338 0.1337 -0.86760 -0.06668-0.07795 3p 6. -45.91161 -45.91161-0.08107 -45.99267 -45.99267 0.1476 0.1475 -1.34526 -0.07880-0.07928-0.07960-0.07983-0.08015 3d 10. -30.11532 -30.11532-0.08120 -30.19651 -30.19651 0.1822 0.1820 -2.15235 -0.08039-0.08049-0.08057-0.08064-0.08095 4s 2. -9.58975 -9.58975-0.07794 -9.66769 -9.66769 0.3229 0.3216 -2.28909 -0.06414-0.07260 4p 6. -6.49010 -6.49010-0.07740 -6.56751 -6.56751 0.3925 0.3902 -2.73538 -0.07242-0.07363-0.07437-0.07491-0.07565 4d 9. -1.96768 -1.96768-0.07469 -2.04237 -2.04237 0.7129 0.6997 -3.39162 -0.07030-0.07165-0.07235-0.07285-0.07431 5s 1. -1.09387 -1.09387-0.05761 -1.15148 -1.15148 0.9561 0.9319 -3.44890 -0.05728 9s 1. -0.03385 -0.03385-0.00079 -0.03465 -0.03465 5.4349 5.3725 -3.44969 -0.00079 ecorrt= -3.63636 (old) ect= -3.44969 (new) etotrl= 0.00000 + 0.00000 + 0.00000 etot= -10621.26948 -10621.26948 -10624.90584 -10624.90584 -10624.71917 -10624.71917 -10624.71917 ag i d9 5s9s 5 -10624.7192 0 1.8200 2 14.1888 4 0.0868 4 0.1437 4 t(run)= 15.25, t(job)= 168.09 seconds 47 1ag i d8 5s2 6s 4d8 5s2 6s ag i d8 5s2 6s nconf= 11 z= 47 ncores=10 nvales= 1 ion= 0 r(i)/x(i)=0.24532669 ca1=0.700 tolstb=1.000 tolk-2=1.00000 tolend= 0.5E-07 thresh= 0.1E-10 kut= 0 exf=1.000 corrf=0.000 ca0= 0.500 rcn mod 32 ihf1= 0 mesh=2601 idb= 481 rdb= 100.461 emx= 0.10 r(mesh)=5426.209 irel= 1 ib=2600 t(run)= 10.70, t(job)= 178.79 seconds nl wnl ee az (r-3) (r-2) (r-1) (r+1) (r+2) (r+3) (r+4) (r+6) 1s 2. -1885.58846 881.502 0.000E+00 5.213E+03 4.936E+01 3.112E-02 1.308E-03 6.934E-05 4.438E-06 2.867E-08 2s 2. -280.89717 295.090 0.000E+00 5.731E+02 1.123E+01 1.350E-01 2.146E-02 3.880E-03 7.892E-04 4.505E-05 2p 6. -254.76193 3360.521 3.659E+03 1.600E+02 1.083E+01 1.175E-01 1.684E-02 2.853E-03 5.593E-04 3.126E-05 3s 2. -53.09732 127.566 0.000E+00 1.088E+02 3.931E+00 3.699E-01 1.565E-01 7.316E-02 3.747E-02 1.276E-02 3p 6. -43.98773 1500.626 6.407E+02 3.005E+01 3.736E+00 3.687E-01 1.577E-01 7.536E-02 3.985E-02 1.483E-02 3d 10. -29.74552 3212.646 9.190E+01 1.571E+01 3.534E+00 3.449E-01 1.415E-01 6.767E-02 3.716E-02 1.611E-02 4s 2. -8.70625 56.361 0.000E+00 2.174E+01 1.526E+00 9.084E-01 9.348E-01 1.058E+00 1.308E+00 2.590E+00 4p 6. -5.94412 627.360 1.097E+02 5.628E+00 1.371E+00 9.919E-01 1.126E+00 1.420E+00 1.980E+00 5.145E+00 4d 8. -1.91001 1109.886 9.588E+00 2.042E+00 1.035E+00 1.296E+00 2.004E+00 3.611E+00 7.514E+00 4.848E+01 5s 2. -0.99034 18.071 0.000E+00 2.348E+00 4.852E-01 2.659E+00 8.045E+00 2.720E+01 1.022E+02 1.953E+03 6s 1. -0.18182 5.367 0.000E+00 2.189E-01 1.484E-01 8.473E+00 8.082E+01 8.487E+02 9.738E+03 1.643E+06 47. 1.318E+04 2.725E+02 3.937E+01 1.244E+02 9.439E+02 1.002E+04 1.647E+06 1. 2.805E+02 5.797E+00 8.376E-01 2.647E+00 2.008E+01 2.131E+02 3.505E+04 --------------------zeta--------------------- nl wnl ----blume-watson---- -----(r*vi)----- i (ryd) eps s evel edar evel+edar erel (ryd) (cm-1) (ryd) (cm-1) 1s 2. 0.00000 0.000 0.00000 0.000-2274.99690 -1877.32460 -398.57701 331.78056 -66.796 -1944.12106 2s 2. 0.00000 0.000 0.00000 0.000 -567.83845 -282.18121 -54.20816 36.23298 -17.975 -300.15640 2p 6. 8.55088 938350.620 8.80340 966061.754 -555.31864 -254.90884 -7.22272 -0.01379 -7.223 -262.13156 3s 2. 0.00000 0.000 0.00000 0.000 -234.95274 -54.70324 -10.56623 6.74805 -3.818 -58.52142 3p 6. 1.49513 164071.483 1.53331 168261.797 -227.35919 -45.55120 -1.64633 -0.00222 -1.646 -47.19752 3d 10. 0.17200 18875.062 0.18440 20235.067 -218.97409 -30.97102 -0.37699 -0.01081 -0.377 -31.34801 4s 2. 0.00000 0.000 0.00000 0.000 -108.63548 -9.45856 -2.08553 1.31652 -0.769 -10.22758 4p 6. 0.25563 28052.675 0.26187 28736.803 -100.15460 -6.65477 -0.29812 -0.00026 -0.298 -6.95288 4d 8. 0.01771 1943.607 0.01882 2065.242 -79.82600 -2.45468 -0.04534 -0.00108 -0.045 -2.50002 5s 2. 0.00000 0.000 0.00000 0.000 -41.11860 -1.15043 -0.21487 0.13534 -0.080 -1.22995 6s 1. 0.00000 0.000 0.00000 0.000 -13.47399 -0.17065 -0.01895 0.01194 -0.007 -0.17766 ag i d8 5s2 6s nconf= 11 z= 47 ion= 0 kut=-1 exf=0.650 corrf=0.000 ca1=0.700 ca0=0.500 without correlation with correlation ----------------------- ----------------------- nl wnl eps fg eps fgr corr eps fg eps fgr n*r n*rc ect ec----------------- 1s 2. -1886.43685 -1886.43685-0.08290 -1886.51976 -1886.51976 0.0230 0.0230 -0.08267 0.00000-0.08267 2s 2. -285.24884 -285.24884-0.08232 -285.33116 -285.33116 0.0592 0.0592 -0.23110 -0.06744-0.08099 2p 6. -255.87547 -255.87547-0.08242 -255.95789 -255.95789 0.0625 0.0625 -0.72297 -0.08169-0.08186-0.08197-0.08206-0.08218 3s 2. -56.05052 -56.05052-0.08107 -56.13158 -56.13158 0.1336 0.1335 -0.86760 -0.06668-0.07795 3p 6. -46.08904 -46.08904-0.08107 -46.17011 -46.17011 0.1473 0.1472 -1.34527 -0.07880-0.07928-0.07960-0.07983-0.08016 3d 10. -30.28844 -30.28844-0.08120 -30.36964 -30.36964 0.1817 0.1815 -2.15236 -0.08040-0.08049-0.08057-0.08064-0.08095 4s 2. -9.72979 -9.72979-0.07792 -9.80771 -9.80771 0.3206 0.3193 -2.28930 -0.06429-0.07265 4p 6. -6.58798 -6.58798-0.07740 -6.66538 -6.66538 0.3896 0.3873 -2.73608 -0.07253-0.07372-0.07445-0.07498-0.07571 4d 8. -2.06688 -2.06688-0.07512 -2.14200 -2.14200 0.6956 0.6833 -3.32207 -0.07111-0.07223-0.07287-0.07333-0.07449 5s 2. -0.96603 -0.96603-0.06166 -1.02769 -1.02769 1.0174 0.9864 -3.43979 -0.05656-0.06116 6s 1. -0.18679 -0.18679-0.01501 -0.20180 -0.20180 2.3138 2.2260 -3.45480 -0.01501 ecorrt= -3.64502 (old) ect= -3.45480 (new) etotrl= 0.00000 + 0.00000 + 0.00000 etot= -10620.84350 -10620.84350 -10624.48852 -10624.48852 -10624.29830 -10624.29830 -10624.29830 ag i d8 5s2 6s 5 -10624.2983 0 76.3655 1 49.9322 1 1.9436 2 1.0040 4 t(run)= 15.46, t(job)= 183.55 seconds 47 1ag i d10 5d 4d10 5d ag i d10 5d nconf= 12 z= 47 ncores= 9 nvales= 1 ion= 0 r(i)/x(i)=0.24532669 ca1=0.700 tolstb=1.000 tolk-2=1.00000 tolend= 0.5E-07 thresh= 0.1E-10 kut= 0 exf=1.000 corrf=0.000 ca0= 0.500 rcn mod 32 ihf1= 0 mesh=2601 idb= 481 rdb= 100.461 emx= 0.10 r(mesh)=5426.209 irel= 1 ib=2600 t(run)= 11.76, t(job)= 195.31 seconds nl wnl ee az (r-3) (r-2) (r-1) (r+1) (r+2) (r+3) (r+4) (r+6) 1s 2. -1884.92888 881.508 0.000E+00 5.213E+03 4.936E+01 3.112E-02 1.308E-03 6.934E-05 4.438E-06 2.867E-08 2s 2. -280.19973 295.095 0.000E+00 5.731E+02 1.123E+01 1.350E-01 2.146E-02 3.880E-03 7.892E-04 4.505E-05 2p 6. -254.06738 3360.693 3.659E+03 1.600E+02 1.083E+01 1.175E-01 1.683E-02 2.853E-03 5.593E-04 3.126E-05 3s 2. -52.41598 127.553 0.000E+00 1.088E+02 3.931E+00 3.700E-01 1.565E-01 7.318E-02 3.748E-02 1.276E-02 3p 6. -43.30620 1500.439 6.406E+02 3.004E+01 3.735E+00 3.687E-01 1.577E-01 7.538E-02 3.987E-02 1.484E-02 3d 10. -29.05903 3211.670 9.185E+01 1.570E+01 3.533E+00 3.450E-01 1.415E-01 6.773E-02 3.720E-02 1.614E-02 4s 2. -8.07346 56.015 0.000E+00 2.148E+01 1.516E+00 9.139E-01 9.475E-01 1.082E+00 1.354E+00 2.767E+00 4p 6. -5.33235 619.959 1.071E+02 5.509E+00 1.356E+00 1.004E+00 1.156E+00 1.486E+00 2.119E+00 5.842E+00 4d 10. -1.37106 1036.304 8.400E+00 1.824E+00 9.713E-01 1.398E+00 2.378E+00 4.815E+00 1.149E+01 1.018E+02 5d 1. -0.11012 80.362 4.981E-02 2.318E-02 1.118E-01 1.066E+01 1.296E+02 1.770E+03 2.681E+04 8.101E+06 47. 1.318E+04 2.728E+02 3.993E+01 1.651E+02 1.830E+03 2.694E+04 8.102E+06 1. 2.804E+02 5.804E+00 8.496E-01 3.512E+00 3.894E+01 5.732E+02 1.724E+05 --------------------zeta--------------------- nl wnl ----blume-watson---- -----(r*vi)----- i (ryd) eps s evel edar evel+edar erel (ryd) (cm-1) (ryd) (cm-1) 1s 2. 0.00000 0.000 0.00000 0.000-2274.99734 -1876.66531 -398.58184 331.78523 -66.797 -1943.46192 2s 2. 0.00000 0.000 0.00000 0.000 -567.83950 -281.48476 -54.21011 36.23417 -17.976 -299.46070 2p 6. 8.55158 938426.771 8.80416 966144.842 -555.32084 -254.21467 -7.22339 -0.01376 -7.223 -261.43807 3s 2. 0.00000 0.000 0.00000 0.000 -234.94455 -54.02112 -10.56400 6.74663 -3.817 -57.83848 3p 6. 1.49473 164028.047 1.53292 168218.858 -227.34852 -44.86893 -1.64589 -0.00221 -1.646 -46.51482 3d 10. 0.17191 18864.961 0.18429 20224.021 -218.95185 -30.28488 -0.37676 -0.01081 -0.377 -30.66164 4s 2. 0.00000 0.000 0.00000 0.000 -108.22095 -8.83559 -2.06000 1.30043 -0.760 -9.59517 4p 6. 0.24966 27396.576 0.25574 28064.464 -99.37715 -6.05130 -0.29109 -0.00026 -0.291 -6.34238 4d 10. 0.01547 1697.273 0.01644 1803.957 -75.85341 -1.89555 -0.03953 -0.00095 -0.040 -1.93508 5d 1. 0.00009 9.970 0.00010 10.475 -10.31929 -0.06995 -0.00023 -0.00001 0.000 -0.07018 ag i d10 5d nconf= 12 z= 47 ion= 0 kut=-1 exf=0.650 corrf=0.000 ca1=0.700 ca0=0.500 without correlation with correlation ----------------------- ----------------------- nl wnl eps fg eps fgr corr eps fg eps fgr n*r n*rc ect ec----------------- 1s 2. -1885.77451 -1885.77451-0.08290 -1885.85741 -1885.85741 0.0230 0.0230 -0.08267 0.00000-0.08267 2s 2. -284.54801 -284.54801-0.08232 -284.63033 -284.63033 0.0593 0.0593 -0.23110 -0.06744-0.08099 2p 6. -255.18285 -255.18285-0.08242 -255.26527 -255.26527 0.0626 0.0626 -0.72296 -0.08169-0.08186-0.08197-0.08206-0.08218 3s 2. -55.35487 -55.35487-0.08107 -55.43594 -55.43594 0.1344 0.1343 -0.86759 -0.06668-0.07795 3p 6. -45.40262 -45.40262-0.08107 -45.48369 -45.48369 0.1484 0.1483 -1.34526 -0.07880-0.07928-0.07960-0.07983-0.08015 3d 10. -29.60988 -29.60988-0.08120 -29.69108 -29.69108 0.1838 0.1835 -2.15235 -0.08039-0.08049-0.08057-0.08064-0.08095 4s 2. -9.10590 -9.10590-0.07796 -9.18386 -9.18386 0.3314 0.3300 -2.28891 -0.06401-0.07255 4p 6. -6.04213 -6.04213-0.07741 -6.11953 -6.11953 0.4068 0.4042 -2.73477 -0.07233-0.07355-0.07430-0.07484-0.07559 4d 10. -1.51761 -1.51761-0.07410 -1.59171 -1.59171 0.8117 0.7926 -3.45983 -0.06931-0.07095-0.07174-0.07229-0.07407 5d 1. -0.10956 -0.10956-0.00481 -0.11438 -0.11438 3.0212 2.9569 -3.46465 -0.00481 ecorrt= -3.65163 (old) ect= -3.46465 (new) etotrl= 0.00000 + 0.00000 + 0.00000 etot= -10621.68613 -10621.68613 -10625.33776 -10625.33776 -10625.15078 -10625.15078 -10625.15078 ag i d10 5d 2 -10625.1508 0 0.0100 2 t(run)= 16.54, t(job)= 200.09 seconds 47 1ag i d10 6d 4d10 6d ag i d10 6d nconf= 13 z= 47 ncores= 9 nvales= 1 ion= 0 r(i)/x(i)=0.24532669 ca1=0.700 tolstb=1.000 tolk-2=1.00000 tolend= 0.5E-07 thresh= 0.1E-10 kut= 0 exf=1.000 corrf=0.000 ca0= 0.500 rcn mod 32 ihf1= 0 mesh=2601 idb= 481 rdb= 100.461 emx= 0.10 r(mesh)=5426.209 irel= 1 ib=2600 t(run)= 12.01, t(job)= 212.10 seconds nl wnl ee az (r-3) (r-2) (r-1) (r+1) (r+2) (r+3) (r+4) (r+6) 1s 2. -1885.02345 881.508 0.000E+00 5.213E+03 4.936E+01 3.112E-02 1.308E-03 6.934E-05 4.438E-06 2.867E-08 2s 2. -280.29433 295.095 0.000E+00 5.731E+02 1.123E+01 1.350E-01 2.146E-02 3.880E-03 7.892E-04 4.505E-05 2p 6. -254.16198 3360.693 3.659E+03 1.600E+02 1.083E+01 1.175E-01 1.683E-02 2.853E-03 5.593E-04 3.126E-05 3s 2. -52.51057 127.553 0.000E+00 1.088E+02 3.931E+00 3.700E-01 1.565E-01 7.318E-02 3.748E-02 1.276E-02 3p 6. -43.40079 1500.439 6.406E+02 3.004E+01 3.735E+00 3.687E-01 1.577E-01 7.538E-02 3.987E-02 1.484E-02 3d 10. -29.15362 3211.670 9.185E+01 1.570E+01 3.533E+00 3.450E-01 1.415E-01 6.773E-02 3.720E-02 1.614E-02 4s 2. -8.16802 56.015 0.000E+00 2.149E+01 1.516E+00 9.139E-01 9.475E-01 1.082E+00 1.354E+00 2.767E+00 4p 6. -5.42690 619.962 1.071E+02 5.509E+00 1.356E+00 1.004E+00 1.156E+00 1.486E+00 2.119E+00 5.842E+00 4d 10. -1.46562 1036.429 8.402E+00 1.825E+00 9.715E-01 1.398E+00 2.376E+00 4.809E+00 1.146E+01 1.011E+02 6d 1. -0.06210 58.964 2.653E-02 1.084E-02 6.317E-02 2.118E+01 5.122E+02 1.341E+04 3.739E+05 3.444E+08 47. 1.318E+04 2.727E+02 5.045E+01 5.476E+02 1.347E+04 3.741E+05 3.444E+08 1. 2.804E+02 5.803E+00 1.073E+00 1.165E+01 2.867E+02 7.959E+03 7.327E+06 --------------------zeta--------------------- nl wnl ----blume-watson---- -----(r*vi)----- i (ryd) eps s evel edar evel+edar erel (ryd) (cm-1) (ryd) (cm-1) 1s 2. 0.00000 0.000 0.00000 0.000-2274.99732 -1876.75988 -398.58180 331.78507 -66.797 -1943.55661 2s 2. 0.00000 0.000 0.00000 0.000 -567.83950 -281.57936 -54.21011 36.23416 -17.976 -299.55531 2p 6. 8.55158 938426.771 8.80416 966144.841 -555.32084 -254.30927 -7.22339 -0.01376 -7.223 -261.53267 3s 2. 0.00000 0.000 0.00000 0.000 -234.94455 -54.11571 -10.56400 6.74663 -3.817 -57.93308 3p 6. 1.49473 164028.068 1.53292 168218.879 -227.34853 -44.96352 -1.64589 -0.00221 -1.646 -46.60941 3d 10. 0.17191 18864.966 0.18429 20224.027 -218.95186 -30.37948 -0.37676 -0.01081 -0.377 -30.75623 4s 2. 0.00000 0.000 0.00000 0.000 -108.22110 -8.93015 -2.06001 1.30043 -0.760 -9.68973 4p 6. 0.24966 27396.813 0.25574 28064.707 -99.37743 -6.14585 -0.29109 -0.00026 -0.291 -6.43694 4d 10. 0.01547 1697.681 0.01644 1804.392 -75.86225 -1.99007 -0.03954 -0.00095 -0.040 -2.02961 6d 1. 0.00005 5.340 0.00005 5.635 -5.83118 -0.04615 -0.00013 0.00000 0.000 -0.04628 ag i d10 6d nconf= 13 z= 47 ion= 0 kut=-1 exf=0.650 corrf=0.000 ca1=0.700 ca0=0.500 without correlation with correlation ----------------------- ----------------------- nl wnl eps fg eps fgr corr eps fg eps fgr n*r n*rc ect ec----------------- 1s 2. -1885.86908 -1885.86908-0.08290 -1885.95199 -1885.95199 0.0230 0.0230 -0.08267 0.00000-0.08267 2s 2. -284.64261 -284.64261-0.08232 -284.72493 -284.72493 0.0593 0.0593 -0.23110 -0.06744-0.08099 2p 6. -255.27745 -255.27745-0.08242 -255.35987 -255.35987 0.0626 0.0626 -0.72296 -0.08169-0.08186-0.08197-0.08206-0.08218 3s 2. -55.44947 -55.44947-0.08107 -55.53053 -55.53053 0.1343 0.1342 -0.86759 -0.06668-0.07795 3p 6. -45.49722 -45.49722-0.08107 -45.57828 -45.57828 0.1483 0.1481 -1.34526 -0.07880-0.07928-0.07960-0.07983-0.08015 3d 10. -29.70447 -29.70447-0.08120 -29.78567 -29.78567 0.1835 0.1832 -2.15235 -0.08039-0.08049-0.08057-0.08064-0.08095 4s 2. -9.20045 -9.20045-0.07796 -9.27841 -9.27841 0.3297 0.3283 -2.28891 -0.06401-0.07255 4p 6. -6.13667 -6.13667-0.07741 -6.21408 -6.21408 0.4037 0.4012 -2.73478 -0.07233-0.07355-0.07430-0.07484-0.07559 4d 10. -1.61213 -1.61213-0.07409 -1.68623 -1.68623 0.7876 0.7701 -3.45987 -0.06932-0.07096-0.07175-0.07230-0.07407 6d 1. -0.06157 -0.06157-0.00204 -0.06361 -0.06361 4.0299 3.9649 -3.46191 -0.00204 ecorrt= -3.64877 (old) ect= -3.46191 (new) etotrl= 0.00000 + 0.00000 + 0.00000 etot= -10621.63847 -10621.63847 -10625.28724 -10625.28724 -10625.10038 -10625.10038 -10625.10038 ag i d10 6d 2 -10625.1004 0 0.0053 2 t(run)= 16.87, t(job)= 216.96 seconds 47 1ag i d10 7d 4d10 7d ag i d10 7d nconf= 14 z= 47 ncores= 9 nvales= 1 ion= 0 r(i)/x(i)=0.24532669 ca1=0.700 tolstb=1.000 tolk-2=1.00000 tolend= 0.5E-07 thresh= 0.1E-10 kut= 0 exf=1.000 corrf=0.000 ca0= 0.500 rcn mod 32 ihf1= 0 mesh=2601 idb= 481 rdb= 100.461 emx= 0.10 r(mesh)=5426.209 irel= 1 ib=2600 51 ru,ruee,ruexch -94.000000 -88.425184 -83.474178 -75.211471 -68.439956 -57.750309 -49.600970 -37.906445 -30.146946 -20.728869 -14.999512 -8.416509 -5.482850 -3.428984 -2.698531 -2.056763 -1.905117 -1.605914 -1.447851 -1.414295 0.000000 6.284714 11.487023 19.950088 27.013546 37.979610 46.156108 58.241384 66.108022 75.116890 81.008960 87.771759 90.433267 91.903605 92.197928 92.364266 92.475670 92.668126 92.849240 93.175960 0.000000 -0.709898 -0.961201 -1.161559 -1.453502 -1.729919 -1.757078 -2.147828 -2.254968 -1.845759 -2.008472 -2.188268 -1.916116 -1.332589 -0.896460 -0.421028 -0.380787 -0.274040 -0.297091 -0.590255 51 1s 1.0000003 -1885.067442 r*vself, r*vtotal, r*veff, (if diagnostic print out-r*vs, r*vt, calc. wvfn, mod. wvfn) 0.000000 1.032295 1.589650 1.937501 1.991428 1.999859 1.999998 2.000001 2.000001 2.000001 2.000001 2.000001 2.000001 2.000001 2.000001 2.000001 2.000001 2.000001 2.000001 2.000001 0.000000 -88.798228 -84.201759 -76.464735 -69.857798 -59.134651 -50.975047 -39.143243 -31.343547 -22.050999 -16.260332 -9.604580 -6.734244 -4.763016 -4.053827 -3.649361 -3.531315 -3.333149 -3.152080 -2.837356 0.000000 4.596197 4.981024 3.068520 1.451815 0.248796 0.036793 0.000678 0.000011 0.000000 0.000000 0.000000 0.000000 0.000000 0.000000 0.000000 0.000000 0.000000 0.000000 0.000000 0.000000 4.596197 4.981024 3.068520 1.451815 0.248796 0.036793 0.000678 0.000011 0.000000 0.000000 0.000000 0.000000 0.000000 0.000000 0.000000 0.000000 0.000000 0.000000 0.000000 51 2s 1.0000000 -280.338324 r*vself, r*vtotal, r*veff, (if diagnostic print out-r*vs, r*vt, calc. wvfn, mod. wvfn) 0.000000 0.256263 0.467435 0.849894 1.214335 1.718852 1.920234 1.995475 1.999794 2.000000 2.000000 2.000000 2.000000 2.000000 2.000000 2.000000 2.000000 2.000000 2.000000 2.000000 0.000000 -88.391428 -83.573402 -75.640831 -69.023146 -58.597037 -50.693035 -39.118462 -31.348173 -22.066698 -16.278185 -9.627219 -6.771967 -4.849805 -4.153672 -3.661694 -3.537915 -3.334405 -3.153381 -2.849778 0.000000 1.426866 1.179157 -0.601912 -2.078945 -2.847323 -2.173810 -0.749396 -0.196734 -0.010147 -0.000447 -0.000001 0.000000 0.000000 0.000000 0.000000 0.000000 0.000000 0.000000 0.000000 0.000000 1.426866 1.179157 -0.601912 -2.078945 -2.847323 -2.173810 -0.749396 -0.196734 -0.010147 -0.000447 -0.000001 0.000000 0.000000 0.000000 0.000000 0.000000 0.000000 0.000000 0.000000 51 2p 1.0000000 -254.205977 r*vself, r*vtotal, r*veff, (if diagnostic print out-r*vs, r*vt, calc. wvfn, mod. wvfn) 0.000000 0.265598 0.528119 1.010646 1.387694 1.804218 1.946424 1.996862 1.999844 2.000000 2.000000 2.000000 2.000000 2.000000 2.000000 2.000000 2.000000 2.000000 2.000000 2.000000 0.000000 -88.435563 -83.641893 -75.679100 -69.105452 -58.720417 -50.776093 -39.122847 -31.341818 -22.050986 -16.260332 -9.604580 -6.734244 -4.763015 -4.053826 -3.649360 -3.531314 -3.333149 -3.152080 -2.837356 0.000000 0.322038 0.946053 2.121620 2.739716 2.609672 1.819013 0.610997 0.165810 0.009593 0.000485 0.000001 0.000000 0.000000 0.000000 0.000000 0.000000 0.000000 0.000000 0.000000 0.000000 0.322038 0.946053 2.121620 2.739716 2.609672 1.819013 0.610997 0.165810 0.009593 0.000485 0.000001 0.000000 0.000000 0.000000 0.000000 0.000000 0.000000 0.000000 0.000000 51 3s 1.0000000 -52.554569 r*vself, r*vtotal, r*veff, (if diagnostic print out-r*vs, r*vt, calc. wvfn, mod. wvfn) 0.000000 0.092861 0.177489 0.339986 0.498479 0.777775 1.030192 1.499924 1.800936 1.980064 1.998530 1.999994 2.000000 2.000000 2.000000 2.000000 2.000000 2.000000 2.000000 2.000000 0.000000 -88.260823 -83.308618 -75.139506 -68.404487 -57.899329 -50.011386 -38.526206 -30.964235 -21.938651 -16.267369 -9.634797 -6.785088 -4.883985 -4.207234 -3.672911 -3.544163 -3.335643 -3.154666 -2.861395 0.000000 0.610109 0.482458 -0.324005 -0.912675 -0.797255 0.161551 1.641571 1.821008 0.931056 0.321594 0.026023 0.001759 0.000007 0.000000 0.000000 0.000000 0.000000 0.000000 0.000000 0.000000 0.610109 0.482458 -0.324005 -0.912675 -0.797255 0.161551 1.641571 1.821008 0.931056 0.321594 0.026023 0.001759 0.000007 0.000000 0.000000 0.000000 0.000000 0.000000 0.000000 51 3p 1.0000000 -43.444784 r*vself, r*vtotal, r*veff, (if diagnostic print out-r*vs, r*vt, calc. wvfn, mod. wvfn) 0.000000 0.091605 0.182606 0.356632 0.512781 0.784031 1.041733 1.507359 1.796303 1.976202 1.997852 1.999987 2.000000 2.000000 2.000000 2.000000 2.000000 2.000000 2.000000 2.000000 0.000000 -88.265538 -83.314133 -75.135659 -68.412414 -57.918405 -50.012007 -38.528420 -30.970766 -21.926772 -16.256980 -9.626956 -6.771963 -4.849805 -4.153672 -3.661694 -3.537915 -3.334405 -3.153381 -2.849778 0.000000 0.143097 0.415238 0.881322 1.011498 0.445503 -0.482906 -1.663231 -1.754880 -0.942059 -0.357674 -0.036208 -0.003113 -0.000020 0.000000 0.000000 0.000000 0.000000 0.000000 0.000000 0.000000 0.143097 0.415238 0.881322 1.011498 0.445503 -0.482906 -1.663231 -1.754880 -0.942059 -0.357674 -0.036208 -0.003113 -0.000020 0.000000 0.000000 0.000000 0.000000 0.000000 0.000000 51 3d 1.0000000 -29.197616 r*vself, r*vtotal, r*veff, (if diagnostic print out-r*vs, r*vt, calc. wvfn, mod. wvfn) 0.000000 0.086670 0.173339 0.346591 0.519102 0.853822 1.155201 1.595216 1.828250 1.975013 1.996875 1.999959 2.000000 2.000000 2.000000 2.000000 2.000000 2.000000 2.000000 2.000000 0.000000 -88.258630 -83.305876 -75.143651 -68.439423 -57.962752 -50.046387 -38.599984 -31.033612 -21.931581 -16.236813 -9.603978 -6.734226 -4.763015 -4.053826 -3.649361 -3.531314 -3.333149 -3.152080 -2.837356 0.000000 0.004450 0.029170 0.161376 0.384758 0.927535 1.381753 1.730749 1.554452 0.849695 0.370113 0.054286 0.007081 0.000111 0.000002 0.000000 0.000000 0.000000 0.000000 0.000000 0.000000 0.004450 0.029170 0.161376 0.384758 0.927535 1.381753 1.730749 1.554452 0.849695 0.370113 0.054286 0.007081 0.000111 0.000002 0.000000 0.000000 0.000000 0.000000 0.000000 51 4s 1.0000000 -8.212001 r*vself, r*vtotal, r*veff, (if diagnostic print out-r*vs, r*vt, calc. wvfn, mod. wvfn) 0.000000 0.036515 0.071450 0.140038 0.207830 0.336317 0.460289 0.700033 0.912313 1.310665 1.644498 1.938098 1.991670 1.999883 1.999999 2.000000 2.000000 2.000000 2.000000 2.000000 0.000000 -88.210660 -83.206976 -74.942548 -68.132919 -57.475902 -49.442727 -37.830205 -30.255640 -21.324900 -15.718298 -9.425104 -6.725187 -4.897855 -4.240432 -3.683156 -3.550086 -3.336865 -3.155933 -2.872281 0.000000 0.267389 0.209678 -0.147142 -0.400859 -0.315868 0.136064 0.684312 0.434844 -0.679834 -1.197092 -0.893210 -0.418462 -0.064494 -0.008477 -0.000124 -0.000002 0.000000 0.000000 0.000000 0.000000 0.267389 0.209678 -0.147142 -0.400859 -0.315868 0.136064 0.684312 0.434844 -0.679834 -1.197092 -0.893210 -0.418462 -0.064494 -0.008477 -0.000124 -0.000002 0.000000 0.000000 0.000000 51 4p 1.0000000 -5.470880 r*vself, r*vtotal, r*veff, (if diagnostic print out-r*vs, r*vt, calc. wvfn, mod. wvfn) 0.000000 0.033265 0.066427 0.131403 0.193410 0.310987 0.426683 0.648246 0.845758 1.220118 1.549124 1.891537 1.978691 1.999326 1.999981 2.000000 2.000000 2.000000 2.000000 2.000000 0.000000 -88.208320 -83.201826 -74.930223 -68.117857 -57.452464 -49.406270 -37.780940 -30.189941 -21.252045 -15.662213 -9.353179 -6.666358 -4.867199 -4.205485 -3.672907 -3.544163 -3.335644 -3.154666 -2.861395 0.000000 0.059078 0.171073 0.359652 0.404016 0.143513 -0.250341 -0.626899 -0.391655 0.553628 1.071856 0.954328 0.541280 0.125162 0.024955 0.000844 0.000026 0.000000 0.000000 0.000000 0.000000 0.059078 0.171073 0.359652 0.404016 0.143513 -0.250341 -0.626899 -0.391655 0.553628 1.071855 0.954328 0.541280 0.125162 0.024955 0.000844 0.000026 0.000000 0.000000 0.000000 51 4d 1.0000000 -1.509601 r*vself, r*vtotal, r*veff, (if diagnostic print out-r*vs, r*vt, calc. wvfn, mod. wvfn) 0.000000 0.023834 0.047669 0.095328 0.142912 0.237043 0.327973 0.496175 0.651832 0.956193 1.241112 1.645450 1.845454 1.972301 1.995174 1.999859 1.999996 2.000000 2.000000 2.000000 0.000000 -88.198162 -83.182812 -74.896600 -68.070298 -57.375141 -49.301035 -37.636823 -29.999903 -21.006038 -15.438563 -9.123347 -6.438707 -4.662800 -4.054637 -3.655538 -3.537677 -3.334405 -3.153381 -2.849778 0.000000 0.001436 0.009402 0.051824 0.122763 0.288979 0.412012 0.423765 0.209945 -0.359000 -0.736186 -0.885947 -0.733371 -0.395937 -0.193463 -0.041085 -0.008044 -0.000265 -0.000008 0.000000 0.000000 0.001436 0.009402 0.051824 0.122763 0.288979 0.412012 0.423765 0.209945 -0.359000 -0.736186 -0.885947 -0.733371 -0.395937 -0.193463 -0.041085 -0.008044 -0.000265 -0.000008 0.000000 51 7d 1.0000003 -0.039822 r*vself, r*vtotal, r*veff, (if diagnostic print out-r*vs, r*vt, calc. wvfn, mod. wvfn) 0.000000 0.000993 0.001987 0.003974 0.005960 0.009932 0.013898 0.021806 0.029693 0.045458 0.061182 0.092346 0.123241 0.184866 0.246301 0.365675 0.475707 0.668123 0.849238 1.175957 0.000000 -88.497045 -83.569783 -75.321615 -68.571118 -57.889384 -49.724918 -38.013989 -30.214123 -20.713859 -14.902320 -8.134011 -5.093219 -3.098395 -2.506547 -2.026884 -2.000108 -1.999997 -1.999997 -1.999997 0.000000 0.000062 0.000404 0.002223 0.005251 0.012258 0.017276 0.017065 0.007293 -0.016969 -0.031386 -0.032017 -0.018220 0.014978 0.046753 0.096446 0.117762 0.060118 -0.058539 -0.134125 0.000000 0.000062 0.000403 0.002218 0.005240 0.012233 0.017240 0.017029 0.007276 -0.016936 -0.031320 -0.031929 -0.018128 0.015076 0.046846 0.096506 0.117773 0.060038 -0.058634 -0.134089 51 25.66 -0.000331 351 -1 50 0.20 0.20 0.20 0.20 0.20 0.20 0.20 0.20 0.30 0.20 52 ru,ruee,ruexch -94.000000 -88.425184 -83.474178 -75.211471 -68.439956 -57.750309 -49.600970 -37.906445 -30.146946 -20.728870 -14.999514 -8.416511 -5.482854 -3.428992 -2.698541 -2.056762 -1.905128 -1.605994 -1.447795 -1.414347 0.000000 6.284714 11.487023 19.950088 27.013546 37.979610 46.156107 58.241383 66.108022 75.116890 81.008959 87.771757 90.433262 91.903597 92.197917 92.364251 92.475653 92.668107 92.849216 93.175934 0.000000 -0.709898 -0.961201 -1.161559 -1.453502 -1.729919 -1.757078 -2.147828 -2.254968 -1.845759 -2.008472 -2.188268 -1.916116 -1.332589 -0.896458 -0.421013 -0.380782 -0.274101 -0.297011 -0.590281 52 1s 1.0000003 -1885.067443 r*vself, r*vtotal, r*veff, (if diagnostic print out-r*vs, r*vt, calc. wvfn, mod. wvfn) 0.000000 1.032295 1.589650 1.937501 1.991428 1.999859 1.999998 2.000001 2.000001 2.000001 2.000001 2.000001 2.000001 2.000001 2.000001 2.000001 2.000001 2.000001 2.000001 2.000001 0.000000 -88.798228 -84.201759 -76.464735 -69.857798 -59.134652 -50.975047 -39.143243 -31.343548 -22.051000 -16.260334 -9.604583 -6.734249 -4.763023 -4.053837 -3.649374 -3.531331 -3.333169 -3.152103 -2.837385 0.000000 4.596197 4.981024 3.068520 1.451815 0.248796 0.036793 0.000678 0.000011 0.000000 0.000000 0.000000 0.000000 0.000000 0.000000 0.000000 0.000000 0.000000 0.000000 0.000000 0.000000 4.596197 4.981024 3.068520 1.451815 0.248796 0.036793 0.000678 0.000011 0.000000 0.000000 0.000000 0.000000 0.000000 0.000000 0.000000 0.000000 0.000000 0.000000 0.000000 52 2s 1.0000000 -280.338325 r*vself, r*vtotal, r*veff, (if diagnostic print out-r*vs, r*vt, calc. wvfn, mod. wvfn) 0.000000 0.256263 0.467435 0.849894 1.214335 1.718852 1.920234 1.995475 1.999794 2.000000 2.000000 2.000000 2.000000 2.000000 2.000000 2.000000 2.000000 2.000000 2.000000 2.000000 0.000000 -88.391428 -83.573402 -75.640831 -69.023146 -58.597037 -50.693035 -39.118463 -31.348174 -22.066699 -16.278186 -9.627221 -6.771971 -4.849813 -4.153682 -3.661706 -3.537931 -3.334426 -3.153403 -2.849809 0.000000 1.426866 1.179157 -0.601912 -2.078945 -2.847323 -2.173810 -0.749396 -0.196734 -0.010147 -0.000447 -0.000001 0.000000 0.000000 0.000000 0.000000 0.000000 0.000000 0.000000 0.000000 0.000000 1.426866 1.179157 -0.601912 -2.078945 -2.847323 -2.173810 -0.749396 -0.196734 -0.010147 -0.000447 -0.000001 0.000000 0.000000 0.000000 0.000000 0.000000 0.000000 0.000000 0.000000 52 2p 1.0000000 -254.205978 r*vself, r*vtotal, r*veff, (if diagnostic print out-r*vs, r*vt, calc. wvfn, mod. wvfn) 0.000000 0.265598 0.528119 1.010646 1.387694 1.804218 1.946424 1.996862 1.999844 2.000000 2.000000 2.000000 2.000000 2.000000 2.000000 2.000000 2.000000 2.000000 2.000000 2.000000 0.000000 -88.435563 -83.641893 -75.679100 -69.105452 -58.720417 -50.776093 -39.122847 -31.341818 -22.050987 -16.260333 -9.604582 -6.734248 -4.763023 -4.053836 -3.649374 -3.531330 -3.333168 -3.152102 -2.837384 0.000000 0.322038 0.946053 2.121620 2.739716 2.609672 1.819013 0.610997 0.165810 0.009593 0.000485 0.000001 0.000000 0.000000 0.000000 0.000000 0.000000 0.000000 0.000000 0.000000 0.000000 0.322038 0.946053 2.121620 2.739716 2.609672 1.819013 0.610997 0.165810 0.009593 0.000485 0.000001 0.000000 0.000000 0.000000 0.000000 0.000000 0.000000 0.000000 0.000000 52 3s 1.0000000 -52.554570 r*vself, r*vtotal, r*veff, (if diagnostic print out-r*vs, r*vt, calc. wvfn, mod. wvfn) 0.000000 0.092861 0.177489 0.339986 0.498479 0.777775 1.030192 1.499924 1.800936 1.980064 1.998530 1.999994 2.000000 2.000000 2.000000 2.000000 2.000000 2.000000 2.000000 2.000000 0.000000 -88.260823 -83.308618 -75.139506 -68.404487 -57.899330 -50.011386 -38.526207 -30.964236 -21.938652 -16.267371 -9.634799 -6.785092 -4.883993 -4.207244 -3.672921 -3.544178 -3.335665 -3.154686 -2.861427 0.000000 0.610109 0.482458 -0.324005 -0.912675 -0.797255 0.161551 1.641571 1.821008 0.931056 0.321594 0.026023 0.001759 0.000007 0.000000 0.000000 0.000000 0.000000 0.000000 0.000000 0.000000 0.610109 0.482458 -0.324005 -0.912675 -0.797255 0.161551 1.641571 1.821008 0.931056 0.321594 0.026023 0.001759 0.000007 0.000000 0.000000 0.000000 0.000000 0.000000 0.000000 52 3p 1.0000000 -43.444785 r*vself, r*vtotal, r*veff, (if diagnostic print out-r*vs, r*vt, calc. wvfn, mod. wvfn) 0.000000 0.091605 0.182606 0.356632 0.512781 0.784031 1.041733 1.507359 1.796303 1.976202 1.997852 1.999987 2.000000 2.000000 2.000000 2.000000 2.000000 2.000000 2.000000 2.000000 0.000000 -88.265538 -83.314133 -75.135659 -68.412414 -57.918405 -50.012007 -38.528421 -30.970766 -21.926773 -16.256981 -9.626959 -6.771968 -4.849813 -4.153682 -3.661706 -3.537931 -3.334426 -3.153403 -2.849809 0.000000 0.143097 0.415238 0.881322 1.011498 0.445503 -0.482906 -1.663231 -1.754880 -0.942059 -0.357674 -0.036208 -0.003113 -0.000020 0.000000 0.000000 0.000000 0.000000 0.000000 0.000000 0.000000 0.143097 0.415238 0.881322 1.011498 0.445503 -0.482906 -1.663231 -1.754880 -0.942059 -0.357674 -0.036208 -0.003113 -0.000020 0.000000 0.000000 0.000000 0.000000 0.000000 0.000000 52 3d 1.0000000 -29.197618 r*vself, r*vtotal, r*veff, (if diagnostic print out-r*vs, r*vt, calc. wvfn, mod. wvfn) 0.000000 0.086670 0.173339 0.346591 0.519102 0.853822 1.155201 1.595216 1.828250 1.975013 1.996875 1.999959 2.000000 2.000000 2.000000 2.000000 2.000000 2.000000 2.000000 2.000000 0.000000 -88.258630 -83.305876 -75.143651 -68.439423 -57.962752 -50.046387 -38.599984 -31.033612 -21.931582 -16.236814 -9.603981 -6.734231 -4.763023 -4.053836 -3.649374 -3.531330 -3.333168 -3.152102 -2.837384 0.000000 0.004450 0.029170 0.161376 0.384758 0.927535 1.381753 1.730749 1.554452 0.849695 0.370113 0.054286 0.007081 0.000111 0.000002 0.000000 0.000000 0.000000 0.000000 0.000000 0.000000 0.004450 0.029170 0.161376 0.384758 0.927535 1.381753 1.730749 1.554452 0.849695 0.370113 0.054286 0.007081 0.000111 0.000002 0.000000 0.000000 0.000000 0.000000 0.000000 52 4s 1.0000000 -8.212003 r*vself, r*vtotal, r*veff, (if diagnostic print out-r*vs, r*vt, calc. wvfn, mod. wvfn) 0.000000 0.036515 0.071450 0.140038 0.207830 0.336317 0.460289 0.700033 0.912313 1.310665 1.644498 1.938098 1.991670 1.999883 1.999999 2.000000 2.000000 2.000000 2.000000 2.000000 0.000000 -88.210660 -83.206976 -74.942548 -68.132919 -57.475902 -49.442727 -37.830206 -30.255640 -21.324901 -15.718299 -9.425107 -6.725191 -4.897863 -4.240442 -3.683165 -3.550101 -3.336888 -3.155952 -2.872314 0.000000 0.267389 0.209678 -0.147142 -0.400859 -0.315868 0.136064 0.684312 0.434844 -0.679834 -1.197092 -0.893210 -0.418462 -0.064494 -0.008477 -0.000124 -0.000002 0.000000 0.000000 0.000000 0.000000 0.267389 0.209678 -0.147142 -0.400859 -0.315868 0.136064 0.684312 0.434844 -0.679834 -1.197092 -0.893210 -0.418462 -0.064494 -0.008477 -0.000124 -0.000002 0.000000 0.000000 0.000000 52 4p 1.0000000 -5.470882 r*vself, r*vtotal, r*veff, (if diagnostic print out-r*vs, r*vt, calc. wvfn, mod. wvfn) 0.000000 0.033265 0.066427 0.131403 0.193410 0.310987 0.426683 0.648246 0.845758 1.220118 1.549124 1.891537 1.978691 1.999326 1.999981 2.000000 2.000000 2.000000 2.000000 2.000000 0.000000 -88.208320 -83.201826 -74.930223 -68.117858 -57.452464 -49.406270 -37.780940 -30.189942 -21.252046 -15.662214 -9.353181 -6.666362 -4.867207 -4.205494 -3.672918 -3.544178 -3.335665 -3.154686 -2.861427 0.000000 0.059078 0.171073 0.359652 0.404016 0.143513 -0.250341 -0.626899 -0.391655 0.553628 1.071855 0.954328 0.541280 0.125162 0.024955 0.000844 0.000026 0.000000 0.000000 0.000000 0.000000 0.059078 0.171073 0.359652 0.404016 0.143513 -0.250341 -0.626899 -0.391655 0.553628 1.071855 0.954328 0.541280 0.125162 0.024955 0.000844 0.000026 0.000000 0.000000 0.000000 52 4d 1.0000000 -1.509604 r*vself, r*vtotal, r*veff, (if diagnostic print out-r*vs, r*vt, calc. wvfn, mod. wvfn) 0.000000 0.023834 0.047669 0.095328 0.142912 0.237043 0.327973 0.496175 0.651832 0.956193 1.241112 1.645450 1.845454 1.972301 1.995174 1.999859 1.999996 2.000000 2.000000 2.000000 0.000000 -88.198162 -83.182812 -74.896601 -68.070298 -57.375141 -49.301036 -37.636824 -29.999904 -21.006039 -15.438565 -9.123350 -6.438712 -4.662808 -4.054647 -3.655550 -3.537692 -3.334426 -3.153403 -2.849809 0.000000 0.001436 0.009402 0.051824 0.122763 0.288979 0.412012 0.423765 0.209945 -0.359000 -0.736186 -0.885947 -0.733371 -0.395937 -0.193463 -0.041085 -0.008044 -0.000265 -0.000008 0.000000 0.000000 0.001436 0.009402 0.051824 0.122763 0.288979 0.412012 0.423765 0.209945 -0.359000 -0.736186 -0.885947 -0.733371 -0.395937 -0.193463 -0.041085 -0.008044 -0.000265 -0.000008 0.000000 52 7d 1.0000003 -0.039832 r*vself, r*vtotal, r*veff, (if diagnostic print out-r*vs, r*vt, calc. wvfn, mod. wvfn) 0.000000 0.000993 0.001987 0.003974 0.005960 0.009932 0.013897 0.021805 0.029692 0.045456 0.061180 0.092344 0.123236 0.184858 0.246290 0.365660 0.475690 0.668104 0.849213 1.175932 0.000000 -88.497085 -83.569893 -75.321880 -68.571616 -57.890371 -49.726321 -38.016685 -30.217983 -20.718686 -14.909398 -8.145691 -5.106838 -3.098395 -2.506549 -2.026886 -2.000108 -1.999997 -1.999997 -1.999997 0.000000 0.000061 0.000402 0.002213 0.005226 0.012201 0.017195 0.016984 0.007256 -0.016895 -0.031237 -0.031820 -0.018013 0.015198 0.046962 0.096582 0.117787 0.059938 -0.058753 -0.134044 0.000000 0.000062 0.000403 0.002217 0.005237 0.012227 0.017231 0.017020 0.007272 -0.016928 -0.031303 -0.031908 -0.018105 0.015100 0.046869 0.096521 0.117776 0.060018 -0.058658 -0.134080 52 26.34 0.000331 351 -1 51 0.20 0.20 0.20 0.20 0.20 0.20 0.20 0.20 0.45 0.20 53 ru,ruee,ruexch -94.000000 -88.425184 -83.474178 -75.211471 -68.439956 -57.750309 -49.600970 -37.906445 -30.146946 -20.728869 -14.999513 -8.416509 -5.482850 -3.428984 -2.698531 -2.056763 -1.905117 -1.605914 -1.447851 -1.414295 0.000000 6.284714 11.487023 19.950088 27.013546 37.979610 46.156107 58.241383 66.108022 75.116890 81.008960 87.771759 90.433266 91.903605 92.197928 92.364266 92.475670 92.668126 92.849240 93.175960 0.000000 -0.709898 -0.961201 -1.161559 -1.453502 -1.729919 -1.757078 -2.147828 -2.254968 -1.845759 -2.008472 -2.188268 -1.916116 -1.332589 -0.896460 -0.421028 -0.380787 -0.274040 -0.297091 -0.590255 53 1s 1.0000003 -1885.067443 r*vself, r*vtotal, r*veff, (if diagnostic print out-r*vs, r*vt, calc. wvfn, mod. wvfn) 0.000000 1.032295 1.589650 1.937501 1.991428 1.999859 1.999998 2.000001 2.000001 2.000001 2.000001 2.000001 2.000001 2.000001 2.000001 2.000001 2.000001 2.000001 2.000001 2.000001 0.000000 -88.798228 -84.201759 -76.464735 -69.857798 -59.134652 -50.975047 -39.143243 -31.343547 -22.050999 -16.260333 -9.604581 -6.734244 -4.763016 -4.053827 -3.649361 -3.531315 -3.333149 -3.152080 -2.837356 0.000000 4.596197 4.981024 3.068520 1.451815 0.248796 0.036793 0.000678 0.000011 0.000000 0.000000 0.000000 0.000000 0.000000 0.000000 0.000000 0.000000 0.000000 0.000000 0.000000 0.000000 4.596197 4.981024 3.068520 1.451815 0.248796 0.036793 0.000678 0.000011 0.000000 0.000000 0.000000 0.000000 0.000000 0.000000 0.000000 0.000000 0.000000 0.000000 0.000000 53 2s 1.0000000 -280.338325 r*vself, r*vtotal, r*veff, (if diagnostic print out-r*vs, r*vt, calc. wvfn, mod. wvfn) 0.000000 0.256263 0.467435 0.849894 1.214335 1.718852 1.920234 1.995475 1.999794 2.000000 2.000000 2.000000 2.000000 2.000000 2.000000 2.000000 2.000000 2.000000 2.000000 2.000000 0.000000 -88.391428 -83.573402 -75.640831 -69.023146 -58.597037 -50.693035 -39.118463 -31.348173 -22.066698 -16.278185 -9.627219 -6.771967 -4.849806 -4.153672 -3.661694 -3.537915 -3.334405 -3.153381 -2.849778 0.000000 1.426866 1.179157 -0.601912 -2.078945 -2.847323 -2.173810 -0.749396 -0.196734 -0.010147 -0.000447 -0.000001 0.000000 0.000000 0.000000 0.000000 0.000000 0.000000 0.000000 0.000000 0.000000 1.426866 1.179157 -0.601912 -2.078945 -2.847323 -2.173810 -0.749396 -0.196734 -0.010147 -0.000447 -0.000001 0.000000 0.000000 0.000000 0.000000 0.000000 0.000000 0.000000 0.000000 53 2p 1.0000000 -254.205977 r*vself, r*vtotal, r*veff, (if diagnostic print out-r*vs, r*vt, calc. wvfn, mod. wvfn) 0.000000 0.265598 0.528119 1.010646 1.387694 1.804218 1.946424 1.996862 1.999844 2.000000 2.000000 2.000000 2.000000 2.000000 2.000000 2.000000 2.000000 2.000000 2.000000 2.000000 0.000000 -88.435563 -83.641893 -75.679100 -69.105452 -58.720417 -50.776093 -39.122847 -31.341818 -22.050986 -16.260332 -9.604580 -6.734244 -4.763015 -4.053826 -3.649360 -3.531314 -3.333149 -3.152080 -2.837356 0.000000 0.322038 0.946053 2.121620 2.739716 2.609672 1.819013 0.610997 0.165810 0.009593 0.000485 0.000001 0.000000 0.000000 0.000000 0.000000 0.000000 0.000000 0.000000 0.000000 0.000000 0.322038 0.946053 2.121620 2.739716 2.609672 1.819013 0.610997 0.165810 0.009593 0.000485 0.000001 0.000000 0.000000 0.000000 0.000000 0.000000 0.000000 0.000000 0.000000 53 3s 1.0000000 -52.554569 r*vself, r*vtotal, r*veff, (if diagnostic print out-r*vs, r*vt, calc. wvfn, mod. wvfn) 0.000000 0.092861 0.177489 0.339986 0.498479 0.777775 1.030192 1.499924 1.800936 1.980064 1.998530 1.999994 2.000000 2.000000 2.000000 2.000000 2.000000 2.000000 2.000000 2.000000 0.000000 -88.260823 -83.308618 -75.139506 -68.404487 -57.899329 -50.011386 -38.526206 -30.964235 -21.938651 -16.267370 -9.634797 -6.785088 -4.883985 -4.207234 -3.672911 -3.544163 -3.335643 -3.154666 -2.861395 0.000000 0.610109 0.482458 -0.324005 -0.912675 -0.797255 0.161551 1.641571 1.821008 0.931056 0.321594 0.026023 0.001759 0.000007 0.000000 0.000000 0.000000 0.000000 0.000000 0.000000 0.000000 0.610109 0.482458 -0.324005 -0.912675 -0.797255 0.161551 1.641571 1.821008 0.931056 0.321594 0.026023 0.001759 0.000007 0.000000 0.000000 0.000000 0.000000 0.000000 0.000000 53 3p 1.0000000 -43.444785 r*vself, r*vtotal, r*veff, (if diagnostic print out-r*vs, r*vt, calc. wvfn, mod. wvfn) 0.000000 0.091605 0.182606 0.356632 0.512781 0.784031 1.041733 1.507359 1.796303 1.976202 1.997852 1.999987 2.000000 2.000000 2.000000 2.000000 2.000000 2.000000 2.000000 2.000000 0.000000 -88.265538 -83.314133 -75.135659 -68.412414 -57.918405 -50.012007 -38.528420 -30.970766 -21.926773 -16.256980 -9.626956 -6.771964 -4.849805 -4.153672 -3.661694 -3.537915 -3.334405 -3.153381 -2.849778 0.000000 0.143097 0.415238 0.881322 1.011498 0.445503 -0.482906 -1.663231 -1.754880 -0.942059 -0.357674 -0.036208 -0.003113 -0.000020 0.000000 0.000000 0.000000 0.000000 0.000000 0.000000 0.000000 0.143097 0.415238 0.881322 1.011498 0.445503 -0.482906 -1.663231 -1.754880 -0.942059 -0.357674 -0.036208 -0.003113 -0.000020 0.000000 0.000000 0.000000 0.000000 0.000000 0.000000 53 3d 1.0000000 -29.197617 r*vself, r*vtotal, r*veff, (if diagnostic print out-r*vs, r*vt, calc. wvfn, mod. wvfn) 0.000000 0.086670 0.173339 0.346591 0.519102 0.853822 1.155201 1.595216 1.828250 1.975013 1.996875 1.999959 2.000000 2.000000 2.000000 2.000000 2.000000 2.000000 2.000000 2.000000 0.000000 -88.258630 -83.305876 -75.143651 -68.439423 -57.962752 -50.046387 -38.599984 -31.033612 -21.931581 -16.236813 -9.603978 -6.734227 -4.763015 -4.053826 -3.649361 -3.531314 -3.333149 -3.152080 -2.837356 0.000000 0.004450 0.029170 0.161376 0.384758 0.927535 1.381753 1.730749 1.554452 0.849695 0.370113 0.054286 0.007081 0.000111 0.000002 0.000000 0.000000 0.000000 0.000000 0.000000 0.000000 0.004450 0.029170 0.161376 0.384758 0.927535 1.381753 1.730749 1.554452 0.849695 0.370113 0.054286 0.007081 0.000111 0.000002 0.000000 0.000000 0.000000 0.000000 0.000000 53 4s 1.0000000 -8.212001 r*vself, r*vtotal, r*veff, (if diagnostic print out-r*vs, r*vt, calc. wvfn, mod. wvfn) 0.000000 0.036515 0.071450 0.140038 0.207830 0.336317 0.460289 0.700033 0.912313 1.310665 1.644498 1.938098 1.991670 1.999883 1.999999 2.000000 2.000000 2.000000 2.000000 2.000000 0.000000 -88.210660 -83.206976 -74.942548 -68.132919 -57.475902 -49.442727 -37.830205 -30.255640 -21.324900 -15.718298 -9.425105 -6.725187 -4.897855 -4.240432 -3.683156 -3.550086 -3.336865 -3.155933 -2.872281 0.000000 0.267389 0.209678 -0.147142 -0.400859 -0.315868 0.136064 0.684312 0.434844 -0.679834 -1.197092 -0.893210 -0.418462 -0.064494 -0.008477 -0.000124 -0.000002 0.000000 0.000000 0.000000 0.000000 0.267389 0.209678 -0.147142 -0.400859 -0.315868 0.136064 0.684312 0.434844 -0.679834 -1.197092 -0.893210 -0.418462 -0.064494 -0.008477 -0.000124 -0.000002 0.000000 0.000000 0.000000 53 4p 1.0000000 -5.470880 r*vself, r*vtotal, r*veff, (if diagnostic print out-r*vs, r*vt, calc. wvfn, mod. wvfn) 0.000000 0.033265 0.066427 0.131403 0.193410 0.310987 0.426683 0.648246 0.845758 1.220118 1.549124 1.891537 1.978691 1.999326 1.999981 2.000000 2.000000 2.000000 2.000000 2.000000 0.000000 -88.208320 -83.201826 -74.930223 -68.117857 -57.452464 -49.406270 -37.780940 -30.189941 -21.252045 -15.662213 -9.353179 -6.666358 -4.867199 -4.205485 -3.672907 -3.544163 -3.335644 -3.154666 -2.861395 0.000000 0.059078 0.171073 0.359652 0.404016 0.143513 -0.250341 -0.626899 -0.391655 0.553628 1.071856 0.954328 0.541280 0.125162 0.024955 0.000844 0.000026 0.000000 0.000000 0.000000 0.000000 0.059078 0.171073 0.359652 0.404016 0.143513 -0.250341 -0.626899 -0.391655 0.553628 1.071855 0.954328 0.541280 0.125162 0.024955 0.000844 0.000026 0.000000 0.000000 0.000000 53 4d 1.0000000 -1.509601 r*vself, r*vtotal, r*veff, (if diagnostic print out-r*vs, r*vt, calc. wvfn, mod. wvfn) 0.000000 0.023834 0.047669 0.095328 0.142912 0.237043 0.327973 0.496175 0.651832 0.956193 1.241112 1.645450 1.845454 1.972301 1.995174 1.999859 1.999996 2.000000 2.000000 2.000000 0.000000 -88.198162 -83.182812 -74.896600 -68.070298 -57.375141 -49.301035 -37.636823 -29.999904 -21.006038 -15.438564 -9.123348 -6.438707 -4.662800 -4.054637 -3.655538 -3.537677 -3.334405 -3.153381 -2.849778 0.000000 0.001436 0.009402 0.051824 0.122763 0.288979 0.412012 0.423765 0.209945 -0.359000 -0.736186 -0.885947 -0.733371 -0.395937 -0.193463 -0.041085 -0.008044 -0.000265 -0.000008 0.000000 0.000000 0.001436 0.009402 0.051824 0.122763 0.288979 0.412012 0.423765 0.209945 -0.359000 -0.736186 -0.885947 -0.733371 -0.395937 -0.193463 -0.041085 -0.008044 -0.000265 -0.000008 0.000000 53 7d 1.0000003 -0.039822 r*vself, r*vtotal, r*veff, (if diagnostic print out-r*vs, r*vt, calc. wvfn, mod. wvfn) 0.000000 0.000993 0.001987 0.003974 0.005960 0.009932 0.013898 0.021806 0.029693 0.045458 0.061182 0.092346 0.123241 0.184866 0.246301 0.365675 0.475707 0.668123 0.849238 1.175957 0.000000 -88.497045 -83.569783 -75.321615 -68.571118 -57.889384 -49.724918 -38.013989 -30.214124 -20.713859 -14.902320 -8.134011 -5.093219 -3.098395 -2.506547 -2.026884 -2.000108 -1.999997 -1.999997 -1.999997 0.000000 0.000062 0.000404 0.002223 0.005251 0.012258 0.017276 0.017065 0.007293 -0.016969 -0.031386 -0.032017 -0.018220 0.014978 0.046753 0.096446 0.117762 0.060118 -0.058539 -0.134125 0.000000 0.000062 0.000403 0.002218 0.005240 0.012233 0.017240 0.017029 0.007276 -0.016936 -0.031320 -0.031929 -0.018128 0.015076 0.046846 0.096506 0.117773 0.060038 -0.058634 -0.134089 53 27.36 -0.000331 351 -1 52 0.30 0.20 0.20 0.20 0.20 0.20 0.20 0.20 0.30 0.20 54 ru,ruee,ruexch -94.000000 -88.425184 -83.474178 -75.211471 -68.439956 -57.750309 -49.600971 -37.906445 -30.146946 -20.728870 -14.999514 -8.416511 -5.482854 -3.428992 -2.698541 -2.056762 -1.905128 -1.605994 -1.447795 -1.414347 0.000000 6.284714 11.487023 19.950088 27.013546 37.979610 46.156107 58.241383 66.108022 75.116890 81.008958 87.771757 90.433262 91.903597 92.197917 92.364251 92.475653 92.668107 92.849216 93.175934 0.000000 -0.709898 -0.961201 -1.161559 -1.453502 -1.729919 -1.757078 -2.147828 -2.254968 -1.845759 -2.008472 -2.188268 -1.916116 -1.332589 -0.896458 -0.421013 -0.380782 -0.274101 -0.297011 -0.590281 54 1s 1.0000003 -1885.067443 r*vself, r*vtotal, r*veff, (if diagnostic print out-r*vs, r*vt, calc. wvfn, mod. wvfn) 0.000000 1.032295 1.589650 1.937501 1.991428 1.999859 1.999998 2.000001 2.000001 2.000001 2.000001 2.000001 2.000001 2.000001 2.000001 2.000001 2.000001 2.000001 2.000001 2.000001 0.000000 -88.798228 -84.201759 -76.464735 -69.857798 -59.134652 -50.975047 -39.143243 -31.343548 -22.051000 -16.260334 -9.604583 -6.734249 -4.763023 -4.053837 -3.649374 -3.531331 -3.333169 -3.152103 -2.837385 0.000000 4.596197 4.981024 3.068520 1.451815 0.248796 0.036793 0.000678 0.000011 0.000000 0.000000 0.000000 0.000000 0.000000 0.000000 0.000000 0.000000 0.000000 0.000000 0.000000 0.000000 4.596197 4.981024 3.068520 1.451815 0.248796 0.036793 0.000678 0.000011 0.000000 0.000000 0.000000 0.000000 0.000000 0.000000 0.000000 0.000000 0.000000 0.000000 0.000000 54 2s 1.0000000 -280.338326 r*vself, r*vtotal, r*veff, (if diagnostic print out-r*vs, r*vt, calc. wvfn, mod. wvfn) 0.000000 0.256263 0.467435 0.849894 1.214335 1.718852 1.920234 1.995475 1.999794 2.000000 2.000000 2.000000 2.000000 2.000000 2.000000 2.000000 2.000000 2.000000 2.000000 2.000000 0.000000 -88.391428 -83.573402 -75.640831 -69.023146 -58.597037 -50.693035 -39.118463 -31.348174 -22.066699 -16.278186 -9.627221 -6.771971 -4.849813 -4.153682 -3.661706 -3.537931 -3.334426 -3.153403 -2.849809 0.000000 1.426866 1.179157 -0.601912 -2.078945 -2.847323 -2.173810 -0.749396 -0.196734 -0.010147 -0.000447 -0.000001 0.000000 0.000000 0.000000 0.000000 0.000000 0.000000 0.000000 0.000000 0.000000 1.426866 1.179157 -0.601912 -2.078945 -2.847323 -2.173810 -0.749396 -0.196734 -0.010147 -0.000447 -0.000001 0.000000 0.000000 0.000000 0.000000 0.000000 0.000000 0.000000 0.000000 54 2p 1.0000000 -254.205978 r*vself, r*vtotal, r*veff, (if diagnostic print out-r*vs, r*vt, calc. wvfn, mod. wvfn) 0.000000 0.265598 0.528119 1.010646 1.387694 1.804218 1.946424 1.996862 1.999844 2.000000 2.000000 2.000000 2.000000 2.000000 2.000000 2.000000 2.000000 2.000000 2.000000 2.000000 0.000000 -88.435563 -83.641893 -75.679100 -69.105452 -58.720417 -50.776093 -39.122847 -31.341819 -22.050987 -16.260333 -9.604582 -6.734248 -4.763023 -4.053836 -3.649374 -3.531330 -3.333168 -3.152102 -2.837384 0.000000 0.322038 0.946053 2.121620 2.739716 2.609672 1.819013 0.610997 0.165810 0.009593 0.000485 0.000001 0.000000 0.000000 0.000000 0.000000 0.000000 0.000000 0.000000 0.000000 0.000000 0.322038 0.946053 2.121620 2.739716 2.609672 1.819013 0.610997 0.165810 0.009593 0.000485 0.000001 0.000000 0.000000 0.000000 0.000000 0.000000 0.000000 0.000000 0.000000 54 3s 1.0000000 -52.554570 r*vself, r*vtotal, r*veff, (if diagnostic print out-r*vs, r*vt, calc. wvfn, mod. wvfn) 0.000000 0.092861 0.177489 0.339986 0.498479 0.777775 1.030192 1.499924 1.800936 1.980064 1.998530 1.999994 2.000000 2.000000 2.000000 2.000000 2.000000 2.000000 2.000000 2.000000 0.000000 -88.260823 -83.308618 -75.139506 -68.404487 -57.899330 -50.011386 -38.526207 -30.964236 -21.938652 -16.267371 -9.634799 -6.785092 -4.883993 -4.207244 -3.672921 -3.544178 -3.335665 -3.154686 -2.861427 0.000000 0.610109 0.482458 -0.324005 -0.912675 -0.797255 0.161551 1.641571 1.821008 0.931056 0.321594 0.026023 0.001759 0.000007 0.000000 0.000000 0.000000 0.000000 0.000000 0.000000 0.000000 0.610109 0.482458 -0.324005 -0.912675 -0.797255 0.161551 1.641571 1.821008 0.931056 0.321594 0.026023 0.001759 0.000007 0.000000 0.000000 0.000000 0.000000 0.000000 0.000000 54 3p 1.0000000 -43.444786 r*vself, r*vtotal, r*veff, (if diagnostic print out-r*vs, r*vt, calc. wvfn, mod. wvfn) 0.000000 0.091605 0.182606 0.356632 0.512781 0.784031 1.041733 1.507359 1.796303 1.976202 1.997852 1.999987 2.000000 2.000000 2.000000 2.000000 2.000000 2.000000 2.000000 2.000000 0.000000 -88.265538 -83.314133 -75.135659 -68.412414 -57.918405 -50.012007 -38.528421 -30.970766 -21.926773 -16.256981 -9.626959 -6.771968 -4.849813 -4.153682 -3.661706 -3.537931 -3.334426 -3.153403 -2.849809 0.000000 0.143097 0.415238 0.881322 1.011498 0.445503 -0.482906 -1.663231 -1.754880 -0.942059 -0.357674 -0.036208 -0.003113 -0.000020 0.000000 0.000000 0.000000 0.000000 0.000000 0.000000 0.000000 0.143097 0.415238 0.881322 1.011498 0.445503 -0.482906 -1.663231 -1.754880 -0.942059 -0.357674 -0.036208 -0.003113 -0.000020 0.000000 0.000000 0.000000 0.000000 0.000000 0.000000 54 3d 1.0000000 -29.197618 r*vself, r*vtotal, r*veff, (if diagnostic print out-r*vs, r*vt, calc. wvfn, mod. wvfn) 0.000000 0.086670 0.173339 0.346591 0.519102 0.853822 1.155201 1.595216 1.828250 1.975013 1.996875 1.999959 2.000000 2.000000 2.000000 2.000000 2.000000 2.000000 2.000000 2.000000 0.000000 -88.258630 -83.305876 -75.143651 -68.439423 -57.962752 -50.046387 -38.599984 -31.033612 -21.931582 -16.236814 -9.603981 -6.734231 -4.763023 -4.053836 -3.649374 -3.531330 -3.333168 -3.152102 -2.837384 0.000000 0.004450 0.029170 0.161376 0.384758 0.927535 1.381753 1.730749 1.554452 0.849695 0.370113 0.054286 0.007081 0.000111 0.000002 0.000000 0.000000 0.000000 0.000000 0.000000 0.000000 0.004450 0.029170 0.161376 0.384758 0.927535 1.381753 1.730749 1.554452 0.849695 0.370113 0.054286 0.007081 0.000111 0.000002 0.000000 0.000000 0.000000 0.000000 0.000000 54 4s 1.0000000 -8.212003 r*vself, r*vtotal, r*veff, (if diagnostic print out-r*vs, r*vt, calc. wvfn, mod. wvfn) 0.000000 0.036515 0.071450 0.140038 0.207830 0.336317 0.460289 0.700033 0.912313 1.310665 1.644498 1.938098 1.991670 1.999883 1.999999 2.000000 2.000000 2.000000 2.000000 2.000000 0.000000 -88.210660 -83.206976 -74.942548 -68.132919 -57.475902 -49.442727 -37.830206 -30.255640 -21.324901 -15.718299 -9.425107 -6.725191 -4.897863 -4.240442 -3.683165 -3.550101 -3.336888 -3.155952 -2.872314 0.000000 0.267389 0.209678 -0.147142 -0.400859 -0.315868 0.136064 0.684312 0.434844 -0.679834 -1.197092 -0.893210 -0.418462 -0.064494 -0.008477 -0.000124 -0.000002 0.000000 0.000000 0.000000 0.000000 0.267389 0.209678 -0.147142 -0.400859 -0.315868 0.136064 0.684312 0.434844 -0.679834 -1.197092 -0.893210 -0.418462 -0.064494 -0.008477 -0.000124 -0.000002 0.000000 0.000000 0.000000 54 4p 1.0000000 -5.470882 r*vself, r*vtotal, r*veff, (if diagnostic print out-r*vs, r*vt, calc. wvfn, mod. wvfn) 0.000000 0.033265 0.066427 0.131403 0.193410 0.310987 0.426683 0.648246 0.845758 1.220118 1.549124 1.891537 1.978691 1.999326 1.999981 2.000000 2.000000 2.000000 2.000000 2.000000 0.000000 -88.208320 -83.201826 -74.930223 -68.117858 -57.452464 -49.406270 -37.780940 -30.189942 -21.252046 -15.662215 -9.353181 -6.666362 -4.867207 -4.205494 -3.672918 -3.544178 -3.335665 -3.154686 -2.861427 0.000000 0.059078 0.171073 0.359652 0.404016 0.143513 -0.250341 -0.626899 -0.391655 0.553628 1.071855 0.954328 0.541280 0.125162 0.024955 0.000844 0.000026 0.000000 0.000000 0.000000 0.000000 0.059078 0.171073 0.359652 0.404016 0.143513 -0.250341 -0.626899 -0.391655 0.553628 1.071855 0.954328 0.541280 0.125162 0.024955 0.000844 0.000026 0.000000 0.000000 0.000000 54 4d 1.0000000 -1.509604 r*vself, r*vtotal, r*veff, (if diagnostic print out-r*vs, r*vt, calc. wvfn, mod. wvfn) 0.000000 0.023834 0.047669 0.095328 0.142912 0.237043 0.327973 0.496175 0.651832 0.956193 1.241112 1.645450 1.845454 1.972301 1.995174 1.999859 1.999996 2.000000 2.000000 2.000000 0.000000 -88.198162 -83.182812 -74.896601 -68.070298 -57.375141 -49.301036 -37.636824 -29.999904 -21.006039 -15.438565 -9.123350 -6.438712 -4.662808 -4.054647 -3.655550 -3.537692 -3.334426 -3.153403 -2.849809 0.000000 0.001436 0.009402 0.051824 0.122763 0.288979 0.412012 0.423765 0.209945 -0.359000 -0.736186 -0.885947 -0.733371 -0.395937 -0.193463 -0.041085 -0.008044 -0.000265 -0.000008 0.000000 0.000000 0.001436 0.009402 0.051824 0.122763 0.288979 0.412012 0.423765 0.209945 -0.359000 -0.736186 -0.885947 -0.733371 -0.395937 -0.193463 -0.041085 -0.008044 -0.000265 -0.000008 0.000000 54 7d 1.0000003 -0.039832 r*vself, r*vtotal, r*veff, (if diagnostic print out-r*vs, r*vt, calc. wvfn, mod. wvfn) 0.000000 0.000993 0.001987 0.003974 0.005960 0.009932 0.013897 0.021805 0.029692 0.045456 0.061180 0.092344 0.123236 0.184858 0.246290 0.365660 0.475690 0.668104 0.849213 1.175932 0.000000 -88.497085 -83.569893 -75.321880 -68.571616 -57.890371 -49.726321 -38.016685 -30.217983 -20.718686 -14.909398 -8.145691 -5.106838 -3.098395 -2.506549 -2.026886 -2.000108 -1.999997 -1.999997 -1.999997 0.000000 0.000061 0.000402 0.002213 0.005226 0.012201 0.017195 0.016984 0.007256 -0.016895 -0.031237 -0.031820 -0.018013 0.015198 0.046962 0.096582 0.117787 0.059938 -0.058753 -0.134044 0.000000 0.000062 0.000403 0.002217 0.005237 0.012227 0.017231 0.017020 0.007272 -0.016928 -0.031303 -0.031908 -0.018105 0.015100 0.046869 0.096521 0.117776 0.060018 -0.058658 -0.134080 54 28.01 0.000331 351 -1 53 0.20 0.20 0.20 0.20 0.20 0.20 0.20 0.20 0.30 0.20 t(run)= 28.51, t(job)= 245.47 seconds nl wnl ee az (r-3) (r-2) (r-1) (r+1) (r+2) (r+3) (r+4) (r+6) 1s 2. -1885.06744 881.507 0.000E+00 5.213E+03 4.936E+01 3.112E-02 1.308E-03 6.934E-05 4.438E-06 2.867E-08 2s 2. -280.33833 295.095 0.000E+00 5.731E+02 1.123E+01 1.350E-01 2.146E-02 3.880E-03 7.892E-04 4.505E-05 2p 6. -254.20598 3360.692 3.659E+03 1.600E+02 1.083E+01 1.175E-01 1.683E-02 2.853E-03 5.593E-04 3.126E-05 3s 2. -52.55457 127.553 0.000E+00 1.088E+02 3.931E+00 3.700E-01 1.565E-01 7.318E-02 3.748E-02 1.276E-02 3p 6. -43.44479 1500.439 6.406E+02 3.004E+01 3.735E+00 3.687E-01 1.577E-01 7.538E-02 3.987E-02 1.484E-02 3d 10. -29.19762 3211.670 9.185E+01 1.570E+01 3.533E+00 3.450E-01 1.415E-01 6.773E-02 3.720E-02 1.614E-02 4s 2. -8.21200 56.016 0.000E+00 2.149E+01 1.516E+00 9.139E-01 9.475E-01 1.082E+00 1.354E+00 2.767E+00 4p 6. -5.47088 619.963 1.071E+02 5.509E+00 1.356E+00 1.004E+00 1.156E+00 1.486E+00 2.119E+00 5.842E+00 4d 10. -1.50960 1036.492 8.403E+00 1.825E+00 9.715E-01 1.397E+00 2.376E+00 4.806E+00 1.145E+01 1.009E+02 7d 1. -0.03983 44.509 1.506E-02 5.848E-03 4.049E-02 3.468E+01 1.363E+03 5.730E+04 2.528E+06 5.576E+09 47. 1.318E+04 2.727E+02 6.394E+01 1.399E+03 5.736E+04 2.528E+06 5.576E+09 1. 2.804E+02 5.802E+00 1.361E+00 2.976E+01 1.220E+03 5.379E+04 1.186E+08 --------------------zeta--------------------- nl wnl ----blume-watson---- -----(r*vi)----- i (ryd) eps s evel edar evel+edar erel (ryd) (cm-1) (ryd) (cm-1) 1s 2. 0.00000 0.000 0.00000 0.000-2274.99731 -1876.80387 -398.58177 331.78500 -66.797 -1943.60065 2s 2. 0.00000 0.000 0.00000 0.000 -567.83950 -281.62336 -54.21010 36.23415 -17.976 -299.59932 2p 6. 8.55158 938426.772 8.80416 966144.842 -555.32084 -254.35327 -7.22339 -0.01376 -7.223 -261.57667 3s 2. 0.00000 0.000 0.00000 0.000 -234.94455 -54.15970 -10.56400 6.74663 -3.817 -57.97707 3p 6. 1.49473 164028.079 1.53292 168218.891 -227.34853 -45.00752 -1.64589 -0.00221 -1.646 -46.65341 3d 10. 0.17191 18864.969 0.18429 20224.030 -218.95187 -30.42347 -0.37676 -0.01081 -0.377 -30.80023 4s 2. 0.00000 0.000 0.00000 0.000 -108.22117 -8.97413 -2.06002 1.30043 -0.760 -9.73371 4p 6. 0.24966 27396.924 0.25575 28064.821 -99.37757 -6.18983 -0.29109 -0.00026 -0.291 -6.48092 4d 10. 0.01547 1697.885 0.01644 1804.609 -75.86665 -2.03402 -0.03954 -0.00095 -0.040 -2.07356 7d 1. 0.00003 3.037 0.00003 3.210 -3.74103 -0.03107 -0.00007 0.00000 0.000 -0.03114 ag i d10 7d nconf= 14 z= 47 ion= 0 kut=-1 exf=0.650 corrf=0.000 ca1=0.700 ca0=0.500 without correlation with correlation ----------------------- ----------------------- nl wnl eps fg eps fgr corr eps fg eps fgr n*r n*rc ect ec----------------- 1s 2. -1885.91307 -1885.91307-0.08290 -1885.99598 -1885.99598 0.0230 0.0230 -0.08267 0.00000-0.08267 2s 2. -284.68661 -284.68661-0.08232 -284.76893 -284.76893 0.0593 0.0593 -0.23110 -0.06744-0.08099 2p 6. -255.32145 -255.32145-0.08242 -255.40387 -255.40387 0.0626 0.0626 -0.72296 -0.08169-0.08186-0.08197-0.08206-0.08218 3s 2. -55.49346 -55.49346-0.08107 -55.57453 -55.57453 0.1342 0.1341 -0.86759 -0.06668-0.07795 3p 6. -45.54121 -45.54121-0.08107 -45.62228 -45.62228 0.1482 0.1481 -1.34526 -0.07880-0.07928-0.07960-0.07983-0.08015 3d 10. -29.74847 -29.74847-0.08120 -29.82967 -29.82967 0.1833 0.1831 -2.15235 -0.08039-0.08049-0.08057-0.08064-0.08095 4s 2. -9.24443 -9.24443-0.07796 -9.32239 -9.32239 0.3289 0.3275 -2.28891 -0.06401-0.07255 4p 6. -6.18065 -6.18065-0.07741 -6.25806 -6.25806 0.4022 0.3997 -2.73478 -0.07233-0.07355-0.07430-0.07484-0.07559 4d 10. -1.65610 -1.65610-0.07409 -1.73019 -1.73019 0.7771 0.7602 -3.45989 -0.06933-0.07096-0.07175-0.07230-0.07408 7d 1. -0.03947 -0.03947-0.00105 -0.04051 -0.04051 5.0338 4.9684 -3.46094 -0.00105 ecorrt= -3.64773 (old) ect= -3.46094 (new) etotrl= 0.00000 + 0.00000 + 0.00000 etot= -10621.61659 -10621.61659 -10625.26432 -10625.26432 -10625.07753 -10625.07753 -10625.07753 ag i d10 7d 2 -10625.0775 0 0.0030 2 t(run)= 33.52, t(job)= 250.48 seconds 47 1ag i d10 8d 4d10 8d ag i d10 8d nconf= 15 z= 47 ncores= 9 nvales= 1 ion= 0 r(i)/x(i)=0.24532669 ca1=0.700 tolstb=1.000 tolk-2=1.00000 tolend= 0.5E-07 thresh= 0.1E-10 kut= 0 exf=1.000 corrf=0.000 ca0= 0.500 rcn mod 32 ihf1= 0 mesh=2601 idb= 481 rdb= 100.461 emx= 0.10 r(mesh)=5426.209 irel= 1 ib=2600 t(run)= 13.55, t(job)= 264.04 seconds nl wnl ee az (r-3) (r-2) (r-1) (r+1) (r+2) (r+3) (r+4) (r+6) 1s 2. -1885.09147 881.507 0.000E+00 5.213E+03 4.936E+01 3.112E-02 1.308E-03 6.934E-05 4.438E-06 2.867E-08 2s 2. -280.36236 295.095 0.000E+00 5.731E+02 1.123E+01 1.350E-01 2.146E-02 3.880E-03 7.892E-04 4.505E-05 2p 6. -254.23002 3360.692 3.659E+03 1.600E+02 1.083E+01 1.175E-01 1.683E-02 2.853E-03 5.593E-04 3.126E-05 3s 2. -52.57861 127.553 0.000E+00 1.088E+02 3.931E+00 3.700E-01 1.565E-01 7.318E-02 3.748E-02 1.276E-02 3p 6. -43.46882 1500.439 6.406E+02 3.004E+01 3.735E+00 3.687E-01 1.577E-01 7.538E-02 3.987E-02 1.484E-02 3d 10. -29.22165 3211.670 9.185E+01 1.570E+01 3.533E+00 3.450E-01 1.415E-01 6.773E-02 3.720E-02 1.614E-02 4s 2. -8.23603 56.016 0.000E+00 2.149E+01 1.516E+00 9.139E-01 9.475E-01 1.082E+00 1.354E+00 2.767E+00 4p 6. -5.49491 619.964 1.071E+02 5.509E+00 1.356E+00 1.004E+00 1.156E+00 1.486E+00 2.119E+00 5.841E+00 4d 10. -1.53363 1036.524 8.403E+00 1.825E+00 9.716E-01 1.397E+00 2.375E+00 4.804E+00 1.144E+01 1.007E+02 8d 1. -0.02770 34.944 9.263E-03 3.497E-03 2.813E-02 5.117E+01 2.952E+03 1.810E+05 1.157E+07 5.233E+10 47. 1.318E+04 2.727E+02 8.043E+01 2.988E+03 1.811E+05 1.157E+07 5.233E+10 1. 2.804E+02 5.802E+00 1.711E+00 6.357E+01 3.852E+03 2.462E+05 1.113E+09 --------------------zeta--------------------- nl wnl ----blume-watson---- -----(r*vi)----- i (ryd) eps s evel edar evel+edar erel (ryd) (cm-1) (ryd) (cm-1) 1s 2. 0.00000 0.000 0.00000 0.000-2274.99730 -1876.82791 -398.58176 331.78496 -66.797 -1943.62471 2s 2. 0.00000 0.000 0.00000 0.000 -567.83950 -281.64740 -54.21010 36.23414 -17.976 -299.62336 2p 6. 8.55158 938426.773 8.80416 966144.843 -555.32084 -254.37731 -7.22339 -0.01376 -7.223 -261.60070 3s 2. 0.00000 0.000 0.00000 0.000 -234.94455 -54.18374 -10.56400 6.74662 -3.817 -58.00111 3p 6. 1.49473 164028.086 1.53292 168218.898 -227.34853 -45.03156 -1.64589 -0.00221 -1.646 -46.67744 3d 10. 0.17191 18864.970 0.18429 20224.031 -218.95187 -30.44751 -0.37676 -0.01081 -0.377 -30.82426 4s 2. 0.00000 0.000 0.00000 0.000 -108.22120 -8.99816 -2.06002 1.30044 -0.760 -9.75774 4p 6. 0.24966 27396.981 0.25575 28064.879 -99.37764 -6.21385 -0.29109 -0.00026 -0.291 -6.50494 4d 10. 0.01547 1697.989 0.01645 1804.719 -75.86887 -2.05803 -0.03955 -0.00095 -0.040 -2.09757 8d 1. 0.00002 1.870 0.00002 1.978 -2.60095 -0.02206 -0.00004 0.00000 0.000 -0.02211 ag i d10 8d nconf= 15 z= 47 ion= 0 kut=-1 exf=0.650 corrf=0.000 ca1=0.700 ca0=0.500 without correlation with correlation ----------------------- ----------------------- nl wnl eps fg eps fgr corr eps fg eps fgr n*r n*rc ect ec----------------- 1s 2. -1885.93710 -1885.93710-0.08290 -1886.02001 -1886.02001 0.0230 0.0230 -0.08267 0.00000-0.08267 2s 2. -284.71064 -284.71064-0.08232 -284.79296 -284.79296 0.0593 0.0593 -0.23110 -0.06744-0.08099 2p 6. -255.34549 -255.34549-0.08242 -255.42791 -255.42791 0.0626 0.0626 -0.72296 -0.08169-0.08186-0.08197-0.08206-0.08218 3s 2. -55.51750 -55.51750-0.08107 -55.59856 -55.59856 0.1342 0.1341 -0.86759 -0.06668-0.07795 3p 6. -45.56525 -45.56525-0.08107 -45.64631 -45.64631 0.1481 0.1480 -1.34526 -0.07880-0.07928-0.07960-0.07983-0.08015 3d 10. -29.77251 -29.77251-0.08120 -29.85370 -29.85370 0.1833 0.1830 -2.15235 -0.08039-0.08049-0.08057-0.08064-0.08095 4s 2. -9.26846 -9.26846-0.07796 -9.34642 -9.34642 0.3285 0.3271 -2.28891 -0.06401-0.07255 4p 6. -6.20468 -6.20468-0.07741 -6.28208 -6.28208 0.4015 0.3990 -2.73478 -0.07233-0.07355-0.07430-0.07484-0.07559 4d 10. -1.68012 -1.68012-0.07408 -1.75421 -1.75421 0.7715 0.7550 -3.45990 -0.06933-0.07096-0.07175-0.07230-0.07408 8d 1. -0.02744 -0.02744-0.00061 -0.02805 -0.02805 6.0369 5.9711 -3.46051 -0.00061 ecorrt= -3.64726 (old) ect= -3.46051 (new) etotrl= 0.00000 + 0.00000 + 0.00000 etot= -10621.60457 -10621.60457 -10625.25183 -10625.25183 -10625.06508 -10625.06508 -10625.06508 ag i d10 8d 2 -10625.0651 0 0.0019 2 t(run)= 17.86, t(job)= 268.34 seconds 47 1ag i d10 9d 4d10 9d ag i d10 9d nconf= 16 z= 47 ncores= 9 nvales= 1 ion= 0 r(i)/x(i)=0.24532669 ca1=0.700 tolstb=1.000 tolk-2=1.00000 tolend= 0.5E-07 thresh= 0.1E-10 kut= 0 exf=1.000 corrf=0.000 ca0= 0.500 rcn mod 32 ihf1= 0 mesh=2601 idb= 481 rdb= 100.461 emx= 0.10 r(mesh)=5426.209 irel= 1 ib=2600 t(run)= 10.69, t(job)= 279.03 seconds nl wnl ee az (r-3) (r-2) (r-1) (r+1) (r+2) (r+3) (r+4) (r+6) 1s 2. -1885.10602 881.507 0.000E+00 5.213E+03 4.936E+01 3.112E-02 1.308E-03 6.934E-05 4.438E-06 2.867E-08 2s 2. -280.37691 295.095 0.000E+00 5.731E+02 1.123E+01 1.350E-01 2.146E-02 3.880E-03 7.892E-04 4.505E-05 2p 6. -254.24457 3360.692 3.659E+03 1.600E+02 1.083E+01 1.175E-01 1.683E-02 2.853E-03 5.593E-04 3.126E-05 3s 2. -52.59316 127.553 0.000E+00 1.088E+02 3.931E+00 3.700E-01 1.565E-01 7.318E-02 3.748E-02 1.276E-02 3p 6. -43.48337 1500.439 6.406E+02 3.004E+01 3.735E+00 3.687E-01 1.577E-01 7.538E-02 3.987E-02 1.484E-02 3d 10. -29.23620 3211.670 9.185E+01 1.570E+01 3.533E+00 3.450E-01 1.415E-01 6.773E-02 3.720E-02 1.614E-02 4s 2. -8.25057 56.016 0.000E+00 2.149E+01 1.516E+00 9.139E-01 9.475E-01 1.082E+00 1.354E+00 2.767E+00 4p 6. -5.50945 619.964 1.071E+02 5.509E+00 1.356E+00 1.004E+00 1.156E+00 1.486E+00 2.119E+00 5.841E+00 4d 10. -1.54817 1036.542 8.404E+00 1.825E+00 9.716E-01 1.397E+00 2.375E+00 4.803E+00 1.144E+01 1.007E+02 9d 1. -0.02037 28.259 6.051E-03 2.248E-03 2.067E-02 7.064E+01 5.607E+03 4.713E+05 4.114E+07 3.423E+11 47. 1.318E+04 2.727E+02 9.990E+01 5.643E+03 4.713E+05 4.114E+07 3.423E+11 1. 2.804E+02 5.802E+00 2.126E+00 1.201E+02 1.003E+04 8.754E+05 7.283E+09 --------------------zeta--------------------- nl wnl ----blume-watson---- -----(r*vi)----- i (ryd) eps s evel edar evel+edar erel (ryd) (cm-1) (ryd) (cm-1) 1s 2. 0.00000 0.000 0.00000 0.000-2274.99730 -1876.84245 -398.58176 331.78494 -66.797 -1943.63927 2s 2. 0.00000 0.000 0.00000 0.000 -567.83950 -281.66195 -54.21010 36.23414 -17.976 -299.63791 2p 6. 8.55158 938426.773 8.80416 966144.843 -555.32084 -254.39186 -7.22339 -0.01376 -7.223 -261.61526 3s 2. 0.00000 0.000 0.00000 0.000 -234.94456 -54.19829 -10.56400 6.74662 -3.817 -58.01566 3p 6. 1.49473 164028.090 1.53292 168218.902 -227.34853 -45.04611 -1.64589 -0.00221 -1.646 -46.69199 3d 10. 0.17191 18864.971 0.18429 20224.032 -218.95187 -30.46206 -0.37676 -0.01081 -0.377 -30.83881 4s 2. 0.00000 0.000 0.00000 0.000 -108.22122 -9.01270 -2.06002 1.30044 -0.760 -9.77229 4p 6. 0.24966 27397.015 0.25575 28064.914 -99.37768 -6.22840 -0.29109 -0.00026 -0.291 -6.51949 4d 10. 0.01547 1698.046 0.01645 1804.780 -75.87009 -2.07256 -0.03955 -0.00095 -0.040 -2.11211 9d 1. 0.00001 1.222 0.00001 1.294 -1.91207 -0.01641 -0.00003 0.00000 0.000 -0.01644 ag i d10 9d nconf= 16 z= 47 ion= 0 kut=-1 exf=0.650 corrf=0.000 ca1=0.700 ca0=0.500 without correlation with correlation ----------------------- ----------------------- nl wnl eps fg eps fgr corr eps fg eps fgr n*r n*rc ect ec----------------- 1s 2. -1885.95165 -1885.95165-0.08290 -1886.03456 -1886.03456 0.0230 0.0230 -0.08267 0.00000-0.08267 2s 2. -284.72519 -284.72519-0.08232 -284.80752 -284.80752 0.0593 0.0593 -0.23110 -0.06744-0.08099 2p 6. -255.36004 -255.36004-0.08242 -255.44246 -255.44246 0.0626 0.0626 -0.72296 -0.08169-0.08186-0.08197-0.08206-0.08218 3s 2. -55.53205 -55.53205-0.08107 -55.61311 -55.61311 0.1342 0.1341 -0.86759 -0.06668-0.07795 3p 6. -45.57980 -45.57980-0.08107 -45.66086 -45.66086 0.1481 0.1480 -1.34526 -0.07880-0.07928-0.07960-0.07983-0.08015 3d 10. -29.78706 -29.78706-0.08120 -29.86825 -29.86825 0.1832 0.1830 -2.15235 -0.08039-0.08049-0.08057-0.08064-0.08095 4s 2. -9.28301 -9.28301-0.07796 -9.36096 -9.36096 0.3282 0.3268 -2.28891 -0.06401-0.07255 4p 6. -6.21922 -6.21922-0.07741 -6.29663 -6.29663 0.4010 0.3985 -2.73478 -0.07233-0.07355-0.07430-0.07484-0.07559 4d 10. -1.69466 -1.69466-0.07408 -1.76875 -1.76875 0.7682 0.7519 -3.45991 -0.06933-0.07096-0.07175-0.07230-0.07408 9d 1. -0.02019 -0.02019-0.00038 -0.02057 -0.02057 7.0381 6.9721 -3.46029 -0.00038 ecorrt= -3.64702 (old) ect= -3.46029 (new) etotrl= 0.00000 + 0.00000 + 0.00000 etot= -10621.59736 -10621.59736 -10625.24438 -10625.24438 -10625.05765 -10625.05765 -10625.05765 ag i d10 9d 2 -10625.0576 0 0.0012 2 t(run)= 15.50, t(job)= 283.84 seconds 47 1ag i d9 5s5d 4d9 5s 5d ag i d9 5s5d nconf= 17 z= 47 ncores=10 nvales= 1 ion= 0 r(i)/x(i)=0.24532669 ca1=0.700 tolstb=1.000 tolk-2=1.00000 tolend= 0.5E-07 thresh= 0.1E-10 kut= 0 exf=1.000 corrf=0.000 ca0= 0.500 rcn mod 32 ihf1= 0 mesh=2601 idb= 481 rdb= 100.461 emx= 0.10 r(mesh)=5426.209 irel= 1 ib=2600 t(run)= 10.48, t(job)= 294.33 seconds nl wnl ee az (r-3) (r-2) (r-1) (r+1) (r+2) (r+3) (r+4) (r+6) 1s 2. -1885.25738 881.505 0.000E+00 5.213E+03 4.936E+01 3.112E-02 1.308E-03 6.934E-05 4.438E-06 2.867E-08 2s 2. -280.54481 295.093 0.000E+00 5.731E+02 1.123E+01 1.350E-01 2.146E-02 3.880E-03 7.892E-04 4.505E-05 2p 6. -254.41114 3360.616 3.659E+03 1.600E+02 1.083E+01 1.175E-01 1.684E-02 2.853E-03 5.593E-04 3.126E-05 3s 2. -52.75532 127.558 0.000E+00 1.088E+02 3.931E+00 3.700E-01 1.565E-01 7.317E-02 3.748E-02 1.276E-02 3p 6. -43.64561 1500.501 6.406E+02 3.005E+01 3.735E+00 3.687E-01 1.577E-01 7.538E-02 3.986E-02 1.483E-02 3d 10. -29.40043 3212.014 9.187E+01 1.571E+01 3.533E+00 3.449E-01 1.415E-01 6.771E-02 3.719E-02 1.613E-02 4s 2. -8.39420 56.166 0.000E+00 2.160E+01 1.520E+00 9.114E-01 9.418E-01 1.071E+00 1.333E+00 2.683E+00 4p 6. -5.64373 623.296 1.083E+02 5.563E+00 1.363E+00 9.983E-01 1.142E+00 1.455E+00 2.052E+00 5.498E+00 4d 9. -1.64840 1073.428 8.991E+00 1.934E+00 1.004E+00 1.343E+00 2.172E+00 4.130E+00 9.154E+00 6.835E+01 5s 1. -0.97713 17.018 0.000E+00 2.094E+00 4.651E-01 2.750E+00 8.590E+00 2.994E+01 1.158E+02 2.328E+03 5d 1. -0.11300 84.756 5.537E-02 2.583E-02 1.182E-01 1.019E+01 1.194E+02 1.579E+03 2.325E+04 6.685E+06 47. 1.318E+04 2.726E+02 4.028E+01 1.591E+02 1.658E+03 2.347E+04 6.688E+06 1. 2.805E+02 5.800E+00 8.571E-01 3.385E+00 3.528E+01 4.993E+02 1.423E+05 --------------------zeta--------------------- nl wnl ----blume-watson---- -----(r*vi)----- i (ryd) eps s evel edar evel+edar erel (ryd) (cm-1) (ryd) (cm-1) 1s 2. 0.00000 0.000 0.00000 0.000-2274.99714 -1876.99370 -398.57974 331.78315 -66.797 -1943.79029 2s 2. 0.00000 0.000 0.00000 0.000 -567.83897 -281.82945 -54.20919 36.23359 -17.976 -299.80504 2p 6. 8.55126 938392.559 8.80382 966107.590 -555.31981 -254.55830 -7.22309 -0.01377 -7.223 -261.78139 3s 2. 0.00000 0.000 0.00000 0.000 -234.94721 -54.36083 -10.56475 6.74711 -3.818 -58.17848 3p 6. 1.49487 164042.785 1.53305 168233.277 -227.35198 -45.20870 -1.64603 -0.00221 -1.646 -46.85474 3d 10. 0.17194 18868.571 0.18433 20227.977 -218.95965 -30.62619 -0.37684 -0.01081 -0.377 -31.00303 4s 2. 0.00000 0.000 0.00000 0.000 -108.40411 -9.15189 -2.07109 1.30742 -0.764 -9.91556 4p 6. 0.25234 27691.479 0.25850 28366.669 -99.73330 -6.35880 -0.29424 -0.00026 -0.294 -6.65304 4d 9. 0.01658 1819.631 0.01762 1933.759 -77.90593 -2.18382 -0.04241 -0.00102 -0.042 -2.22623 5s 1. 0.00000 0.000 0.00000 0.000 -39.71935 -1.04778 -0.19053 0.12003 -0.071 -1.11828 5d 1. 0.00010 11.062 0.00011 11.626 -10.89429 -0.07880 -0.00026 -0.00001 0.000 -0.07906 ag i d9 5s5d nconf= 17 z= 47 ion= 0 kut=-1 exf=0.650 corrf=0.000 ca1=0.700 ca0=0.500 without correlation with correlation ----------------------- ----------------------- nl wnl eps fg eps fgr corr eps fg eps fgr n*r n*rc ect ec----------------- 1s 2. -1886.10420 -1886.10420-0.08290 -1886.18710 -1886.18710 0.0230 0.0230 -0.08267 0.00000-0.08267 2s 2. -284.89457 -284.89457-0.08232 -284.97690 -284.97690 0.0592 0.0592 -0.23110 -0.06744-0.08099 2p 6. -255.52586 -255.52586-0.08242 -255.60828 -255.60828 0.0626 0.0625 -0.72296 -0.08169-0.08186-0.08197-0.08206-0.08218 3s 2. -55.70040 -55.70040-0.08107 -55.78147 -55.78147 0.1340 0.1339 -0.86760 -0.06668-0.07795 3p 6. -45.74422 -45.74422-0.08107 -45.82529 -45.82529 0.1479 0.1477 -1.34526 -0.07880-0.07928-0.07960-0.07983-0.08015 3d 10. -29.94796 -29.94796-0.08120 -30.02916 -30.02916 0.1827 0.1825 -2.15235 -0.08039-0.08049-0.08057-0.08064-0.08095 4s 2. -9.42239 -9.42239-0.07794 -9.50033 -9.50033 0.3258 0.3244 -2.28909 -0.06414-0.07260 4p 6. -6.32300 -6.32300-0.07740 -6.40040 -6.40040 0.3977 0.3953 -2.73538 -0.07242-0.07363-0.07437-0.07491-0.07565 4d 9. -1.80064 -1.80064-0.07469 -1.87534 -1.87534 0.7452 0.7302 -3.39159 -0.07030-0.07164-0.07234-0.07285-0.07431 5s 1. -0.92608 -0.92608-0.05859 -0.98467 -0.98467 1.0391 1.0078 -3.44867 -0.05707 5d 1. -0.11050 -0.11050-0.00960 -0.12010 -0.12010 3.0083 2.8855 -3.45827 -0.00960 ecorrt= -3.64619 (old) ect= -3.45827 (new) etotrl= 0.00000 + 0.00000 + 0.00000 etot= -10621.34628 -10621.34628 -10624.99248 -10624.99248 -10624.80455 -10624.80455 -10624.80455 ag i d9 5s5d 10 -10624.8046 0 1.8196 2 0.0111 2 1.4595 3 0.3785 3 14.0746 4 0.2839 4 0.2711 4 0.2029 4 1.3043 4 t(run)= 15.64, t(job)= 299.48 seconds 47 1ag i d9 5s6d 4d9 5s 6d ag i d9 5s6d nconf= 18 z= 47 ncores=10 nvales= 1 ion= 0 r(i)/x(i)=0.24532669 ca1=0.700 tolstb=1.000 tolk-2=1.00000 tolend= 0.5E-07 thresh= 0.1E-10 kut= 0 exf=1.000 corrf=0.000 ca0= 0.500 rcn mod 32 ihf1= 0 mesh=2601 idb= 481 rdb= 100.461 emx= 0.10 r(mesh)=5426.209 irel= 1 ib=2600 t(run)= 11.91, t(job)= 311.39 seconds nl wnl ee az (r-3) (r-2) (r-1) (r+1) (r+2) (r+3) (r+4) (r+6) 1s 2. -1885.35670 881.505 0.000E+00 5.213E+03 4.936E+01 3.112E-02 1.308E-03 6.934E-05 4.438E-06 2.867E-08 2s 2. -280.64421 295.093 0.000E+00 5.731E+02 1.123E+01 1.350E-01 2.146E-02 3.880E-03 7.892E-04 4.505E-05 2p 6. -254.51053 3360.615 3.659E+03 1.600E+02 1.083E+01 1.175E-01 1.684E-02 2.853E-03 5.593E-04 3.126E-05 3s 2. -52.85469 127.558 0.000E+00 1.088E+02 3.931E+00 3.700E-01 1.565E-01 7.317E-02 3.748E-02 1.276E-02 3p 6. -43.74498 1500.501 6.406E+02 3.005E+01 3.735E+00 3.687E-01 1.577E-01 7.538E-02 3.986E-02 1.483E-02 3d 10. -29.49981 3212.016 9.187E+01 1.571E+01 3.533E+00 3.449E-01 1.415E-01 6.771E-02 3.719E-02 1.613E-02 4s 2. -8.49351 56.166 0.000E+00 2.160E+01 1.520E+00 9.114E-01 9.418E-01 1.071E+00 1.333E+00 2.683E+00 4p 6. -5.74302 623.301 1.083E+02 5.563E+00 1.363E+00 9.982E-01 1.142E+00 1.455E+00 2.052E+00 5.497E+00 4d 9. -1.74769 1073.493 8.992E+00 1.934E+00 1.004E+00 1.343E+00 2.171E+00 4.127E+00 9.142E+00 6.810E+01 5s 1. -1.07552 17.072 0.000E+00 2.107E+00 4.664E-01 2.741E+00 8.522E+00 2.953E+01 1.133E+02 2.230E+03 6d 1. -0.06376 63.595 3.079E-02 1.236E-02 6.656E-02 2.046E+01 4.799E+02 1.221E+04 3.312E+05 2.896E+08 47. 1.318E+04 2.726E+02 5.054E+01 5.196E+02 1.229E+04 3.314E+05 2.896E+08 1. 2.805E+02 5.799E+00 1.075E+00 1.105E+01 2.615E+02 7.050E+03 6.161E+06 --------------------zeta--------------------- nl wnl ----blume-watson---- -----(r*vi)----- i (ryd) eps s evel edar evel+edar erel (ryd) (cm-1) (ryd) (cm-1) 1s 2. 0.00000 0.000 0.00000 0.000-2274.99712 -1877.09301 -398.57969 331.78298 -66.797 -1943.88972 2s 2. 0.00000 0.000 0.00000 0.000 -567.83897 -281.92885 -54.20918 36.23358 -17.976 -299.90445 2p 6. 8.55126 938392.440 8.80382 966107.458 -555.31981 -254.65770 -7.22309 -0.01377 -7.223 -261.88079 3s 2. 0.00000 0.000 0.00000 0.000 -234.94722 -54.46020 -10.56475 6.74711 -3.818 -58.27785 3p 6. 1.49487 164042.851 1.53306 168233.342 -227.35200 -45.30808 -1.64603 -0.00221 -1.646 -46.95411 3d 10. 0.17194 18868.588 0.18433 20227.995 -218.95969 -30.72557 -0.37684 -0.01081 -0.377 -31.10241 4s 2. 0.00000 0.000 0.00000 0.000 -108.40444 -9.25119 -2.07111 1.30743 -0.764 -10.01488 4p 6. 0.25235 27691.922 0.25850 28367.123 -99.73377 -6.45810 -0.29425 -0.00026 -0.294 -6.75234 4d 9. 0.01658 1819.849 0.01762 1933.990 -77.91023 -2.28310 -0.04242 -0.00102 -0.042 -2.32551 5s 1. 0.00000 0.000 0.00000 0.000 -39.81728 -1.14521 -0.19174 0.12079 -0.071 -1.21616 6d 1. 0.00006 6.193 0.00006 6.541 -6.13595 -0.05121 -0.00015 0.00000 0.000 -0.05135 ag i d9 5s6d nconf= 18 z= 47 ion= 0 kut=-1 exf=0.650 corrf=0.000 ca1=0.700 ca0=0.500 without correlation with correlation ----------------------- ----------------------- nl wnl eps fg eps fgr corr eps fg eps fgr n*r n*rc ect ec----------------- 1s 2. -1886.20352 -1886.20352-0.08290 -1886.28642 -1886.28642 0.0230 0.0230 -0.08267 0.00000-0.08267 2s 2. -284.99398 -284.99398-0.08232 -285.07631 -285.07631 0.0592 0.0592 -0.23110 -0.06744-0.08099 2p 6. -255.62525 -255.62525-0.08242 -255.70767 -255.70767 0.0625 0.0625 -0.72296 -0.08169-0.08186-0.08197-0.08206-0.08218 3s 2. -55.79981 -55.79981-0.08107 -55.88087 -55.88087 0.1339 0.1338 -0.86760 -0.06668-0.07795 3p 6. -45.84360 -45.84360-0.08107 -45.92467 -45.92467 0.1477 0.1476 -1.34526 -0.07880-0.07928-0.07960-0.07983-0.08015 3d 10. -30.04733 -30.04733-0.08120 -30.12853 -30.12853 0.1824 0.1822 -2.15235 -0.08039-0.08049-0.08057-0.08064-0.08095 4s 2. -9.52174 -9.52174-0.07794 -9.59968 -9.59968 0.3241 0.3228 -2.28909 -0.06414-0.07260 4p 6. -6.42226 -6.42226-0.07740 -6.49967 -6.49967 0.3946 0.3922 -2.73538 -0.07242-0.07363-0.07437-0.07491-0.07565 4d 9. -1.89987 -1.89987-0.07469 -1.97456 -1.97456 0.7255 0.7116 -3.39161 -0.07030-0.07164-0.07235-0.07285-0.07431 5s 1. -1.02540 -1.02540-0.05821 -1.08362 -1.08362 0.9875 0.9606 -3.44881 -0.05720 6d 1. -0.06198 -0.06198-0.00356 -0.06554 -0.06554 4.0167 3.9060 -3.45237 -0.00356 ecorrt= -3.63976 (old) ect= -3.45237 (new) etotrl= 0.00000 + 0.00000 + 0.00000 etot= -10621.29769 -10621.29769 -10624.93745 -10624.93745 -10624.75006 -10624.75006 -10624.75006 ag i d9 5s6d 10 -10624.7501 0 1.8198 2 0.0062 2 0.6457 3 0.1973 3 14.1435 4 0.1560 4 0.1504 4 0.1131 4 0.6618 4 t(run)= 17.50, t(job)= 316.98 seconds 47 1ag i d9 5s7d 4d9 5s 7d ag i d9 5s7d nconf= 19 z= 47 ncores=10 nvales= 1 ion= 0 r(i)/x(i)=0.24532669 ca1=0.700 tolstb=1.000 tolk-2=1.00000 tolend= 0.5E-07 thresh= 0.1E-10 kut= 0 exf=1.000 corrf=0.000 ca0= 0.500 rcn mod 32 ihf1= 0 mesh=2601 idb= 481 rdb= 100.461 emx= 0.10 r(mesh)=5426.209 irel= 1 ib=2600 t(run)= 11.34, t(job)= 328.33 seconds nl wnl ee az (r-3) (r-2) (r-1) (r+1) (r+2) (r+3) (r+4) (r+6) 1s 2. -1885.40311 881.505 0.000E+00 5.213E+03 4.936E+01 3.112E-02 1.308E-03 6.934E-05 4.438E-06 2.867E-08 2s 2. -280.69066 295.093 0.000E+00 5.731E+02 1.123E+01 1.350E-01 2.146E-02 3.880E-03 7.892E-04 4.505E-05 2p 6. -254.55699 3360.615 3.659E+03 1.600E+02 1.083E+01 1.175E-01 1.684E-02 2.853E-03 5.593E-04 3.126E-05 3s 2. -52.90113 127.558 0.000E+00 1.088E+02 3.931E+00 3.700E-01 1.565E-01 7.317E-02 3.748E-02 1.276E-02 3p 6. -43.79142 1500.501 6.406E+02 3.005E+01 3.735E+00 3.687E-01 1.577E-01 7.538E-02 3.986E-02 1.483E-02 3d 10. -29.54625 3212.017 9.187E+01 1.571E+01 3.533E+00 3.449E-01 1.415E-01 6.771E-02 3.719E-02 1.613E-02 4s 2. -8.53991 56.166 0.000E+00 2.160E+01 1.520E+00 9.114E-01 9.418E-01 1.071E+00 1.333E+00 2.683E+00 4p 6. -5.78942 623.303 1.083E+02 5.563E+00 1.363E+00 9.982E-01 1.142E+00 1.455E+00 2.052E+00 5.497E+00 4d 9. -1.79407 1073.536 8.993E+00 1.934E+00 1.004E+00 1.343E+00 2.170E+00 4.125E+00 9.135E+00 6.797E+01 5s 1. -1.12138 17.095 0.000E+00 2.113E+00 4.670E-01 2.737E+00 8.496E+00 2.937E+01 1.124E+02 2.196E+03 7d 1. -0.04082 48.003 1.747E-02 6.658E-03 4.238E-02 3.369E+01 1.290E+03 5.282E+04 2.272E+06 4.772E+09 47. 1.318E+04 2.725E+02 6.377E+01 1.329E+03 5.289E+04 2.272E+06 4.772E+09 1. 2.805E+02 5.799E+00 1.357E+00 2.829E+01 1.125E+03 4.834E+04 1.015E+08 --------------------zeta--------------------- nl wnl ----blume-watson---- -----(r*vi)----- i (ryd) eps s evel edar evel+edar erel (ryd) (cm-1) (ryd) (cm-1) 1s 2. 0.00000 0.000 0.00000 0.000-2274.99710 -1877.13942 -398.57966 331.78290 -66.797 -1943.93619 2s 2. 0.00000 0.000 0.00000 0.000 -567.83897 -281.97530 -54.20917 36.23357 -17.976 -299.95091 2p 6. 8.55126 938392.389 8.80382 966107.400 -555.31981 -254.70415 -7.22309 -0.01377 -7.223 -261.92724 3s 2. 0.00000 0.000 0.00000 0.000 -234.94723 -54.50665 -10.56476 6.74711 -3.818 -58.32429 3p 6. 1.49487 164042.890 1.53306 168233.381 -227.35201 -45.35452 -1.64603 -0.00221 -1.646 -47.00055 3d 10. 0.17194 18868.598 0.18433 20228.006 -218.95971 -30.77202 -0.37684 -0.01081 -0.377 -31.14886 4s 2. 0.00000 0.000 0.00000 0.000 -108.40462 -9.29759 -2.07112 1.30744 -0.764 -10.06128 4p 6. 0.25235 27692.175 0.25850 28367.382 -99.73404 -6.50449 -0.29425 -0.00026 -0.294 -6.79874 4d 9. 0.01658 1819.992 0.01763 1934.142 -77.91300 -2.32948 -0.04242 -0.00102 -0.042 -2.37190 5s 1. 0.00000 0.000 0.00000 0.000 -39.85826 -1.19035 -0.19226 0.12112 -0.071 -1.26149 7d 1. 0.00003 3.522 0.00003 3.725 -3.91032 -0.03405 -0.00008 0.00000 0.000 -0.03413 ag i d9 5s7d nconf= 19 z= 47 ion= 0 kut=-1 exf=0.650 corrf=0.000 ca1=0.700 ca0=0.500 without correlation with correlation ----------------------- ----------------------- nl wnl eps fg eps fgr corr eps fg eps fgr n*r n*rc ect ec----------------- 1s 2. -1886.24994 -1886.24994-0.08290 -1886.33284 -1886.33284 0.0230 0.0230 -0.08267 0.00000-0.08267 2s 2. -285.04044 -285.04044-0.08232 -285.12276 -285.12276 0.0592 0.0592 -0.23110 -0.06744-0.08099 2p 6. -255.67170 -255.67170-0.08242 -255.75412 -255.75412 0.0625 0.0625 -0.72296 -0.08169-0.08186-0.08197-0.08206-0.08218 3s 2. -55.84626 -55.84626-0.08107 -55.92733 -55.92733 0.1338 0.1337 -0.86760 -0.06668-0.07795 3p 6. -45.89005 -45.89005-0.08107 -45.97111 -45.97111 0.1476 0.1475 -1.34526 -0.07880-0.07928-0.07960-0.07983-0.08015 3d 10. -30.09377 -30.09377-0.08120 -30.17497 -30.17497 0.1823 0.1820 -2.15235 -0.08039-0.08049-0.08057-0.08064-0.08095 4s 2. -9.56816 -9.56816-0.07794 -9.64610 -9.64610 0.3233 0.3220 -2.28909 -0.06414-0.07260 4p 6. -6.46864 -6.46864-0.07740 -6.54605 -6.54605 0.3932 0.3909 -2.73538 -0.07242-0.07363-0.07437-0.07491-0.07565 4d 9. -1.94623 -1.94623-0.07469 -2.02092 -2.02092 0.7168 0.7034 -3.39162 -0.07030-0.07165-0.07235-0.07285-0.07431 5s 1. -1.07167 -1.07167-0.05794 -1.12961 -1.12961 0.9660 0.9409 -3.44887 -0.05725 7d 1. -0.03965 -0.03965-0.00174 -0.04139 -0.04139 5.0222 4.9154 -3.45062 -0.00174 ecorrt= -3.63766 (old) ect= -3.45062 (new) etotrl= 0.00000 + 0.00000 + 0.00000 etot= -10621.27535 -10621.27535 -10624.91301 -10624.91301 -10624.72597 -10624.72597 -10624.72597 ag i d9 5s7d 10 -10624.7260 0 1.8200 2 0.0035 2 0.3368 3 0.1095 3 14.1721 4 0.0876 4 0.0851 4 0.0641 4 0.3617 4 t(run)= 16.93, t(job)= 333.91 seconds 47 1ag i d9 5s8d 4d9 5s 8d ag i d9 5s8d nconf= 20 z= 47 ncores=10 nvales= 1 ion= 0 r(i)/x(i)=0.24532669 ca1=0.700 tolstb=1.000 tolk-2=1.00000 tolend= 0.5E-07 thresh= 0.1E-10 kut= 0 exf=1.000 corrf=0.000 ca0= 0.500 rcn mod 32 ihf1= 0 mesh=2601 idb= 481 rdb= 100.461 emx= 0.10 r(mesh)=5426.209 irel= 1 ib=2600 t(run)= 12.05, t(job)= 345.96 seconds nl wnl ee az (r-3) (r-2) (r-1) (r+1) (r+2) (r+3) (r+4) (r+6) 1s 2. -1885.42840 881.504 0.000E+00 5.213E+03 4.936E+01 3.112E-02 1.308E-03 6.934E-05 4.438E-06 2.867E-08 2s 2. -280.71597 295.093 0.000E+00 5.731E+02 1.123E+01 1.350E-01 2.146E-02 3.880E-03 7.892E-04 4.505E-05 2p 6. -254.58229 3360.615 3.659E+03 1.600E+02 1.083E+01 1.175E-01 1.684E-02 2.853E-03 5.593E-04 3.126E-05 3s 2. -52.92643 127.558 0.000E+00 1.088E+02 3.931E+00 3.700E-01 1.565E-01 7.317E-02 3.748E-02 1.276E-02 3p 6. -43.81672 1500.501 6.406E+02 3.005E+01 3.735E+00 3.687E-01 1.577E-01 7.538E-02 3.986E-02 1.483E-02 3d 10. -29.57155 3212.017 9.187E+01 1.571E+01 3.533E+00 3.449E-01 1.415E-01 6.771E-02 3.719E-02 1.613E-02 4s 2. -8.56519 56.166 0.000E+00 2.160E+01 1.520E+00 9.114E-01 9.418E-01 1.071E+00 1.333E+00 2.683E+00 4p 6. -5.81469 623.305 1.083E+02 5.563E+00 1.363E+00 9.982E-01 1.142E+00 1.455E+00 2.052E+00 5.497E+00 4d 9. -1.81934 1073.559 8.993E+00 1.934E+00 1.004E+00 1.343E+00 2.170E+00 4.124E+00 9.132E+00 6.790E+01 5s 1. -1.14637 17.106 0.000E+00 2.115E+00 4.672E-01 2.736E+00 8.485E+00 2.930E+01 1.120E+02 2.183E+03 8d 1. -0.02833 37.512 1.065E-02 3.952E-03 2.926E-02 4.990E+01 2.812E+03 1.684E+05 1.052E+07 4.550E+10 47. 1.318E+04 2.725E+02 7.998E+01 2.852E+03 1.685E+05 1.052E+07 4.550E+10 1. 2.805E+02 5.799E+00 1.702E+00 6.068E+01 3.585E+03 2.238E+05 9.680E+08 --------------------zeta--------------------- nl wnl ----blume-watson---- -----(r*vi)----- i (ryd) eps s evel edar evel+edar erel (ryd) (cm-1) (ryd) (cm-1) 1s 2. 0.00000 0.000 0.00000 0.000-2274.99710 -1877.16471 -398.57965 331.78285 -66.797 -1943.96151 2s 2. 0.00000 0.000 0.00000 0.000 -567.83896 -282.00061 -54.20917 36.23356 -17.976 -299.97622 2p 6. 8.55126 938392.366 8.80382 966107.375 -555.31980 -254.72946 -7.22309 -0.01377 -7.223 -261.95255 3s 2. 0.00000 0.000 0.00000 0.000 -234.94723 -54.53194 -10.56476 6.74711 -3.818 -58.34959 3p 6. 1.49487 164042.912 1.53306 168233.402 -227.35201 -45.37982 -1.64604 -0.00221 -1.646 -47.02585 3d 10. 0.17194 18868.603 0.18433 20228.011 -218.95972 -30.79732 -0.37684 -0.01081 -0.377 -31.17416 4s 2. 0.00000 0.000 0.00000 0.000 -108.40471 -9.32287 -2.07113 1.30744 -0.764 -10.08656 4p 6. 0.25235 27692.307 0.25850 28367.517 -99.73418 -6.52977 -0.29425 -0.00026 -0.294 -6.82402 4d 9. 0.01659 1820.072 0.01763 1934.227 -77.91455 -2.35475 -0.04242 -0.00102 -0.042 -2.39717 5s 1. 0.00000 0.000 0.00000 0.000 -39.87596 -1.21488 -0.19250 0.12127 -0.071 -1.28611 8d 1. 0.00002 2.149 0.00002 2.275 -2.70234 -0.02393 -0.00005 0.00000 0.000 -0.02398 ag i d9 5s8d nconf= 20 z= 47 ion= 0 kut=-1 exf=0.650 corrf=0.000 ca1=0.700 ca0=0.500 without correlation with correlation ----------------------- ----------------------- nl wnl eps fg eps fgr corr eps fg eps fgr n*r n*rc ect ec----------------- 1s 2. -1886.27523 -1886.27523-0.08290 -1886.35813 -1886.35813 0.0230 0.0230 -0.08267 0.00000-0.08267 2s 2. -285.06575 -285.06575-0.08232 -285.14807 -285.14807 0.0592 0.0592 -0.23110 -0.06744-0.08099 2p 6. -255.69701 -255.69701-0.08242 -255.77943 -255.77943 0.0625 0.0625 -0.72296 -0.08169-0.08186-0.08197-0.08206-0.08218 3s 2. -55.87157 -55.87157-0.08107 -55.95263 -55.95263 0.1338 0.1337 -0.86760 -0.06668-0.07795 3p 6. -45.91535 -45.91535-0.08107 -45.99641 -45.99641 0.1476 0.1474 -1.34526 -0.07880-0.07928-0.07960-0.07983-0.08015 3d 10. -30.11907 -30.11907-0.08120 -30.20027 -30.20027 0.1822 0.1820 -2.15235 -0.08039-0.08049-0.08057-0.08064-0.08095 4s 2. -9.59345 -9.59345-0.07794 -9.67139 -9.67139 0.3229 0.3216 -2.28909 -0.06414-0.07260 4p 6. -6.49391 -6.49391-0.07740 -6.57131 -6.57131 0.3924 0.3901 -2.73538 -0.07242-0.07363-0.07437-0.07491-0.07565 4d 9. -1.97149 -1.97149-0.07469 -2.04618 -2.04618 0.7122 0.6991 -3.39163 -0.07030-0.07165-0.07235-0.07285-0.07431 5s 1. -1.09685 -1.09685-0.05776 -1.15460 -1.15460 0.9548 0.9306 -3.44890 -0.05727 8d 1. -0.02754 -0.02754-0.00098 -0.02853 -0.02853 6.0255 5.9208 -3.44988 -0.00098 ecorrt= -3.63671 (old) ect= -3.44988 (new) etotrl= 0.00000 + 0.00000 + 0.00000 etot= -10621.26325 -10621.26325 -10624.89996 -10624.89996 -10624.71313 -10624.71313 -10624.71313 ag i d9 5s8d 10 -10624.7131 0 1.8201 2 0.0021 2 0.1965 3 0.0660 3 14.1843 4 0.0530 4 0.0517 4 0.0390 4 0.2158 4 t(run)= 17.23, t(job)= 351.15 seconds 47 1ag i d9 5s9d 4d9 5s 9d ag i d9 5s9d nconf= 21 z= 47 ncores=10 nvales= 1 ion= 0 r(i)/x(i)=0.24532669 ca1=0.700 tolstb=1.000 tolk-2=1.00000 tolend= 0.5E-07 thresh= 0.1E-10 kut= 0 exf=1.000 corrf=0.000 ca0= 0.500 rcn mod 32 ihf1= 0 mesh=2601 idb= 481 rdb= 100.461 emx= 0.10 r(mesh)=5426.209 irel= 1 ib=2600 t(run)= 13.50, t(job)= 364.65 seconds nl wnl ee az (r-3) (r-2) (r-1) (r+1) (r+2) (r+3) (r+4) (r+6) 1s 2. -1885.44365 881.504 0.000E+00 5.213E+03 4.936E+01 3.112E-02 1.308E-03 6.934E-05 4.438E-06 2.867E-08 2s 2. -280.73122 295.093 0.000E+00 5.731E+02 1.123E+01 1.350E-01 2.146E-02 3.880E-03 7.892E-04 4.505E-05 2p 6. -254.59755 3360.615 3.659E+03 1.600E+02 1.083E+01 1.175E-01 1.684E-02 2.853E-03 5.593E-04 3.126E-05 3s 2. -52.94168 127.558 0.000E+00 1.088E+02 3.931E+00 3.700E-01 1.565E-01 7.317E-02 3.748E-02 1.276E-02 3p 6. -43.83197 1500.501 6.406E+02 3.005E+01 3.735E+00 3.687E-01 1.577E-01 7.538E-02 3.986E-02 1.483E-02 3d 10. -29.58680 3212.017 9.187E+01 1.571E+01 3.533E+00 3.449E-01 1.415E-01 6.771E-02 3.719E-02 1.613E-02 4s 2. -8.58043 56.166 0.000E+00 2.160E+01 1.520E+00 9.114E-01 9.418E-01 1.071E+00 1.333E+00 2.683E+00 4p 6. -5.82993 623.306 1.083E+02 5.563E+00 1.363E+00 9.982E-01 1.142E+00 1.455E+00 2.052E+00 5.497E+00 4d 9. -1.83458 1073.573 8.993E+00 1.934E+00 1.004E+00 1.343E+00 2.170E+00 4.124E+00 9.130E+00 6.787E+01 5s 1. -1.16145 17.111 0.000E+00 2.116E+00 4.673E-01 2.735E+00 8.480E+00 2.927E+01 1.119E+02 2.177E+03 9d 1. -0.02080 30.236 6.911E-03 2.524E-03 2.139E-02 6.910E+01 5.370E+03 4.419E+05 3.778E+07 3.017E+11 47. 1.318E+04 2.725E+02 9.917E+01 5.409E+03 4.420E+05 3.778E+07 3.017E+11 1. 2.805E+02 5.798E+00 2.110E+00 1.151E+02 9.404E+03 8.039E+05 6.420E+09 --------------------zeta--------------------- nl wnl ----blume-watson---- -----(r*vi)----- i (ryd) eps s evel edar evel+edar erel (ryd) (cm-1) (ryd) (cm-1) 1s 2. 0.00000 0.000 0.00000 0.000-2274.99709 -1877.17996 -398.57964 331.78283 -66.797 -1943.97677 2s 2. 0.00000 0.000 0.00000 0.000 -567.83896 -282.01586 -54.20917 36.23356 -17.976 -299.99147 2p 6. 8.55126 938392.355 8.80382 966107.362 -555.31980 -254.74471 -7.22309 -0.01377 -7.223 -261.96780 3s 2. 0.00000 0.000 0.00000 0.000 -234.94724 -54.54719 -10.56476 6.74711 -3.818 -58.36484 3p 6. 1.49487 164042.924 1.53306 168233.414 -227.35202 -45.39507 -1.64604 -0.00221 -1.646 -47.04110 3d 10. 0.17194 18868.606 0.18433 20228.014 -218.95972 -30.81257 -0.37684 -0.01081 -0.377 -31.18941 4s 2. 0.00000 0.000 0.00000 0.000 -108.40476 -9.33811 -2.07113 1.30744 -0.764 -10.10180 4p 6. 0.25235 27692.379 0.25850 28367.591 -99.73426 -6.54500 -0.29425 -0.00026 -0.294 -6.83926 4d 9. 0.01659 1820.118 0.01763 1934.276 -77.91543 -2.36998 -0.04242 -0.00102 -0.042 -2.41240 5s 1. 0.00000 0.000 0.00000 0.000 -39.88459 -1.22966 -0.19261 0.12134 -0.071 -1.30093 9d 1. 0.00001 1.395 0.00001 1.478 -1.97669 -0.01764 -0.00003 0.00000 0.000 -0.01767 ag i d9 5s9d nconf= 21 z= 47 ion= 0 kut=-1 exf=0.650 corrf=0.000 ca1=0.700 ca0=0.500 without correlation with correlation ----------------------- ----------------------- nl wnl eps fg eps fgr corr eps fg eps fgr n*r n*rc ect ec----------------- 1s 2. -1886.29047 -1886.29047-0.08290 -1886.37337 -1886.37337 0.0230 0.0230 -0.08267 0.00000-0.08267 2s 2. -285.08101 -285.08101-0.08232 -285.16333 -285.16333 0.0592 0.0592 -0.23110 -0.06744-0.08099 2p 6. -255.71226 -255.71226-0.08242 -255.79468 -255.79468 0.0625 0.0625 -0.72296 -0.08169-0.08186-0.08197-0.08206-0.08218 3s 2. -55.88682 -55.88682-0.08107 -55.96789 -55.96789 0.1338 0.1337 -0.86760 -0.06668-0.07795 3p 6. -45.93060 -45.93060-0.08107 -46.01166 -46.01166 0.1476 0.1474 -1.34526 -0.07880-0.07928-0.07960-0.07983-0.08015 3d 10. -30.13432 -30.13432-0.08120 -30.21552 -30.21552 0.1822 0.1819 -2.15235 -0.08039-0.08049-0.08057-0.08064-0.08095 4s 2. -9.60869 -9.60869-0.07794 -9.68663 -9.68663 0.3226 0.3213 -2.28909 -0.06414-0.07260 4p 6. -6.50914 -6.50914-0.07740 -6.58655 -6.58655 0.3920 0.3896 -2.73538 -0.07242-0.07363-0.07437-0.07491-0.07565 4d 9. -1.98672 -1.98672-0.07469 -2.06141 -2.06141 0.7095 0.6965 -3.39163 -0.07030-0.07165-0.07235-0.07285-0.07431 5s 1. -1.11201 -1.11201-0.05764 -1.16965 -1.16965 0.9483 0.9246 -3.44891 -0.05728 9d 1. -0.02025 -0.02025-0.00061 -0.02086 -0.02086 7.0271 6.9237 -3.44952 -0.00061 ecorrt= -3.63621 (old) ect= -3.44952 (new) etotrl= 0.00000 + 0.00000 + 0.00000 etot= -10621.25596 -10621.25596 -10624.89217 -10624.89217 -10624.70548 -10624.70548 -10624.70548 ag i d9 5s9d 10 -10624.7055 0 1.8201 2 0.0014 2 0.1243 3 0.0425 3 14.1903 4 0.0343 4 0.0335 4 0.0253 4 0.1382 4 t(run)= 18.39, t(job)= 369.54 seconds 47 1ag i d8 5s2 5d 4d8 5s2 5d ag i d8 5s2 5d nconf= 22 z= 47 ncores=10 nvales= 1 ion= 0 r(i)/x(i)=0.24532669 ca1=0.700 tolstb=1.000 tolk-2=1.00000 tolend= 0.5E-07 thresh= 0.1E-10 kut= 0 exf=1.000 corrf=0.000 ca0= 0.500 rcn mod 32 ihf1= 0 mesh=2601 idb= 481 rdb= 100.461 emx= 0.10 r(mesh)=5426.209 irel= 1 ib=2600 t(run)= 10.63, t(job)= 380.16 seconds nl wnl ee az (r-3) (r-2) (r-1) (r+1) (r+2) (r+3) (r+4) (r+6) 1s 2. -1885.63212 881.501 0.000E+00 5.213E+03 4.936E+01 3.112E-02 1.308E-03 6.934E-05 4.438E-06 2.867E-08 2s 2. -280.94007 295.090 0.000E+00 5.731E+02 1.123E+01 1.350E-01 2.146E-02 3.880E-03 7.892E-04 4.505E-05 2p 6. -254.80488 3360.525 3.659E+03 1.600E+02 1.083E+01 1.175E-01 1.684E-02 2.853E-03 5.593E-04 3.126E-05 3s 2. -53.14031 127.566 0.000E+00 1.088E+02 3.931E+00 3.699E-01 1.565E-01 7.316E-02 3.747E-02 1.276E-02 3p 6. -44.03072 1500.626 6.407E+02 3.005E+01 3.736E+00 3.687E-01 1.577E-01 7.536E-02 3.985E-02 1.483E-02 3d 10. -29.78845 3212.642 9.190E+01 1.571E+01 3.534E+00 3.449E-01 1.415E-01 6.767E-02 3.716E-02 1.611E-02 4s 2. -8.74917 56.360 0.000E+00 2.174E+01 1.526E+00 9.084E-01 9.348E-01 1.058E+00 1.308E+00 2.589E+00 4p 6. -5.98708 627.355 1.097E+02 5.628E+00 1.371E+00 9.919E-01 1.126E+00 1.420E+00 1.980E+00 5.142E+00 4d 8. -1.95281 1110.272 9.594E+00 2.043E+00 1.035E+00 1.295E+00 2.002E+00 3.602E+00 7.485E+00 4.810E+01 5s 2. -1.02859 18.135 0.000E+00 2.364E+00 4.866E-01 2.651E+00 7.990E+00 2.688E+01 1.004E+02 1.884E+03 5d 1. -0.11332 96.517 7.438E-02 2.998E-02 1.202E-01 1.014E+01 1.184E+02 1.561E+03 2.291E+04 6.552E+06 47. 1.318E+04 2.724E+02 4.101E+01 1.618E+02 1.655E+03 2.319E+04 6.556E+06 1. 2.805E+02 5.797E+00 8.726E-01 3.443E+00 3.521E+01 4.933E+02 1.395E+05 --------------------zeta--------------------- nl wnl ----blume-watson---- -----(r*vi)----- i (ryd) eps s evel edar evel+edar erel (ryd) (cm-1) (ryd) (cm-1) 1s 2. 0.00000 0.000 0.00000 0.000-2274.99689 -1877.36828 -398.57709 331.78056 -66.797 -1944.16481 2s 2. 0.00000 0.000 0.00000 0.000 -567.83848 -282.22412 -54.20821 36.23300 -17.975 -300.19933 2p 6. 8.55090 938352.198 8.80342 966063.503 -555.31869 -254.95180 -7.22273 -0.01379 -7.223 -262.17454 3s 2. 0.00000 0.000 0.00000 0.000 -234.95277 -54.74620 -10.56623 6.74805 -3.818 -58.56439 3p 6. 1.49513 164071.499 1.53331 168261.853 -227.35923 -45.59416 -1.64633 -0.00222 -1.646 -47.24049 3d 10. 0.17200 18875.017 0.18440 20235.017 -218.97404 -31.01394 -0.37698 -0.01081 -0.377 -31.39093 4s 2. 0.00000 0.000 0.00000 0.000 -108.63476 -9.50152 -2.08548 1.31648 -0.769 -10.27051 4p 6. 0.25563 28052.205 0.26186 28736.323 -100.15464 -6.69771 -0.29811 -0.00026 -0.298 -6.99582 4d 8. 0.01772 1944.942 0.01883 2066.664 -79.85080 -2.49739 -0.04537 -0.00108 -0.045 -2.54276 5s 2. 0.00000 0.000 0.00000 0.000 -41.21657 -1.18929 -0.21638 0.13629 -0.080 -1.26938 5d 1. 0.00014 14.884 0.00014 15.592 -11.05144 -0.08624 -0.00034 -0.00001 0.000 -0.08659 ag i d8 5s2 5d nconf= 22 z= 47 ion= 0 kut=-1 exf=0.650 corrf=0.000 ca1=0.700 ca0=0.500 without correlation with correlation ----------------------- ----------------------- nl wnl eps fg eps fgr corr eps fg eps fgr n*r n*rc ect ec----------------- 1s 2. -1886.48045 -1886.48045-0.08290 -1886.56335 -1886.56335 0.0230 0.0230 -0.08267 0.00000-0.08267 2s 2. -285.29159 -285.29159-0.08232 -285.37391 -285.37391 0.0592 0.0592 -0.23110 -0.06744-0.08099 2p 6. -255.91847 -255.91847-0.08242 -256.00089 -256.00089 0.0625 0.0625 -0.72297 -0.08169-0.08186-0.08197-0.08206-0.08218 3s 2. -56.09309 -56.09309-0.08107 -56.17415 -56.17415 0.1335 0.1334 -0.86760 -0.06668-0.07795 3p 6. -46.13194 -46.13194-0.08107 -46.21300 -46.21300 0.1472 0.1471 -1.34527 -0.07880-0.07928-0.07960-0.07983-0.08016 3d 10. -30.33149 -30.33149-0.08120 -30.41268 -30.41268 0.1816 0.1813 -2.15236 -0.08040-0.08049-0.08057-0.08064-0.08095 4s 2. -9.77201 -9.77201-0.07792 -9.84993 -9.84993 0.3199 0.3186 -2.28930 -0.06429-0.07265 4p 6. -6.63123 -6.63123-0.07740 -6.70863 -6.70863 0.3883 0.3861 -2.73609 -0.07253-0.07372-0.07445-0.07498-0.07571 4d 8. -2.11026 -2.11026-0.07512 -2.18538 -2.18538 0.6884 0.6765 -3.32214 -0.07112-0.07224-0.07287-0.07334-0.07450 5s 2. -0.99811 -0.99811-0.06175 -1.05985 -1.05985 1.0009 0.9714 -3.44002 -0.05665-0.06123 5d 1. -0.11478 -0.11478-0.01043 -0.12522 -0.12522 2.9516 2.8260 -3.45046 -0.01043 ecorrt= -3.64059 (old) ect= -3.45046 (new) etotrl= 0.00000 + 0.00000 + 0.00000 etot= -10620.77227 -10620.77227 -10624.41286 -10624.41286 -10624.22272 -10624.22272 -10624.22272 ag i d8 5s2 5d 10 -10624.2227 0 76.4160 1 49.9694 1 1.9449 2 0.0149 2 1.5291 3 0.4554 3 0.5798 4 0.4188 4 0.3019 4 t(run)= 15.35, t(job)= 384.89 seconds 47 1ag i d10 5g 4d10 5g ag i d10 5g nconf= 23 z= 47 ncores= 9 nvales= 1 ion= 0 r(i)/x(i)=0.24532669 ca1=0.700 tolstb=1.000 tolk-2=1.00000 tolend= 0.5E-07 thresh= 0.1E-10 kut= 0 exf=1.000 corrf=0.000 ca0= 0.500 rcn mod 32 ihf1= 0 mesh=2601 idb= 481 rdb= 100.461 emx= 0.10 r(mesh)=5426.209 irel= 1 ib=2600 t(run)= 12.20, t(job)= 397.09 seconds nl wnl ee az (r-3) (r-2) (r-1) (r+1) (r+2) (r+3) (r+4) (r+6) 1s 2. -1885.06666 881.507 0.000E+00 5.213E+03 4.936E+01 3.112E-02 1.308E-03 6.934E-05 4.438E-06 2.867E-08 2s 2. -280.33754 295.095 0.000E+00 5.731E+02 1.123E+01 1.350E-01 2.146E-02 3.880E-03 7.892E-04 4.505E-05 2p 6. -254.20520 3360.692 3.659E+03 1.600E+02 1.083E+01 1.175E-01 1.683E-02 2.853E-03 5.593E-04 3.126E-05 3s 2. -52.55378 127.553 0.000E+00 1.088E+02 3.931E+00 3.700E-01 1.565E-01 7.318E-02 3.748E-02 1.276E-02 3p 6. -43.44400 1500.439 6.406E+02 3.004E+01 3.735E+00 3.687E-01 1.577E-01 7.538E-02 3.987E-02 1.484E-02 3d 10. -29.19683 3211.671 9.185E+01 1.570E+01 3.533E+00 3.450E-01 1.415E-01 6.773E-02 3.720E-02 1.614E-02 4s 2. -8.21119 56.016 0.000E+00 2.149E+01 1.516E+00 9.139E-01 9.475E-01 1.082E+00 1.354E+00 2.767E+00 4p 6. -5.47007 619.965 1.071E+02 5.509E+00 1.356E+00 1.004E+00 1.156E+00 1.486E+00 2.119E+00 5.841E+00 4d 10. -1.50879 1036.575 8.404E+00 1.825E+00 9.716E-01 1.397E+00 2.375E+00 4.802E+00 1.143E+01 1.006E+02 5g 1. -0.04000 0.000 8.890E-05 1.778E-03 4.000E-02 2.750E+01 8.250E+02 2.681E+04 9.384E+05 1.408E+09 47. 1.318E+04 2.727E+02 5.676E+01 8.604E+02 2.687E+04 9.386E+05 1.408E+09 1. 2.804E+02 5.802E+00 1.208E+00 1.831E+01 5.718E+02 1.997E+04 2.995E+07 --------------------zeta--------------------- nl wnl ----blume-watson---- -----(r*vi)----- i (ryd) eps s evel edar evel+edar erel (ryd) (cm-1) (ryd) (cm-1) 1s 2. 0.00000 0.000 0.00000 0.000-2274.99731 -1876.80309 -398.58177 331.78500 -66.797 -1943.59986 2s 2. 0.00000 0.000 0.00000 0.000 -567.83950 -281.62258 -54.21010 36.23415 -17.976 -299.59853 2p 6. 8.55158 938426.773 8.80416 966144.843 -555.32084 -254.35249 -7.22339 -0.01376 -7.223 -261.57589 3s 2. 0.00000 0.000 0.00000 0.000 -234.94456 -54.15891 -10.56400 6.74663 -3.817 -57.97628 3p 6. 1.49473 164028.098 1.53292 168218.909 -227.34854 -45.00673 -1.64589 -0.00221 -1.646 -46.65262 3d 10. 0.17191 18864.973 0.18429 20224.034 -218.95188 -30.42268 -0.37676 -0.01081 -0.377 -30.79944 4s 2. 0.00000 0.000 0.00000 0.000 -108.22126 -8.97332 -2.06002 1.30044 -0.760 -9.73290 4p 6. 0.24966 27397.079 0.25575 28064.980 -99.37775 -6.18901 -0.29109 -0.00026 -0.291 -6.48010 4d 10. 0.01547 1698.153 0.01645 1804.895 -75.87238 -2.03315 -0.03955 -0.00095 -0.040 -2.07270 5g 1. 0.00000 0.016 0.00000 0.001 -3.72003 -0.02105 0.00000 0.00000 0.000 -0.02105 ag i d10 5g nconf= 23 z= 47 ion= 0 kut=-1 exf=0.650 corrf=0.000 ca1=0.700 ca0=0.500 without correlation with correlation ----------------------- ----------------------- nl wnl eps fg eps fgr corr eps fg eps fgr n*r n*rc ect ec----------------- 1s 2. -1885.91229 -1885.91229-0.08290 -1885.99519 -1885.99519 0.0230 0.0230 -0.08267 0.00000-0.08267 2s 2. -284.68582 -284.68582-0.08232 -284.76815 -284.76815 0.0593 0.0593 -0.23110 -0.06744-0.08099 2p 6. -255.32067 -255.32067-0.08242 -255.40309 -255.40309 0.0626 0.0626 -0.72296 -0.08169-0.08186-0.08197-0.08206-0.08218 3s 2. -55.49267 -55.49267-0.08107 -55.57374 -55.57374 0.1342 0.1341 -0.86759 -0.06668-0.07795 3p 6. -45.54042 -45.54042-0.08107 -45.62149 -45.62149 0.1482 0.1481 -1.34526 -0.07880-0.07928-0.07960-0.07983-0.08015 3d 10. -29.74768 -29.74768-0.08120 -29.82888 -29.82888 0.1833 0.1831 -2.15235 -0.08039-0.08049-0.08057-0.08064-0.08095 4s 2. -9.24362 -9.24362-0.07796 -9.32158 -9.32158 0.3289 0.3275 -2.28891 -0.06401-0.07255 4p 6. -6.17983 -6.17983-0.07741 -6.25724 -6.25724 0.4023 0.3998 -2.73478 -0.07233-0.07355-0.07430-0.07484-0.07559 4d 10. -1.65527 -1.65527-0.07408 -1.72935 -1.72935 0.7773 0.7604 -3.45992 -0.06933-0.07096-0.07175-0.07230-0.07408 5g 1. -0.04000 -0.04000-0.00001 -0.04001 -0.04001 5.0000 4.9992 -3.45993 -0.00001 ecorrt= -3.64661 (old) ect= -3.45993 (new) etotrl= 0.00000 + 0.00000 + 0.00000 etot= -10621.61729 -10621.61729 -10625.26389 -10625.26389 -10625.07722 -10625.07722 -10625.07722 ag i d10 5g 2 -10625.0772 0 0.0000 2 t(run)= 16.94, t(job)= 401.83 seconds 47 1ag i d10 6g 4d10 6g ag i d10 6g nconf= 24 z= 47 ncores= 9 nvales= 1 ion= 0 r(i)/x(i)=0.24532669 ca1=0.700 tolstb=1.000 tolk-2=1.00000 tolend= 0.5E-07 thresh= 0.1E-10 kut= 0 exf=1.000 corrf=0.000 ca0= 0.500 rcn mod 32 ihf1= 0 mesh=2601 idb= 481 rdb= 100.461 emx= 0.10 r(mesh)=5426.209 irel= 1 ib=2600 t(run)= 12.74, t(job)= 414.57 seconds nl wnl ee az (r-3) (r-2) (r-1) (r+1) (r+2) (r+3) (r+4) (r+6) 1s 2. -1885.09110 881.507 0.000E+00 5.213E+03 4.936E+01 3.112E-02 1.308E-03 6.934E-05 4.438E-06 2.867E-08 2s 2. -280.36199 295.095 0.000E+00 5.731E+02 1.123E+01 1.350E-01 2.146E-02 3.880E-03 7.892E-04 4.505E-05 2p 6. -254.22964 3360.692 3.659E+03 1.600E+02 1.083E+01 1.175E-01 1.683E-02 2.853E-03 5.593E-04 3.126E-05 3s 2. -52.57823 127.553 0.000E+00 1.088E+02 3.931E+00 3.700E-01 1.565E-01 7.318E-02 3.748E-02 1.276E-02 3p 6. -43.46844 1500.439 6.406E+02 3.004E+01 3.735E+00 3.687E-01 1.577E-01 7.538E-02 3.987E-02 1.484E-02 3d 10. -29.22127 3211.671 9.185E+01 1.570E+01 3.533E+00 3.450E-01 1.415E-01 6.773E-02 3.720E-02 1.614E-02 4s 2. -8.23563 56.016 0.000E+00 2.149E+01 1.516E+00 9.139E-01 9.475E-01 1.082E+00 1.354E+00 2.767E+00 4p 6. -5.49451 619.965 1.071E+02 5.509E+00 1.356E+00 1.004E+00 1.156E+00 1.486E+00 2.119E+00 5.841E+00 4d 10. -1.53323 1036.575 8.404E+00 1.825E+00 9.716E-01 1.397E+00 2.375E+00 4.802E+00 1.143E+01 1.006E+02 6g 1. -0.02778 0.000 5.145E-05 1.029E-03 2.778E-02 4.400E+01 2.178E+03 1.158E+05 6.486E+06 2.312E+10 47. 1.318E+04 2.727E+02 7.326E+01 2.213E+03 1.159E+05 6.486E+06 2.312E+10 1. 2.804E+02 5.802E+00 1.559E+00 4.709E+01 2.466E+03 1.380E+05 4.918E+08 --------------------zeta--------------------- nl wnl ----blume-watson---- -----(r*vi)----- i (ryd) eps s evel edar evel+edar erel (ryd) (cm-1) (ryd) (cm-1) 1s 2. 0.00000 0.000 0.00000 0.000-2274.99730 -1876.82753 -398.58176 331.78496 -66.797 -1943.62433 2s 2. 0.00000 0.000 0.00000 0.000 -567.83950 -281.64702 -54.21010 36.23414 -17.976 -299.62298 2p 6. 8.55158 938426.773 8.80416 966144.843 -555.32084 -254.37694 -7.22339 -0.01376 -7.223 -261.60033 3s 2. 0.00000 0.000 0.00000 0.000 -234.94456 -54.18336 -10.56400 6.74663 -3.817 -58.00073 3p 6. 1.49473 164028.098 1.53292 168218.910 -227.34854 -45.03118 -1.64589 -0.00221 -1.646 -46.67706 3d 10. 0.17191 18864.973 0.18429 20224.034 -218.95188 -30.44713 -0.37676 -0.01081 -0.377 -30.82388 4s 2. 0.00000 0.000 0.00000 0.000 -108.22126 -8.99776 -2.06002 1.30044 -0.760 -9.75735 4p 6. 0.24966 27397.079 0.25575 28064.980 -99.37775 -6.21346 -0.29109 -0.00026 -0.291 -6.50455 4d 10. 0.01547 1698.153 0.01645 1804.895 -75.87238 -2.05760 -0.03955 -0.00095 -0.040 -2.09715 6g 1. 0.00000 0.009 0.00000 0.000 -2.58339 -0.01739 0.00000 0.00000 0.000 -0.01739 ag i d10 6g nconf= 24 z= 47 ion= 0 kut=-1 exf=0.650 corrf=0.000 ca1=0.700 ca0=0.500 without correlation with correlation ----------------------- ----------------------- nl wnl eps fg eps fgr corr eps fg eps fgr n*r n*rc ect ec----------------- 1s 2. -1885.93673 -1885.93673-0.08290 -1886.01963 -1886.01963 0.0230 0.0230 -0.08267 0.00000-0.08267 2s 2. -284.71027 -284.71027-0.08232 -284.79259 -284.79259 0.0593 0.0593 -0.23110 -0.06744-0.08099 2p 6. -255.34512 -255.34512-0.08242 -255.42753 -255.42753 0.0626 0.0626 -0.72296 -0.08169-0.08186-0.08197-0.08206-0.08218 3s 2. -55.51712 -55.51712-0.08107 -55.59818 -55.59818 0.1342 0.1341 -0.86759 -0.06668-0.07795 3p 6. -45.56487 -45.56487-0.08107 -45.64593 -45.64593 0.1481 0.1480 -1.34526 -0.07880-0.07928-0.07960-0.07983-0.08015 3d 10. -29.77213 -29.77213-0.08120 -29.85332 -29.85332 0.1833 0.1830 -2.15235 -0.08039-0.08049-0.08057-0.08064-0.08095 4s 2. -9.26807 -9.26807-0.07796 -9.34602 -9.34602 0.3285 0.3271 -2.28891 -0.06401-0.07255 4p 6. -6.20428 -6.20428-0.07741 -6.28169 -6.28169 0.4015 0.3990 -2.73478 -0.07233-0.07355-0.07430-0.07484-0.07559 4d 10. -1.67972 -1.67972-0.07408 -1.75379 -1.75379 0.7716 0.7551 -3.45992 -0.06933-0.07096-0.07175-0.07230-0.07408 6g 1. -0.02778 -0.02778-0.00001 -0.02779 -0.02779 5.9998 5.9984 -3.45993 -0.00001 ecorrt= -3.64660 (old) ect= -3.45993 (new) etotrl= 0.00000 + 0.00000 + 0.00000 etot= -10621.60506 -10621.60506 -10625.25166 -10625.25166 -10625.06498 -10625.06498 -10625.06498 ag i d10 6g 2 -10625.0650 0 0.0000 2 t(run)= 17.10, t(job)= 418.93 seconds 47 1ag i d10 7g 4d10 7g ag i d10 7g nconf= 25 z= 47 ncores= 9 nvales= 1 ion= 0 r(i)/x(i)=0.24532669 ca1=0.700 tolstb=1.000 tolk-2=1.00000 tolend= 0.5E-07 thresh= 0.1E-10 kut= 0 exf=1.000 corrf=0.000 ca0= 0.500 rcn mod 32 ihf1= 0 mesh=2601 idb= 481 rdb= 100.461 emx= 0.10 r(mesh)=5426.209 irel= 1 ib=2600 t(run)= 12.13, t(job)= 431.06 seconds nl wnl ee az (r-3) (r-2) (r-1) (r+1) (r+2) (r+3) (r+4) (r+6) 1s 2. -1885.10583 881.507 0.000E+00 5.213E+03 4.936E+01 3.112E-02 1.308E-03 6.934E-05 4.438E-06 2.867E-08 2s 2. -280.37673 295.095 0.000E+00 5.731E+02 1.123E+01 1.350E-01 2.146E-02 3.880E-03 7.892E-04 4.505E-05 2p 6. -254.24438 3360.692 3.659E+03 1.600E+02 1.083E+01 1.175E-01 1.683E-02 2.853E-03 5.593E-04 3.126E-05 3s 2. -52.59296 127.553 0.000E+00 1.088E+02 3.931E+00 3.700E-01 1.565E-01 7.318E-02 3.748E-02 1.276E-02 3p 6. -43.48318 1500.439 6.406E+02 3.004E+01 3.735E+00 3.687E-01 1.577E-01 7.538E-02 3.987E-02 1.484E-02 3d 10. -29.23601 3211.671 9.185E+01 1.570E+01 3.533E+00 3.450E-01 1.415E-01 6.773E-02 3.720E-02 1.614E-02 4s 2. -8.25037 56.016 0.000E+00 2.149E+01 1.516E+00 9.139E-01 9.475E-01 1.082E+00 1.354E+00 2.767E+00 4p 6. -5.50925 619.965 1.071E+02 5.509E+00 1.356E+00 1.004E+00 1.156E+00 1.486E+00 2.119E+00 5.841E+00 4d 10. -1.54797 1036.575 8.404E+00 1.825E+00 9.716E-01 1.397E+00 2.375E+00 4.802E+00 1.143E+01 1.006E+02 7g 1. -0.02041 0.000 3.241E-05 6.480E-04 2.041E-02 6.350E+01 4.557E+03 3.487E+05 2.786E+07 1.964E+11 47. 1.318E+04 2.727E+02 9.276E+01 4.592E+03 3.488E+05 2.786E+07 1.964E+11 1. 2.804E+02 5.802E+00 1.974E+00 9.771E+01 7.421E+03 5.927E+05 4.179E+09 --------------------zeta--------------------- nl wnl ----blume-watson---- -----(r*vi)----- i (ryd) eps s evel edar evel+edar erel (ryd) (cm-1) (ryd) (cm-1) 1s 2. 0.00000 0.000 0.00000 0.000-2274.99730 -1876.84226 -398.58176 331.78494 -66.797 -1943.63908 2s 2. 0.00000 0.000 0.00000 0.000 -567.83950 -281.66176 -54.21010 36.23414 -17.976 -299.63772 2p 6. 8.55158 938426.774 8.80416 966144.843 -555.32084 -254.39168 -7.22339 -0.01376 -7.223 -261.61507 3s 2. 0.00000 0.000 0.00000 0.000 -234.94456 -54.19810 -10.56400 6.74662 -3.817 -58.01547 3p 6. 1.49473 164028.098 1.53292 168218.910 -227.34854 -45.04591 -1.64589 -0.00221 -1.646 -46.69180 3d 10. 0.17191 18864.973 0.18429 20224.034 -218.95188 -30.46187 -0.37676 -0.01081 -0.377 -30.83862 4s 2. 0.00000 0.000 0.00000 0.000 -108.22126 -9.01250 -2.06002 1.30044 -0.760 -9.77209 4p 6. 0.24966 27397.079 0.25575 28064.980 -99.37775 -6.22819 -0.29109 -0.00026 -0.291 -6.51929 4d 10. 0.01547 1698.153 0.01645 1804.895 -75.87238 -2.07234 -0.03955 -0.00095 -0.040 -2.11188 7g 1. 0.00000 0.005 0.00000 0.000 -1.89802 -0.01379 0.00000 0.00000 0.000 -0.01379 ag i d10 7g nconf= 25 z= 47 ion= 0 kut=-1 exf=0.650 corrf=0.000 ca1=0.700 ca0=0.500 without correlation with correlation ----------------------- ----------------------- nl wnl eps fg eps fgr corr eps fg eps fgr n*r n*rc ect ec----------------- 1s 2. -1885.95146 -1885.95146-0.08290 -1886.03437 -1886.03437 0.0230 0.0230 -0.08267 0.00000-0.08267 2s 2. -284.72500 -284.72500-0.08232 -284.80733 -284.80733 0.0593 0.0593 -0.23110 -0.06744-0.08099 2p 6. -255.35985 -255.35985-0.08242 -255.44227 -255.44227 0.0626 0.0626 -0.72296 -0.08169-0.08186-0.08197-0.08206-0.08218 3s 2. -55.53186 -55.53186-0.08107 -55.61292 -55.61292 0.1342 0.1341 -0.86759 -0.06668-0.07795 3p 6. -45.57961 -45.57961-0.08107 -45.66067 -45.66067 0.1481 0.1480 -1.34526 -0.07880-0.07928-0.07960-0.07983-0.08015 3d 10. -29.78687 -29.78687-0.08120 -29.86806 -29.86806 0.1832 0.1830 -2.15235 -0.08039-0.08049-0.08057-0.08064-0.08095 4s 2. -9.28280 -9.28280-0.07796 -9.36076 -9.36076 0.3282 0.3268 -2.28891 -0.06401-0.07255 4p 6. -6.21902 -6.21902-0.07741 -6.29642 -6.29642 0.4010 0.3985 -2.73478 -0.07233-0.07355-0.07430-0.07484-0.07559 4d 10. -1.69445 -1.69445-0.07408 -1.76853 -1.76853 0.7682 0.7520 -3.45992 -0.06933-0.07096-0.07175-0.07230-0.07408 7g 1. -0.02041 -0.02041-0.00001 -0.02042 -0.02042 7.0003 6.9985 -3.45993 -0.00001 ecorrt= -3.64660 (old) ect= -3.45993 (new) etotrl= 0.00000 + 0.00000 + 0.00000 etot= -10621.59767 -10621.59767 -10625.24428 -10625.24428 -10625.05760 -10625.05760 -10625.05760 ag i d10 7g 2 -10625.0576 0 0.0000 2 t(run)= 16.81, t(job)= 435.74 seconds 47 1ag i d10 8g 4d10 8g ag i d10 8g nconf= 26 z= 47 ncores= 9 nvales= 1 ion= 0 r(i)/x(i)=0.24532669 ca1=0.700 tolstb=1.000 tolk-2=1.00000 tolend= 0.5E-07 thresh= 0.1E-10 kut= 0 exf=1.000 corrf=0.000 ca0= 0.500 rcn mod 32 ihf1= 0 mesh=2601 idb= 481 rdb= 100.461 emx= 0.10 r(mesh)=5426.209 irel= 1 ib=2600 t(run)= 12.38, t(job)= 448.13 seconds nl wnl ee az (r-3) (r-2) (r-1) (r+1) (r+2) (r+3) (r+4) (r+6) 1s 2. -1885.11540 881.507 0.000E+00 5.213E+03 4.936E+01 3.112E-02 1.308E-03 6.934E-05 4.438E-06 2.867E-08 2s 2. -280.38629 295.095 0.000E+00 5.731E+02 1.123E+01 1.350E-01 2.146E-02 3.880E-03 7.892E-04 4.505E-05 2p 6. -254.25395 3360.692 3.659E+03 1.600E+02 1.083E+01 1.175E-01 1.683E-02 2.853E-03 5.593E-04 3.126E-05 3s 2. -52.60253 127.553 0.000E+00 1.088E+02 3.931E+00 3.700E-01 1.565E-01 7.318E-02 3.748E-02 1.276E-02 3p 6. -43.49275 1500.439 6.406E+02 3.004E+01 3.735E+00 3.687E-01 1.577E-01 7.538E-02 3.987E-02 1.484E-02 3d 10. -29.24558 3211.671 9.185E+01 1.570E+01 3.533E+00 3.450E-01 1.415E-01 6.773E-02 3.720E-02 1.614E-02 4s 2. -8.25994 56.016 0.000E+00 2.149E+01 1.516E+00 9.139E-01 9.475E-01 1.082E+00 1.354E+00 2.767E+00 4p 6. -5.51881 619.965 1.071E+02 5.509E+00 1.356E+00 1.004E+00 1.156E+00 1.486E+00 2.119E+00 5.841E+00 4d 10. -1.55754 1036.575 8.404E+00 1.825E+00 9.716E-01 1.397E+00 2.375E+00 4.802E+00 1.143E+01 1.006E+02 8g 1. -0.01563 0.000 2.171E-05 4.341E-04 1.563E-02 8.600E+01 8.352E+03 8.611E+05 9.225E+07 1.153E+12 47. 1.318E+04 2.727E+02 1.153E+02 8.387E+03 8.612E+05 9.225E+07 1.153E+12 1. 2.804E+02 5.802E+00 2.452E+00 1.785E+02 1.832E+04 1.963E+06 2.453E+10 --------------------zeta--------------------- nl wnl ----blume-watson---- -----(r*vi)----- i (ryd) eps s evel edar evel+edar erel (ryd) (cm-1) (ryd) (cm-1) 1s 2. 0.00000 0.000 0.00000 0.000-2274.99730 -1876.85183 -398.58175 331.78492 -66.797 -1943.64866 2s 2. 0.00000 0.000 0.00000 0.000 -567.83950 -281.67133 -54.21010 36.23414 -17.976 -299.64729 2p 6. 8.55158 938426.774 8.80416 966144.843 -555.32084 -254.40124 -7.22339 -0.01376 -7.223 -261.62463 3s 2. 0.00000 0.000 0.00000 0.000 -234.94456 -54.20766 -10.56400 6.74662 -3.817 -58.02503 3p 6. 1.49473 164028.098 1.53292 168218.910 -227.34854 -45.05548 -1.64589 -0.00221 -1.646 -46.70137 3d 10. 0.17191 18864.973 0.18429 20224.034 -218.95188 -30.47143 -0.37676 -0.01081 -0.377 -30.84819 4s 2. 0.00000 0.000 0.00000 0.000 -108.22126 -9.02207 -2.06002 1.30044 -0.760 -9.78165 4p 6. 0.24966 27397.079 0.25575 28064.980 -99.37775 -6.23776 -0.29109 -0.00026 -0.291 -6.52885 4d 10. 0.01547 1698.153 0.01645 1804.895 -75.87238 -2.08190 -0.03955 -0.00095 -0.040 -2.12145 8g 1. 0.00000 0.004 0.00000 0.000 -1.45319 -0.01102 0.00000 0.00000 0.000 -0.01102 ag i d10 8g nconf= 26 z= 47 ion= 0 kut=-1 exf=0.650 corrf=0.000 ca1=0.700 ca0=0.500 without correlation with correlation ----------------------- ----------------------- nl wnl eps fg eps fgr corr eps fg eps fgr n*r n*rc ect ec----------------- 1s 2. -1885.96103 -1885.96103-0.08290 -1886.04393 -1886.04393 0.0230 0.0230 -0.08267 0.00000-0.08267 2s 2. -284.73457 -284.73457-0.08232 -284.81689 -284.81689 0.0593 0.0593 -0.23110 -0.06744-0.08099 2p 6. -255.36942 -255.36942-0.08242 -255.45184 -255.45184 0.0626 0.0626 -0.72296 -0.08169-0.08186-0.08197-0.08206-0.08218 3s 2. -55.54142 -55.54142-0.08107 -55.62249 -55.62249 0.1342 0.1341 -0.86759 -0.06668-0.07795 3p 6. -45.58917 -45.58917-0.08107 -45.67024 -45.67024 0.1481 0.1480 -1.34526 -0.07880-0.07928-0.07960-0.07983-0.08015 3d 10. -29.79643 -29.79643-0.08120 -29.87763 -29.87763 0.1832 0.1829 -2.15235 -0.08039-0.08049-0.08057-0.08064-0.08095 4s 2. -9.29237 -9.29237-0.07796 -9.37033 -9.37033 0.3280 0.3267 -2.28891 -0.06401-0.07255 4p 6. -6.22858 -6.22858-0.07741 -6.30599 -6.30599 0.4007 0.3982 -2.73478 -0.07233-0.07355-0.07430-0.07484-0.07559 4d 10. -1.70402 -1.70402-0.07408 -1.77810 -1.77810 0.7661 0.7499 -3.45992 -0.06933-0.07096-0.07175-0.07230-0.07408 8g 1. -0.01563 -0.01563-0.00001 -0.01563 -0.01563 7.9999 7.9980 -3.45992 -0.00001 ecorrt= -3.64660 (old) ect= -3.45992 (new) etotrl= 0.00000 + 0.00000 + 0.00000 etot= -10621.59289 -10621.59289 -10625.23949 -10625.23949 -10625.05281 -10625.05281 -10625.05281 ag i d10 8g 2 -10625.0528 0 0.0000 2 t(run)= 17.54, t(job)= 453.28 seconds 47 1ag i d10 9g 4d10 9g ag i d10 9g nconf= 27 z= 47 ncores= 9 nvales= 1 ion= 0 r(i)/x(i)=0.24532669 ca1=0.700 tolstb=1.000 tolk-2=1.00000 tolend= 0.5E-07 thresh= 0.1E-10 kut= 0 exf=1.000 corrf=0.000 ca0= 0.500 rcn mod 32 ihf1= 0 mesh=2601 idb= 481 rdb= 100.461 emx= 0.10 r(mesh)=5426.209 irel= 1 ib=2600 t(run)= 10.07, t(job)= 463.35 seconds nl wnl ee az (r-3) (r-2) (r-1) (r+1) (r+2) (r+3) (r+4) (r+6) 1s 2. -1885.12195 881.507 0.000E+00 5.213E+03 4.936E+01 3.112E-02 1.308E-03 6.934E-05 4.438E-06 2.867E-08 2s 2. -280.39285 295.095 0.000E+00 5.731E+02 1.123E+01 1.350E-01 2.146E-02 3.880E-03 7.892E-04 4.505E-05 2p 6. -254.26050 3360.692 3.659E+03 1.600E+02 1.083E+01 1.175E-01 1.683E-02 2.853E-03 5.593E-04 3.126E-05 3s 2. -52.60909 127.553 0.000E+00 1.088E+02 3.931E+00 3.700E-01 1.565E-01 7.318E-02 3.748E-02 1.276E-02 3p 6. -43.49930 1500.439 6.406E+02 3.004E+01 3.735E+00 3.687E-01 1.577E-01 7.538E-02 3.987E-02 1.484E-02 3d 10. -29.25214 3211.670 9.185E+01 1.570E+01 3.533E+00 3.450E-01 1.415E-01 6.773E-02 3.720E-02 1.614E-02 4s 2. -8.26650 56.016 0.000E+00 2.149E+01 1.516E+00 9.139E-01 9.475E-01 1.082E+00 1.354E+00 2.767E+00 4p 6. -5.52537 619.965 1.071E+02 5.509E+00 1.356E+00 1.004E+00 1.156E+00 1.486E+00 2.119E+00 5.841E+00 4d 10. -1.56409 1036.575 8.404E+00 1.825E+00 9.716E-01 1.397E+00 2.375E+00 4.802E+00 1.143E+01 1.006E+02 9g 1. -0.01235 0.000 1.525E-05 3.049E-04 1.235E-02 1.115E+02 1.401E+04 1.864E+06 2.571E+08 5.277E+12 47. 1.318E+04 2.727E+02 1.408E+02 1.405E+04 1.864E+06 2.571E+08 5.277E+12 1. 2.804E+02 5.802E+00 2.995E+00 2.989E+02 3.967E+04 5.469E+06 1.123E+11 --------------------zeta--------------------- nl wnl ----blume-watson---- -----(r*vi)----- i (ryd) eps s evel edar evel+edar erel (ryd) (cm-1) (ryd) (cm-1) 1s 2. 0.00000 0.000 0.00000 0.000-2274.99729 -1876.85839 -398.58175 331.78491 -66.797 -1943.65522 2s 2. 0.00000 0.000 0.00000 0.000 -567.83950 -281.67788 -54.21010 36.23414 -17.976 -299.65385 2p 6. 8.55158 938426.773 8.80416 966144.843 -555.32084 -254.40780 -7.22339 -0.01376 -7.223 -261.63119 3s 2. 0.00000 0.000 0.00000 0.000 -234.94456 -54.21422 -10.56400 6.74662 -3.817 -58.03159 3p 6. 1.49473 164028.098 1.53292 168218.910 -227.34854 -45.06204 -1.64589 -0.00221 -1.646 -46.70793 3d 10. 0.17191 18864.973 0.18429 20224.034 -218.95188 -30.47799 -0.37676 -0.01081 -0.377 -30.85475 4s 2. 0.00000 0.000 0.00000 0.000 -108.22126 -9.02863 -2.06002 1.30044 -0.760 -9.78821 4p 6. 0.24966 27397.078 0.25575 28064.979 -99.37775 -6.24432 -0.29109 -0.00026 -0.291 -6.53541 4d 10. 0.01547 1698.153 0.01645 1804.895 -75.87238 -2.08846 -0.03955 -0.00095 -0.040 -2.12801 9g 1. 0.00000 0.003 0.00000 0.000 -1.14821 -0.00895 0.00000 0.00000 0.000 -0.00895 ag i d10 9g nconf= 27 z= 47 ion= 0 kut=-1 exf=0.650 corrf=0.000 ca1=0.700 ca0=0.500 without correlation with correlation ----------------------- ----------------------- nl wnl eps fg eps fgr corr eps fg eps fgr n*r n*rc ect ec----------------- 1s 2. -1885.96758 -1885.96758-0.08290 -1886.05049 -1886.05049 0.0230 0.0230 -0.08267 0.00000-0.08267 2s 2. -284.74113 -284.74113-0.08232 -284.82345 -284.82345 0.0593 0.0593 -0.23110 -0.06744-0.08099 2p 6. -255.37598 -255.37598-0.08242 -255.45840 -255.45840 0.0626 0.0626 -0.72296 -0.08169-0.08186-0.08197-0.08206-0.08218 3s 2. -55.54798 -55.54798-0.08107 -55.62905 -55.62905 0.1342 0.1341 -0.86759 -0.06668-0.07795 3p 6. -45.59573 -45.59573-0.08107 -45.67680 -45.67680 0.1481 0.1480 -1.34526 -0.07880-0.07928-0.07960-0.07983-0.08015 3d 10. -29.80299 -29.80299-0.08120 -29.88419 -29.88419 0.1832 0.1829 -2.15235 -0.08039-0.08049-0.08057-0.08064-0.08095 4s 2. -9.29893 -9.29893-0.07796 -9.37689 -9.37689 0.3279 0.3266 -2.28891 -0.06401-0.07255 4p 6. -6.23514 -6.23514-0.07741 -6.31255 -6.31255 0.4005 0.3980 -2.73478 -0.07233-0.07355-0.07430-0.07484-0.07559 4d 10. -1.71058 -1.71058-0.07408 -1.78466 -1.78466 0.7646 0.7486 -3.45992 -0.06933-0.07096-0.07175-0.07230-0.07408 9g 1. -0.01234 -0.01234-0.00001 -0.01235 -0.01235 9.0011 8.9990 -3.45992 -0.00001 ecorrt= -3.64660 (old) ect= -3.45992 (new) etotrl= 0.00000 + 0.00000 + 0.00000 etot= -10621.58960 -10621.58960 -10625.23620 -10625.23620 -10625.04952 -10625.04952 -10625.04952 ag i d10 9g 2 -10625.0495 0 0.0000 2 t(run)= 14.67, t(job)= 467.95 seconds 47 1ag i d9 5s5g 4d9 5s 5g ag i d9 5s5g nconf= 28 z= 47 ncores=10 nvales= 1 ion= 0 r(i)/x(i)=0.24532669 ca1=0.700 tolstb=1.000 tolk-2=1.00000 tolend= 0.5E-07 thresh= 0.1E-10 kut= 0 exf=1.000 corrf=0.000 ca0= 0.500 rcn mod 32 ihf1= 0 mesh=2601 idb= 481 rdb= 100.461 emx= 0.10 r(mesh)=5426.209 irel= 1 ib=2600 t(run)= 10.92, t(job)= 478.88 seconds nl wnl ee az (r-3) (r-2) (r-1) (r+1) (r+2) (r+3) (r+4) (r+6) 1s 2. -1885.40554 881.505 0.000E+00 5.213E+03 4.936E+01 3.112E-02 1.308E-03 6.934E-05 4.438E-06 2.867E-08 2s 2. -280.69312 295.093 0.000E+00 5.731E+02 1.123E+01 1.350E-01 2.146E-02 3.880E-03 7.892E-04 4.505E-05 2p 6. -254.55944 3360.615 3.659E+03 1.600E+02 1.083E+01 1.175E-01 1.684E-02 2.853E-03 5.593E-04 3.126E-05 3s 2. -52.90357 127.558 0.000E+00 1.088E+02 3.931E+00 3.700E-01 1.565E-01 7.317E-02 3.748E-02 1.276E-02 3p 6. -43.79386 1500.501 6.406E+02 3.005E+01 3.735E+00 3.687E-01 1.577E-01 7.538E-02 3.986E-02 1.483E-02 3d 10. -29.54869 3212.018 9.187E+01 1.571E+01 3.533E+00 3.449E-01 1.415E-01 6.771E-02 3.719E-02 1.613E-02 4s 2. -8.54230 56.166 0.000E+00 2.160E+01 1.520E+00 9.114E-01 9.418E-01 1.071E+00 1.333E+00 2.683E+00 4p 6. -5.79179 623.307 1.083E+02 5.563E+00 1.363E+00 9.982E-01 1.142E+00 1.455E+00 2.052E+00 5.497E+00 4d 9. -1.79643 1073.600 8.994E+00 1.934E+00 1.004E+00 1.343E+00 2.170E+00 4.123E+00 9.126E+00 6.781E+01 5s 1. -1.12301 17.119 0.000E+00 2.118E+00 4.675E-01 2.734E+00 8.472E+00 2.923E+01 1.116E+02 2.168E+03 5g 1. -0.04000 0.000 8.891E-05 1.778E-03 4.000E-02 2.750E+01 8.250E+02 2.681E+04 9.384E+05 1.408E+09 47. 1.318E+04 2.725E+02 5.757E+01 8.645E+02 2.689E+04 9.386E+05 1.408E+09 1. 2.805E+02 5.799E+00 1.225E+00 1.839E+01 5.721E+02 1.997E+04 2.995E+07 --------------------zeta--------------------- nl wnl ----blume-watson---- -----(r*vi)----- i (ryd) eps s evel edar evel+edar erel (ryd) (cm-1) (ryd) (cm-1) 1s 2. 0.00000 0.000 0.00000 0.000-2274.99710 -1877.14185 -398.57966 331.78289 -66.797 -1943.93862 2s 2. 0.00000 0.000 0.00000 0.000 -567.83897 -281.97776 -54.20917 36.23357 -17.976 -299.95336 2p 6. 8.55126 938392.336 8.80382 966107.341 -555.31980 -254.70661 -7.22309 -0.01377 -7.223 -261.92969 3s 2. 0.00000 0.000 0.00000 0.000 -234.94724 -54.50908 -10.56476 6.74711 -3.818 -58.32673 3p 6. 1.49487 164042.946 1.53306 168233.436 -227.35202 -45.35695 -1.64604 -0.00221 -1.646 -47.00299 3d 10. 0.17194 18868.611 0.18433 20228.020 -218.95974 -30.77446 -0.37684 -0.01081 -0.377 -31.15130 4s 2. 0.00000 0.000 0.00000 0.000 -108.40485 -9.29998 -2.07114 1.30745 -0.764 -10.06367 4p 6. 0.25235 27692.514 0.25851 28367.729 -99.73441 -6.50686 -0.29425 -0.00026 -0.294 -6.80112 4d 9. 0.01659 1820.207 0.01763 1934.371 -77.91714 -2.33183 -0.04242 -0.00102 -0.042 -2.37426 5s 1. 0.00000 0.000 0.00000 0.000 -39.89825 -1.19056 -0.19280 0.12146 -0.071 -1.26190 5g 1. 0.00000 0.016 0.00000 0.001 -3.72013 -0.02109 0.00000 0.00000 0.000 -0.02109 ag i d9 5s5g nconf= 28 z= 47 ion= 0 kut=-1 exf=0.650 corrf=0.000 ca1=0.700 ca0=0.500 without correlation with correlation ----------------------- ----------------------- nl wnl eps fg eps fgr corr eps fg eps fgr n*r n*rc ect ec----------------- 1s 2. -1886.25236 -1886.25236-0.08290 -1886.33527 -1886.33527 0.0230 0.0230 -0.08267 0.00000-0.08267 2s 2. -285.04290 -285.04290-0.08232 -285.12522 -285.12522 0.0592 0.0592 -0.23110 -0.06744-0.08099 2p 6. -255.67416 -255.67416-0.08242 -255.75657 -255.75657 0.0625 0.0625 -0.72296 -0.08169-0.08186-0.08197-0.08206-0.08218 3s 2. -55.84871 -55.84871-0.08107 -55.92978 -55.92978 0.1338 0.1337 -0.86760 -0.06668-0.07795 3p 6. -45.89249 -45.89249-0.08107 -45.97355 -45.97355 0.1476 0.1475 -1.34526 -0.07880-0.07928-0.07960-0.07983-0.08015 3d 10. -30.09621 -30.09621-0.08120 -30.17740 -30.17740 0.1823 0.1820 -2.15235 -0.08039-0.08049-0.08057-0.08064-0.08095 4s 2. -9.57056 -9.57056-0.07794 -9.64850 -9.64850 0.3232 0.3219 -2.28909 -0.06414-0.07260 4p 6. -6.47100 -6.47100-0.07740 -6.54840 -6.54840 0.3931 0.3908 -2.73538 -0.07242-0.07363-0.07437-0.07491-0.07565 4d 9. -1.94856 -1.94856-0.07469 -2.02325 -2.02325 0.7164 0.7030 -3.39164 -0.07030-0.07165-0.07235-0.07285-0.07431 5s 1. -1.07372 -1.07372-0.05731 -1.13103 -1.13103 0.9651 0.9403 -3.44894 -0.05730 5g 1. -0.04000 -0.04000-0.00004 -0.04004 -0.04004 5.0000 4.9972 -3.44898 -0.00004 ecorrt= -3.63532 (old) ect= -3.44898 (new) etotrl= 0.00000 + 0.00000 + 0.00000 etot= -10621.27576 -10621.27576 -10624.91108 -10624.91108 -10624.72474 -10624.72474 -10624.72474 ag i d9 5s5g 10 -10624.7247 0 1.8202 2 0.0000 2 0.0423 3 0.0007 3 14.1995 4 0.0000 4 0.0000 4 0.0000 4 0.0002 4 t(run)= 15.75, t(job)= 483.70 seconds 47 1ag i d9 5s6g 4d9 5s 6g ag i d9 5s6g nconf= 29 z= 47 ncores=10 nvales= 1 ion= 0 r(i)/x(i)=0.24532669 ca1=0.700 tolstb=1.000 tolk-2=1.00000 tolend= 0.5E-07 thresh= 0.1E-10 kut= 0 exf=1.000 corrf=0.000 ca0= 0.500 rcn mod 32 ihf1= 0 mesh=2601 idb= 481 rdb= 100.461 emx= 0.10 r(mesh)=5426.209 irel= 1 ib=2600 t(run)= 12.71, t(job)= 496.41 seconds nl wnl ee az (r-3) (r-2) (r-1) (r+1) (r+2) (r+3) (r+4) (r+6) 1s 2. -1885.42998 881.504 0.000E+00 5.213E+03 4.936E+01 3.112E-02 1.308E-03 6.934E-05 4.438E-06 2.867E-08 2s 2. -280.71756 295.093 0.000E+00 5.731E+02 1.123E+01 1.350E-01 2.146E-02 3.880E-03 7.892E-04 4.505E-05 2p 6. -254.58388 3360.615 3.659E+03 1.600E+02 1.083E+01 1.175E-01 1.684E-02 2.853E-03 5.593E-04 3.126E-05 3s 2. -52.92801 127.558 0.000E+00 1.088E+02 3.931E+00 3.700E-01 1.565E-01 7.317E-02 3.748E-02 1.276E-02 3p 6. -43.81830 1500.501 6.406E+02 3.005E+01 3.735E+00 3.687E-01 1.577E-01 7.538E-02 3.986E-02 1.483E-02 3d 10. -29.57313 3212.018 9.187E+01 1.571E+01 3.533E+00 3.449E-01 1.415E-01 6.771E-02 3.719E-02 1.613E-02 4s 2. -8.56674 56.166 0.000E+00 2.160E+01 1.520E+00 9.114E-01 9.418E-01 1.071E+00 1.333E+00 2.683E+00 4p 6. -5.81623 623.307 1.083E+02 5.563E+00 1.363E+00 9.982E-01 1.142E+00 1.455E+00 2.052E+00 5.497E+00 4d 9. -1.82087 1073.600 8.994E+00 1.934E+00 1.004E+00 1.343E+00 2.170E+00 4.123E+00 9.126E+00 6.781E+01 5s 1. -1.14746 17.119 0.000E+00 2.118E+00 4.675E-01 2.734E+00 8.472E+00 2.923E+01 1.116E+02 2.168E+03 6g 1. -0.02778 0.000 5.148E-05 1.029E-03 2.778E-02 4.400E+01 2.178E+03 1.158E+05 6.486E+06 2.311E+10 47. 1.318E+04 2.725E+02 7.407E+01 2.217E+03 1.159E+05 6.486E+06 2.311E+10 1. 2.805E+02 5.799E+00 1.576E+00 4.718E+01 2.466E+03 1.380E+05 4.918E+08 --------------------zeta--------------------- nl wnl ----blume-watson---- -----(r*vi)----- i (ryd) eps s evel edar evel+edar erel (ryd) (cm-1) (ryd) (cm-1) 1s 2. 0.00000 0.000 0.00000 0.000-2274.99710 -1877.16629 -398.57965 331.78285 -66.797 -1943.96308 2s 2. 0.00000 0.000 0.00000 0.000 -567.83896 -282.00220 -54.20917 36.23356 -17.976 -299.97781 2p 6. 8.55126 938392.336 8.80382 966107.341 -555.31980 -254.73105 -7.22309 -0.01377 -7.223 -261.95414 3s 2. 0.00000 0.000 0.00000 0.000 -234.94724 -54.53352 -10.56476 6.74711 -3.818 -58.35117 3p 6. 1.49487 164042.946 1.53306 168233.437 -227.35202 -45.38139 -1.64604 -0.00221 -1.646 -47.02743 3d 10. 0.17194 18868.611 0.18433 20228.020 -218.95974 -30.79890 -0.37684 -0.01081 -0.377 -31.17574 4s 2. 0.00000 0.000 0.00000 0.000 -108.40485 -9.32442 -2.07114 1.30745 -0.764 -10.08811 4p 6. 0.25235 27692.514 0.25851 28367.729 -99.73441 -6.53131 -0.29425 -0.00026 -0.294 -6.82556 4d 9. 0.01659 1820.207 0.01763 1934.371 -77.91714 -2.35628 -0.04242 -0.00102 -0.042 -2.39870 5s 1. 0.00000 0.000 0.00000 0.000 -39.89825 -1.21500 -0.19280 0.12146 -0.071 -1.28634 6g 1. 0.00000 0.009 0.00000 0.000 -2.58355 -0.01743 0.00000 0.00000 0.000 -0.01743 ag i d9 5s6g nconf= 29 z= 47 ion= 0 kut=-1 exf=0.650 corrf=0.000 ca1=0.700 ca0=0.500 without correlation with correlation ----------------------- ----------------------- nl wnl eps fg eps fgr corr eps fg eps fgr n*r n*rc ect ec----------------- 1s 2. -1886.27680 -1886.27680-0.08290 -1886.35970 -1886.35970 0.0230 0.0230 -0.08267 0.00000-0.08267 2s 2. -285.06734 -285.06734-0.08232 -285.14967 -285.14967 0.0592 0.0592 -0.23110 -0.06744-0.08099 2p 6. -255.69860 -255.69860-0.08242 -255.78102 -255.78102 0.0625 0.0625 -0.72296 -0.08169-0.08186-0.08197-0.08206-0.08218 3s 2. -55.87315 -55.87315-0.08107 -55.95422 -55.95422 0.1338 0.1337 -0.86760 -0.06668-0.07795 3p 6. -45.91693 -45.91693-0.08107 -45.99799 -45.99799 0.1476 0.1474 -1.34526 -0.07880-0.07928-0.07960-0.07983-0.08015 3d 10. -30.12065 -30.12065-0.08120 -30.20185 -30.20185 0.1822 0.1820 -2.15235 -0.08039-0.08049-0.08057-0.08064-0.08095 4s 2. -9.59501 -9.59501-0.07794 -9.67295 -9.67295 0.3228 0.3215 -2.28909 -0.06414-0.07260 4p 6. -6.49544 -6.49544-0.07740 -6.57285 -6.57285 0.3924 0.3901 -2.73538 -0.07242-0.07363-0.07437-0.07491-0.07565 4d 9. -1.97300 -1.97300-0.07469 -2.04769 -2.04769 0.7119 0.6988 -3.39164 -0.07030-0.07165-0.07235-0.07285-0.07431 5s 1. -1.09816 -1.09816-0.05731 -1.15548 -1.15548 0.9543 0.9303 -3.44894 -0.05730 6g 1. -0.02778 -0.02778-0.00004 -0.02782 -0.02782 5.9998 5.9954 -3.44898 -0.00004 ecorrt= -3.63531 (old) ect= -3.44898 (new) etotrl= 0.00000 + 0.00000 + 0.00000 etot= -10621.26353 -10621.26353 -10624.89884 -10624.89884 -10624.71251 -10624.71251 -10624.71251 ag i d9 5s6g 10 -10624.7125 0 1.8202 2 0.0000 2 0.0245 3 0.0005 3 14.1995 4 0.0000 4 0.0000 4 0.0000 4 0.0002 4 t(run)= 17.97, t(job)= 501.67 seconds 47 1ag i d9 5s7g 4d9 5s 7g ag i d9 5s7g nconf= 30 z= 47 ncores=10 nvales= 1 ion= 0 r(i)/x(i)=0.24532669 ca1=0.700 tolstb=1.000 tolk-2=1.00000 tolend= 0.5E-07 thresh= 0.1E-10 kut= 0 exf=1.000 corrf=0.000 ca0= 0.500 rcn mod 32 ihf1= 0 mesh=2601 idb= 481 rdb= 100.461 emx= 0.10 r(mesh)=5426.209 irel= 1 ib=2600 t(run)= 12.86, t(job)= 514.53 seconds nl wnl ee az (r-3) (r-2) (r-1) (r+1) (r+2) (r+3) (r+4) (r+6) 1s 2. -1885.44471 881.504 0.000E+00 5.213E+03 4.936E+01 3.112E-02 1.308E-03 6.934E-05 4.438E-06 2.867E-08 2s 2. -280.73230 295.093 0.000E+00 5.731E+02 1.123E+01 1.350E-01 2.146E-02 3.880E-03 7.892E-04 4.505E-05 2p 6. -254.59862 3360.615 3.659E+03 1.600E+02 1.083E+01 1.175E-01 1.684E-02 2.853E-03 5.593E-04 3.126E-05 3s 2. -52.94275 127.558 0.000E+00 1.088E+02 3.931E+00 3.700E-01 1.565E-01 7.317E-02 3.748E-02 1.276E-02 3p 6. -43.83304 1500.501 6.406E+02 3.005E+01 3.735E+00 3.687E-01 1.577E-01 7.538E-02 3.986E-02 1.483E-02 3d 10. -29.58787 3212.018 9.187E+01 1.571E+01 3.533E+00 3.449E-01 1.415E-01 6.771E-02 3.719E-02 1.613E-02 4s 2. -8.58148 56.166 0.000E+00 2.160E+01 1.520E+00 9.114E-01 9.418E-01 1.071E+00 1.333E+00 2.683E+00 4p 6. -5.83097 623.307 1.083E+02 5.563E+00 1.363E+00 9.982E-01 1.142E+00 1.455E+00 2.052E+00 5.497E+00 4d 9. -1.83561 1073.600 8.994E+00 1.934E+00 1.004E+00 1.343E+00 2.170E+00 4.123E+00 9.126E+00 6.781E+01 5s 1. -1.16220 17.119 0.000E+00 2.118E+00 4.675E-01 2.734E+00 8.472E+00 2.923E+01 1.116E+02 2.168E+03 7g 1. -0.02041 0.000 3.244E-05 6.482E-04 2.041E-02 6.350E+01 4.557E+03 3.487E+05 2.785E+07 1.964E+11 47. 1.318E+04 2.725E+02 9.357E+01 4.596E+03 3.488E+05 2.785E+07 1.964E+11 1. 2.805E+02 5.798E+00 1.991E+00 9.779E+01 7.421E+03 5.926E+05 4.178E+09 --------------------zeta--------------------- nl wnl ----blume-watson---- -----(r*vi)----- i (ryd) eps s evel edar evel+edar erel (ryd) (cm-1) (ryd) (cm-1) 1s 2. 0.00000 0.000 0.00000 0.000-2274.99709 -1877.18102 -398.57964 331.78282 -66.797 -1943.97784 2s 2. 0.00000 0.000 0.00000 0.000 -567.83896 -282.01694 -54.20917 36.23356 -17.976 -299.99255 2p 6. 8.55126 938392.336 8.80382 966107.342 -555.31980 -254.74579 -7.22309 -0.01377 -7.223 -261.96888 3s 2. 0.00000 0.000 0.00000 0.000 -234.94724 -54.54826 -10.56476 6.74711 -3.818 -58.36591 3p 6. 1.49487 164042.946 1.53306 168233.437 -227.35202 -45.39613 -1.64604 -0.00221 -1.646 -47.04217 3d 10. 0.17194 18868.611 0.18433 20228.020 -218.95974 -30.81364 -0.37684 -0.01081 -0.377 -31.19048 4s 2. 0.00000 0.000 0.00000 0.000 -108.40485 -9.33916 -2.07114 1.30745 -0.764 -10.10285 4p 6. 0.25235 27692.514 0.25851 28367.729 -99.73441 -6.54605 -0.29425 -0.00026 -0.294 -6.84030 4d 9. 0.01659 1820.207 0.01763 1934.371 -77.91714 -2.37101 -0.04242 -0.00102 -0.042 -2.41344 5s 1. 0.00000 0.000 0.00000 0.000 -39.89825 -1.22974 -0.19280 0.12146 -0.071 -1.30108 7g 1. 0.00000 0.005 0.00000 0.000 -1.89820 -0.01382 0.00000 0.00000 0.000 -0.01382 ag i d9 5s7g nconf= 30 z= 47 ion= 0 kut=-1 exf=0.650 corrf=0.000 ca1=0.700 ca0=0.500 without correlation with correlation ----------------------- ----------------------- nl wnl eps fg eps fgr corr eps fg eps fgr n*r n*rc ect ec----------------- 1s 2. -1886.29154 -1886.29154-0.08290 -1886.37444 -1886.37444 0.0230 0.0230 -0.08267 0.00000-0.08267 2s 2. -285.08208 -285.08208-0.08232 -285.16441 -285.16441 0.0592 0.0592 -0.23110 -0.06744-0.08099 2p 6. -255.71334 -255.71334-0.08242 -255.79576 -255.79576 0.0625 0.0625 -0.72296 -0.08169-0.08186-0.08197-0.08206-0.08218 3s 2. -55.88789 -55.88789-0.08107 -55.96896 -55.96896 0.1338 0.1337 -0.86760 -0.06668-0.07795 3p 6. -45.93167 -45.93167-0.08107 -46.01273 -46.01273 0.1476 0.1474 -1.34526 -0.07880-0.07928-0.07960-0.07983-0.08015 3d 10. -30.13539 -30.13539-0.08120 -30.21658 -30.21658 0.1822 0.1819 -2.15235 -0.08039-0.08049-0.08057-0.08064-0.08095 4s 2. -9.60975 -9.60975-0.07794 -9.68769 -9.68769 0.3226 0.3213 -2.28909 -0.06414-0.07260 4p 6. -6.51018 -6.51018-0.07740 -6.58758 -6.58758 0.3919 0.3896 -2.73538 -0.07242-0.07363-0.07437-0.07491-0.07565 4d 9. -1.98774 -1.98774-0.07469 -2.06243 -2.06243 0.7093 0.6963 -3.39164 -0.07030-0.07165-0.07235-0.07285-0.07431 5s 1. -1.11290 -1.11290-0.05731 -1.17021 -1.17021 0.9479 0.9244 -3.44894 -0.05730 7g 1. -0.02041 -0.02041-0.00003 -0.02044 -0.02044 7.0002 6.9948 -3.44897 -0.00003 ecorrt= -3.63530 (old) ect= -3.44897 (new) etotrl= 0.00000 + 0.00000 + 0.00000 etot= -10621.25615 -10621.25615 -10624.89145 -10624.89145 -10624.70512 -10624.70512 -10624.70512 ag i d9 5s7g 10 -10624.7051 0 1.8202 2 0.0000 2 0.0154 3 0.0004 3 14.1995 4 0.0000 4 0.0000 4 0.0000 4 0.0002 4 t(run)= 18.42, t(job)= 520.09 seconds 47 1ag i d9 5s8g 4d9 5s 8g ag i d9 5s8g nconf= 31 z= 47 ncores=10 nvales= 1 ion= 0 r(i)/x(i)=0.24532669 ca1=0.700 tolstb=1.000 tolk-2=1.00000 tolend= 0.5E-07 thresh= 0.1E-10 kut= 0 exf=1.000 corrf=0.000 ca0= 0.500 rcn mod 32 ihf1= 0 mesh=2601 idb= 481 rdb= 100.461 emx= 0.10 r(mesh)=5426.209 irel= 1 ib=2600 t(run)= 12.62, t(job)= 532.71 seconds nl wnl ee az (r-3) (r-2) (r-1) (r+1) (r+2) (r+3) (r+4) (r+6) 1s 2. -1885.45428 881.504 0.000E+00 5.213E+03 4.936E+01 3.112E-02 1.308E-03 6.934E-05 4.438E-06 2.867E-08 2s 2. -280.74186 295.093 0.000E+00 5.731E+02 1.123E+01 1.350E-01 2.146E-02 3.880E-03 7.892E-04 4.505E-05 2p 6. -254.60819 3360.615 3.659E+03 1.600E+02 1.083E+01 1.175E-01 1.684E-02 2.853E-03 5.593E-04 3.126E-05 3s 2. -52.95232 127.558 0.000E+00 1.088E+02 3.931E+00 3.700E-01 1.565E-01 7.317E-02 3.748E-02 1.276E-02 3p 6. -43.84260 1500.501 6.406E+02 3.005E+01 3.735E+00 3.687E-01 1.577E-01 7.538E-02 3.986E-02 1.483E-02 3d 10. -29.59744 3212.018 9.187E+01 1.571E+01 3.533E+00 3.449E-01 1.415E-01 6.771E-02 3.719E-02 1.613E-02 4s 2. -8.59104 56.166 0.000E+00 2.160E+01 1.520E+00 9.114E-01 9.418E-01 1.071E+00 1.333E+00 2.683E+00 4p 6. -5.84054 623.307 1.083E+02 5.563E+00 1.363E+00 9.982E-01 1.142E+00 1.455E+00 2.052E+00 5.497E+00 4d 9. -1.84518 1073.600 8.994E+00 1.934E+00 1.004E+00 1.343E+00 2.170E+00 4.123E+00 9.126E+00 6.781E+01 5s 1. -1.17176 17.119 0.000E+00 2.118E+00 4.675E-01 2.734E+00 8.472E+00 2.923E+01 1.116E+02 2.168E+03 8g 1. -0.01563 0.000 2.174E-05 4.343E-04 1.563E-02 8.599E+01 8.351E+03 8.610E+05 9.224E+07 1.153E+12 47. 1.318E+04 2.725E+02 1.161E+02 8.391E+03 8.611E+05 9.224E+07 1.153E+12 1. 2.805E+02 5.798E+00 2.469E+00 1.785E+02 1.832E+04 1.962E+06 2.453E+10 --------------------zeta--------------------- nl wnl ----blume-watson---- -----(r*vi)----- i (ryd) eps s evel edar evel+edar erel (ryd) (cm-1) (ryd) (cm-1) 1s 2. 0.00000 0.000 0.00000 0.000-2274.99709 -1877.19059 -398.57963 331.78281 -66.797 -1943.98741 2s 2. 0.00000 0.000 0.00000 0.000 -567.83896 -282.02650 -54.20917 36.23356 -17.976 -300.00212 2p 6. 8.55126 938392.336 8.80382 966107.342 -555.31980 -254.75535 -7.22309 -0.01377 -7.223 -261.97844 3s 2. 0.00000 0.000 0.00000 0.000 -234.94724 -54.55783 -10.56476 6.74711 -3.818 -58.37548 3p 6. 1.49487 164042.946 1.53306 168233.437 -227.35202 -45.40570 -1.64604 -0.00221 -1.646 -47.05174 3d 10. 0.17194 18868.611 0.18433 20228.020 -218.95974 -30.82320 -0.37684 -0.01081 -0.377 -31.20004 4s 2. 0.00000 0.000 0.00000 0.000 -108.40485 -9.34872 -2.07114 1.30745 -0.764 -10.11242 4p 6. 0.25235 27692.514 0.25851 28367.729 -99.73441 -6.55561 -0.29425 -0.00026 -0.294 -6.84987 4d 9. 0.01659 1820.207 0.01763 1934.371 -77.91714 -2.38058 -0.04242 -0.00102 -0.042 -2.42301 5s 1. 0.00000 0.000 0.00000 0.000 -39.89826 -1.23930 -0.19280 0.12146 -0.071 -1.31064 8g 1. 0.00000 0.004 0.00000 0.000 -1.45336 -0.01105 0.00000 0.00000 0.000 -0.01105 ag i d9 5s8g nconf= 31 z= 47 ion= 0 kut=-1 exf=0.650 corrf=0.000 ca1=0.700 ca0=0.500 without correlation with correlation ----------------------- ----------------------- nl wnl eps fg eps fgr corr eps fg eps fgr n*r n*rc ect ec----------------- 1s 2. -1886.30110 -1886.30110-0.08290 -1886.38400 -1886.38400 0.0230 0.0230 -0.08267 0.00000-0.08267 2s 2. -285.09165 -285.09165-0.08232 -285.17397 -285.17397 0.0592 0.0592 -0.23110 -0.06744-0.08099 2p 6. -255.72290 -255.72290-0.08242 -255.80532 -255.80532 0.0625 0.0625 -0.72296 -0.08169-0.08186-0.08197-0.08206-0.08218 3s 2. -55.89746 -55.89746-0.08107 -55.97852 -55.97852 0.1338 0.1337 -0.86760 -0.06668-0.07795 3p 6. -45.94123 -45.94123-0.08107 -46.02230 -46.02230 0.1475 0.1474 -1.34526 -0.07880-0.07928-0.07960-0.07983-0.08015 3d 10. -30.14495 -30.14495-0.08120 -30.22615 -30.22615 0.1821 0.1819 -2.15235 -0.08039-0.08049-0.08057-0.08064-0.08095 4s 2. -9.61931 -9.61931-0.07794 -9.69725 -9.69725 0.3224 0.3211 -2.28909 -0.06414-0.07260 4p 6. -6.51975 -6.51975-0.07740 -6.59715 -6.59715 0.3916 0.3893 -2.73538 -0.07242-0.07363-0.07437-0.07491-0.07565 4d 9. -1.99731 -1.99731-0.07469 -2.07200 -2.07200 0.7076 0.6947 -3.39164 -0.07030-0.07165-0.07235-0.07285-0.07431 5s 1. -1.12247 -1.12247-0.05731 -1.17978 -1.17978 0.9439 0.9207 -3.44894 -0.05730 8g 1. -0.01563 -0.01563-0.00002 -0.01565 -0.01565 7.9999 7.9938 -3.44896 -0.00002 ecorrt= -3.63529 (old) ect= -3.44896 (new) etotrl= 0.00000 + 0.00000 + 0.00000 etot= -10621.25136 -10621.25136 -10624.88666 -10624.88666 -10624.70032 -10624.70032 -10624.70032 ag i d9 5s8g 10 -10624.7003 0 1.8202 2 0.0000 2 0.0104 3 0.0003 3 14.1995 4 0.0000 4 0.0000 4 0.0000 4 0.0001 4 t(run)= 18.11, t(job)= 538.20 seconds 47 1ag i d9 5s9g 4d9 5s 9g ag i d9 5s9g nconf= 32 z= 47 ncores=10 nvales= 1 ion= 0 r(i)/x(i)=0.24532669 ca1=0.700 tolstb=1.000 tolk-2=1.00000 tolend= 0.5E-07 thresh= 0.1E-10 kut= 0 exf=1.000 corrf=0.000 ca0= 0.500 rcn mod 32 ihf1= 0 mesh=2601 idb= 481 rdb= 100.461 emx= 0.10 r(mesh)=5426.209 irel= 1 ib=2600 t(run)= 10.93, t(job)= 549.13 seconds nl wnl ee az (r-3) (r-2) (r-1) (r+1) (r+2) (r+3) (r+4) (r+6) 1s 2. -1885.46083 881.504 0.000E+00 5.213E+03 4.936E+01 3.112E-02 1.308E-03 6.934E-05 4.438E-06 2.867E-08 2s 2. -280.74842 295.093 0.000E+00 5.731E+02 1.123E+01 1.350E-01 2.146E-02 3.880E-03 7.892E-04 4.505E-05 2p 6. -254.61475 3360.615 3.659E+03 1.600E+02 1.083E+01 1.175E-01 1.684E-02 2.853E-03 5.593E-04 3.126E-05 3s 2. -52.95887 127.558 0.000E+00 1.088E+02 3.931E+00 3.700E-01 1.565E-01 7.317E-02 3.748E-02 1.276E-02 3p 6. -43.84916 1500.501 6.406E+02 3.005E+01 3.735E+00 3.687E-01 1.577E-01 7.538E-02 3.986E-02 1.483E-02 3d 10. -29.60400 3212.018 9.187E+01 1.571E+01 3.533E+00 3.449E-01 1.415E-01 6.771E-02 3.719E-02 1.613E-02 4s 2. -8.59760 56.166 0.000E+00 2.160E+01 1.520E+00 9.114E-01 9.418E-01 1.071E+00 1.333E+00 2.683E+00 4p 6. -5.84710 623.307 1.083E+02 5.563E+00 1.363E+00 9.982E-01 1.142E+00 1.455E+00 2.052E+00 5.497E+00 4d 9. -1.85174 1073.600 8.994E+00 1.934E+00 1.004E+00 1.343E+00 2.170E+00 4.123E+00 9.126E+00 6.781E+01 5s 1. -1.17832 17.119 0.000E+00 2.118E+00 4.675E-01 2.734E+00 8.472E+00 2.923E+01 1.116E+02 2.168E+03 9g 1. -0.01235 0.000 1.528E-05 3.051E-04 1.235E-02 1.115E+02 1.401E+04 1.864E+06 2.570E+08 5.275E+12 47. 1.318E+04 2.725E+02 1.416E+02 1.405E+04 1.864E+06 2.570E+08 5.275E+12 1. 2.805E+02 5.798E+00 3.012E+00 2.990E+02 3.966E+04 5.469E+06 1.122E+11 --------------------zeta--------------------- nl wnl ----blume-watson---- -----(r*vi)----- i (ryd) eps s evel edar evel+edar erel (ryd) (cm-1) (ryd) (cm-1) 1s 2. 0.00000 0.000 0.00000 0.000-2274.99709 -1877.19714 -398.57963 331.78280 -66.797 -1943.99398 2s 2. 0.00000 0.000 0.00000 0.000 -567.83896 -282.03306 -54.20917 36.23356 -17.976 -300.00867 2p 6. 8.55126 938392.336 8.80382 966107.342 -555.31980 -254.76191 -7.22309 -0.01377 -7.223 -261.98500 3s 2. 0.00000 0.000 0.00000 0.000 -234.94724 -54.56439 -10.56476 6.74711 -3.818 -58.38204 3p 6. 1.49487 164042.946 1.53306 168233.437 -227.35202 -45.41226 -1.64604 -0.00221 -1.646 -47.05829 3d 10. 0.17194 18868.611 0.18433 20228.020 -218.95974 -30.82976 -0.37684 -0.01081 -0.377 -31.20660 4s 2. 0.00000 0.000 0.00000 0.000 -108.40485 -9.35528 -2.07114 1.30745 -0.764 -10.11898 4p 6. 0.25235 27692.514 0.25851 28367.729 -99.73441 -6.56217 -0.29425 -0.00026 -0.294 -6.85643 4d 9. 0.01659 1820.207 0.01763 1934.371 -77.91714 -2.38714 -0.04242 -0.00102 -0.042 -2.42956 5s 1. 0.00000 0.000 0.00000 0.000 -39.89826 -1.24586 -0.19280 0.12146 -0.071 -1.31720 9g 1. 0.00000 0.003 0.00000 0.000 -1.14836 -0.00897 0.00000 0.00000 0.000 -0.00897 ag i d9 5s9g nconf= 32 z= 47 ion= 0 kut=-1 exf=0.650 corrf=0.000 ca1=0.700 ca0=0.500 without correlation with correlation ----------------------- ----------------------- nl wnl eps fg eps fgr corr eps fg eps fgr n*r n*rc ect ec----------------- 1s 2. -1886.30766 -1886.30766-0.08290 -1886.39056 -1886.39056 0.0230 0.0230 -0.08267 0.00000-0.08267 2s 2. -285.09821 -285.09821-0.08232 -285.18053 -285.18053 0.0592 0.0592 -0.23110 -0.06744-0.08099 2p 6. -255.72946 -255.72946-0.08242 -255.81188 -255.81188 0.0625 0.0625 -0.72296 -0.08169-0.08186-0.08197-0.08206-0.08218 3s 2. -55.90402 -55.90402-0.08107 -55.98508 -55.98508 0.1337 0.1336 -0.86760 -0.06668-0.07795 3p 6. -45.94779 -45.94779-0.08107 -46.02886 -46.02886 0.1475 0.1474 -1.34526 -0.07880-0.07928-0.07960-0.07983-0.08015 3d 10. -30.15151 -30.15151-0.08120 -30.23271 -30.23271 0.1821 0.1819 -2.15235 -0.08039-0.08049-0.08057-0.08064-0.08095 4s 2. -9.62587 -9.62587-0.07794 -9.70381 -9.70381 0.3223 0.3210 -2.28909 -0.06414-0.07260 4p 6. -6.52631 -6.52631-0.07740 -6.60371 -6.60371 0.3914 0.3891 -2.73538 -0.07242-0.07363-0.07437-0.07491-0.07565 4d 9. -2.00387 -2.00387-0.07469 -2.07856 -2.07856 0.7064 0.6936 -3.39164 -0.07030-0.07165-0.07235-0.07285-0.07431 5s 1. -1.12903 -1.12903-0.05731 -1.18634 -1.18634 0.9411 0.9181 -3.44894 -0.05730 9g 1. -0.01234 -0.01234-0.00002 -0.01236 -0.01236 9.0011 8.9946 -3.44895 -0.00002 ecorrt= -3.63529 (old) ect= -3.44895 (new) etotrl= 0.00000 + 0.00000 + 0.00000 etot= -10621.24808 -10621.24808 -10624.88336 -10624.88336 -10624.69703 -10624.69703 -10624.69703 ag i d9 5s9g 10 -10624.6970 0 1.8202 2 0.0000 2 0.0073 3 0.0002 3 14.1995 4 0.0000 4 0.0000 4 0.0000 4 0.0001 4 t(run)= 16.40, t(job)= 554.60 seconds 47 1ag i d10 7i 4d10 7i ag i d10 7i nconf= 33 z= 47 ncores= 9 nvales= 1 ion= 0 r(i)/x(i)=0.24532669 ca1=0.700 tolstb=1.000 tolk-2=1.00000 tolend= 0.5E-07 thresh= 0.1E-10 kut= 0 exf=1.000 corrf=0.000 ca0= 0.500 rcn mod 32 ihf1= 0 mesh=2601 idb= 481 rdb= 100.461 emx= 0.10 r(mesh)=5426.209 irel= 1 ib=2600 t(run)= 11.62, t(job)= 566.22 seconds nl wnl ee az (r-3) (r-2) (r-1) (r+1) (r+2) (r+3) (r+4) (r+6) 1s 2. -1885.10583 881.507 0.000E+00 5.213E+03 4.936E+01 3.112E-02 1.308E-03 6.934E-05 4.438E-06 2.867E-08 2s 2. -280.37673 295.095 0.000E+00 5.731E+02 1.123E+01 1.350E-01 2.146E-02 3.880E-03 7.892E-04 4.505E-05 2p 6. -254.24438 3360.692 3.659E+03 1.600E+02 1.083E+01 1.175E-01 1.683E-02 2.853E-03 5.593E-04 3.126E-05 3s 2. -52.59297 127.553 0.000E+00 1.088E+02 3.931E+00 3.700E-01 1.565E-01 7.318E-02 3.748E-02 1.276E-02 3p 6. -43.48318 1500.439 6.406E+02 3.004E+01 3.735E+00 3.687E-01 1.577E-01 7.538E-02 3.987E-02 1.484E-02 3d 10. -29.23601 3211.671 9.185E+01 1.570E+01 3.533E+00 3.450E-01 1.415E-01 6.773E-02 3.720E-02 1.614E-02 4s 2. -8.25037 56.016 0.000E+00 2.149E+01 1.516E+00 9.139E-01 9.475E-01 1.082E+00 1.354E+00 2.767E+00 4p 6. -5.50925 619.965 1.071E+02 5.509E+00 1.356E+00 1.004E+00 1.156E+00 1.486E+00 2.119E+00 5.841E+00 4d 10. -1.54797 1036.575 8.404E+00 1.825E+00 9.716E-01 1.397E+00 2.375E+00 4.802E+00 1.143E+01 1.006E+02 7i 1. -0.02041 0.000 1.068E-05 4.485E-04 2.041E-02 5.250E+01 2.940E+03 1.749E+05 1.102E+07 5.130E+10 47. 1.318E+04 2.727E+02 8.176E+01 2.975E+03 1.750E+05 1.102E+07 5.130E+10 1. 2.804E+02 5.802E+00 1.740E+00 6.331E+01 3.723E+03 2.345E+05 1.092E+09 --------------------zeta--------------------- nl wnl ----blume-watson---- -----(r*vi)----- i (ryd) eps s evel edar evel+edar erel (ryd) (cm-1) (ryd) (cm-1) 1s 2. 0.00000 0.000 0.00000 0.000-2274.99730 -1876.84227 -398.58176 331.78494 -66.797 -1943.63908 2s 2. 0.00000 0.000 0.00000 0.000 -567.83950 -281.66176 -54.21010 36.23414 -17.976 -299.63772 2p 6. 8.55158 938426.774 8.80416 966144.843 -555.32084 -254.39168 -7.22339 -0.01376 -7.223 -261.61507 3s 2. 0.00000 0.000 0.00000 0.000 -234.94456 -54.19810 -10.56400 6.74662 -3.817 -58.01547 3p 6. 1.49473 164028.098 1.53292 168218.910 -227.34854 -45.04592 -1.64589 -0.00221 -1.646 -46.69180 3d 10. 0.17191 18864.973 0.18429 20224.034 -218.95188 -30.46187 -0.37676 -0.01081 -0.377 -30.83863 4s 2. 0.00000 0.000 0.00000 0.000 -108.22126 -9.01250 -2.06002 1.30044 -0.760 -9.77209 4p 6. 0.24966 27397.078 0.25575 28064.979 -99.37775 -6.22820 -0.29109 -0.00026 -0.291 -6.51929 4d 10. 0.01547 1698.153 0.01645 1804.895 -75.87238 -2.07234 -0.03955 -0.00095 -0.040 -2.11189 7i 1. 0.00000 0.003 0.00000 0.000 -1.89796 -0.01112 0.00000 0.00000 0.000 -0.01112 ag i d10 7i nconf= 33 z= 47 ion= 0 kut=-1 exf=0.650 corrf=0.000 ca1=0.700 ca0=0.500 without correlation with correlation ----------------------- ----------------------- nl wnl eps fg eps fgr corr eps fg eps fgr n*r n*rc ect ec----------------- 1s 2. -1885.95147 -1885.95147-0.08290 -1886.03437 -1886.03437 0.0230 0.0230 -0.08267 0.00000-0.08267 2s 2. -284.72501 -284.72501-0.08232 -284.80733 -284.80733 0.0593 0.0593 -0.23110 -0.06744-0.08099 2p 6. -255.35986 -255.35986-0.08242 -255.44227 -255.44227 0.0626 0.0626 -0.72296 -0.08169-0.08186-0.08197-0.08206-0.08218 3s 2. -55.53186 -55.53186-0.08107 -55.61292 -55.61292 0.1342 0.1341 -0.86759 -0.06668-0.07795 3p 6. -45.57961 -45.57961-0.08107 -45.66067 -45.66067 0.1481 0.1480 -1.34526 -0.07880-0.07928-0.07960-0.07983-0.08015 3d 10. -29.78687 -29.78687-0.08120 -29.86806 -29.86806 0.1832 0.1830 -2.15235 -0.08039-0.08049-0.08057-0.08064-0.08095 4s 2. -9.28281 -9.28281-0.07796 -9.36076 -9.36076 0.3282 0.3268 -2.28891 -0.06401-0.07255 4p 6. -6.21902 -6.21902-0.07741 -6.29643 -6.29643 0.4010 0.3985 -2.73478 -0.07233-0.07355-0.07430-0.07484-0.07559 4d 10. -1.69446 -1.69446-0.07408 -1.76853 -1.76853 0.7682 0.7520 -3.45992 -0.06933-0.07096-0.07175-0.07230-0.07408 7i 1. -0.02041 -0.02041 0.00000 -0.02041 -0.02041 7.0000 7.0000 -3.45992 0.00000 ecorrt= -3.64659 (old) ect= -3.45992 (new) etotrl= 0.00000 + 0.00000 + 0.00000 etot= -10621.59768 -10621.59768 -10625.24427 -10625.24427 -10625.05760 -10625.05760 -10625.05760 ag i d10 7i 2 -10625.0576 0 0.0000 2 t(run)= 16.60, t(job)= 571.20 seconds 47 1ag i d10 8i 4d10 8i ag i d10 8i nconf= 34 z= 47 ncores= 9 nvales= 1 ion= 0 r(i)/x(i)=0.24532669 ca1=0.700 tolstb=1.000 tolk-2=1.00000 tolend= 0.5E-07 thresh= 0.1E-10 kut= 0 exf=1.000 corrf=0.000 ca0= 0.500 rcn mod 32 ihf1= 0 mesh=2601 idb= 481 rdb= 100.461 emx= 0.10 r(mesh)=5426.209 irel= 1 ib=2600 t(run)= 11.86, t(job)= 583.06 seconds nl wnl ee az (r-3) (r-2) (r-1) (r+1) (r+2) (r+3) (r+4) (r+6) 1s 2. -1885.11540 881.507 0.000E+00 5.213E+03 4.936E+01 3.112E-02 1.308E-03 6.934E-05 4.438E-06 2.867E-08 2s 2. -280.38629 295.095 0.000E+00 5.731E+02 1.123E+01 1.350E-01 2.146E-02 3.880E-03 7.892E-04 4.505E-05 2p 6. -254.25395 3360.692 3.659E+03 1.600E+02 1.083E+01 1.175E-01 1.683E-02 2.853E-03 5.593E-04 3.126E-05 3s 2. -52.60253 127.553 0.000E+00 1.088E+02 3.931E+00 3.700E-01 1.565E-01 7.318E-02 3.748E-02 1.276E-02 3p 6. -43.49275 1500.439 6.406E+02 3.004E+01 3.735E+00 3.687E-01 1.577E-01 7.538E-02 3.987E-02 1.484E-02 3d 10. -29.24558 3211.671 9.185E+01 1.570E+01 3.533E+00 3.450E-01 1.415E-01 6.773E-02 3.720E-02 1.614E-02 4s 2. -8.25994 56.016 0.000E+00 2.149E+01 1.516E+00 9.139E-01 9.475E-01 1.082E+00 1.354E+00 2.767E+00 4p 6. -5.51882 619.965 1.071E+02 5.509E+00 1.356E+00 1.004E+00 1.156E+00 1.486E+00 2.119E+00 5.841E+00 4d 10. -1.55754 1036.575 8.404E+00 1.825E+00 9.716E-01 1.397E+00 2.375E+00 4.802E+00 1.143E+01 1.006E+02 8i 1. -0.01562 0.000 7.154E-06 3.005E-04 1.562E-02 7.500E+01 6.240E+03 5.549E+05 5.170E+07 5.001E+11 47. 1.318E+04 2.727E+02 1.043E+02 6.275E+03 5.549E+05 5.170E+07 5.001E+11 1. 2.804E+02 5.802E+00 2.218E+00 1.335E+02 1.181E+04 1.100E+06 1.064E+10 --------------------zeta--------------------- nl wnl ----blume-watson---- -----(r*vi)----- i (ryd) eps s evel edar evel+edar erel (ryd) (cm-1) (ryd) (cm-1) 1s 2. 0.00000 0.000 0.00000 0.000-2274.99730 -1876.85183 -398.58175 331.78492 -66.797 -1943.64866 2s 2. 0.00000 0.000 0.00000 0.000 -567.83950 -281.67133 -54.21010 36.23414 -17.976 -299.64729 2p 6. 8.55158 938426.774 8.80416 966144.843 -555.32084 -254.40124 -7.22339 -0.01376 -7.223 -261.62464 3s 2. 0.00000 0.000 0.00000 0.000 -234.94456 -54.20766 -10.56400 6.74662 -3.817 -58.02504 3p 6. 1.49473 164028.098 1.53292 168218.910 -227.34854 -45.05548 -1.64589 -0.00221 -1.646 -46.70137 3d 10. 0.17191 18864.973 0.18429 20224.034 -218.95188 -30.47143 -0.37676 -0.01081 -0.377 -30.84819 4s 2. 0.00000 0.000 0.00000 0.000 -108.22126 -9.02207 -2.06002 1.30044 -0.760 -9.78165 4p 6. 0.24966 27397.079 0.25575 28064.980 -99.37775 -6.23776 -0.29109 -0.00026 -0.291 -6.52885 4d 10. 0.01547 1698.153 0.01645 1804.895 -75.87238 -2.08190 -0.03955 -0.00095 -0.040 -2.12145 8i 1. 0.00000 0.002 0.00000 0.000 -1.45312 -0.00971 0.00000 0.00000 0.000 -0.00971 ag i d10 8i nconf= 34 z= 47 ion= 0 kut=-1 exf=0.650 corrf=0.000 ca1=0.700 ca0=0.500 without correlation with correlation ----------------------- ----------------------- nl wnl eps fg eps fgr corr eps fg eps fgr n*r n*rc ect ec----------------- 1s 2. -1885.96103 -1885.96103-0.08290 -1886.04393 -1886.04393 0.0230 0.0230 -0.08267 0.00000-0.08267 2s 2. -284.73457 -284.73457-0.08232 -284.81689 -284.81689 0.0593 0.0593 -0.23110 -0.06744-0.08099 2p 6. -255.36942 -255.36942-0.08242 -255.45184 -255.45184 0.0626 0.0626 -0.72296 -0.08169-0.08186-0.08197-0.08206-0.08218 3s 2. -55.54142 -55.54142-0.08107 -55.62249 -55.62249 0.1342 0.1341 -0.86759 -0.06668-0.07795 3p 6. -45.58918 -45.58918-0.08107 -45.67024 -45.67024 0.1481 0.1480 -1.34526 -0.07880-0.07928-0.07960-0.07983-0.08015 3d 10. -29.79643 -29.79643-0.08120 -29.87763 -29.87763 0.1832 0.1829 -2.15235 -0.08039-0.08049-0.08057-0.08064-0.08095 4s 2. -9.29237 -9.29237-0.07796 -9.37033 -9.37033 0.3280 0.3267 -2.28891 -0.06401-0.07255 4p 6. -6.22858 -6.22858-0.07741 -6.30599 -6.30599 0.4007 0.3982 -2.73478 -0.07233-0.07355-0.07430-0.07484-0.07559 4d 10. -1.70402 -1.70402-0.07408 -1.77810 -1.77810 0.7661 0.7499 -3.45992 -0.06933-0.07096-0.07175-0.07230-0.07408 8i 1. -0.01563 -0.01563 0.00000 -0.01563 -0.01563 7.9998 7.9998 -3.45992 0.00000 ecorrt= -3.64659 (old) ect= -3.45992 (new) etotrl= 0.00000 + 0.00000 + 0.00000 etot= -10621.59289 -10621.59289 -10625.23948 -10625.23948 -10625.05281 -10625.05281 -10625.05281 ag i d10 8i 2 -10625.0528 0 0.0000 2 t(run)= 16.96, t(job)= 588.16 seconds 47 1ag i d10 9i 4d10 9i ag i d10 9i nconf= 35 z= 47 ncores= 9 nvales= 1 ion= 0 r(i)/x(i)=0.24532669 ca1=0.700 tolstb=1.000 tolk-2=1.00000 tolend= 0.5E-07 thresh= 0.1E-10 kut= 0 exf=1.000 corrf=0.000 ca0= 0.500 rcn mod 32 ihf1= 0 mesh=2601 idb= 481 rdb= 100.461 emx= 0.10 r(mesh)=5426.209 irel= 1 ib=2600 t(run)= 12.34, t(job)= 600.50 seconds nl wnl ee az (r-3) (r-2) (r-1) (r+1) (r+2) (r+3) (r+4) (r+6) 1s 2. -1885.12196 881.507 0.000E+00 5.213E+03 4.936E+01 3.112E-02 1.308E-03 6.934E-05 4.438E-06 2.867E-08 2s 2. -280.39285 295.095 0.000E+00 5.731E+02 1.123E+01 1.350E-01 2.146E-02 3.880E-03 7.892E-04 4.505E-05 2p 6. -254.26051 3360.692 3.659E+03 1.600E+02 1.083E+01 1.175E-01 1.683E-02 2.853E-03 5.593E-04 3.126E-05 3s 2. -52.60909 127.553 0.000E+00 1.088E+02 3.931E+00 3.700E-01 1.565E-01 7.318E-02 3.748E-02 1.276E-02 3p 6. -43.49931 1500.439 6.406E+02 3.004E+01 3.735E+00 3.687E-01 1.577E-01 7.538E-02 3.987E-02 1.484E-02 3d 10. -29.25214 3211.670 9.185E+01 1.570E+01 3.533E+00 3.450E-01 1.415E-01 6.773E-02 3.720E-02 1.614E-02 4s 2. -8.26650 56.016 0.000E+00 2.149E+01 1.516E+00 9.139E-01 9.475E-01 1.082E+00 1.354E+00 2.767E+00 4p 6. -5.52537 619.965 1.071E+02 5.509E+00 1.356E+00 1.004E+00 1.156E+00 1.486E+00 2.119E+00 5.841E+00 4d 10. -1.56410 1036.575 8.404E+00 1.825E+00 9.716E-01 1.397E+00 2.375E+00 4.802E+00 1.143E+01 1.006E+02 9i 1. -0.01235 0.000 5.025E-06 2.110E-04 1.235E-02 1.005E+02 1.134E+04 1.363E+06 1.707E+08 2.920E+12 47. 1.318E+04 2.727E+02 1.298E+02 1.138E+04 1.363E+06 1.707E+08 2.920E+12 1. 2.804E+02 5.802E+00 2.761E+00 2.420E+02 2.901E+04 3.631E+06 6.212E+10 --------------------zeta--------------------- nl wnl ----blume-watson---- -----(r*vi)----- i (ryd) eps s evel edar evel+edar erel (ryd) (cm-1) (ryd) (cm-1) 1s 2. 0.00000 0.000 0.00000 0.000-2274.99729 -1876.85839 -398.58175 331.78491 -66.797 -1943.65522 2s 2. 0.00000 0.000 0.00000 0.000 -567.83950 -281.67788 -54.21010 36.23414 -17.976 -299.65385 2p 6. 8.55158 938426.774 8.80416 966144.844 -555.32084 -254.40780 -7.22339 -0.01376 -7.223 -261.63119 3s 2. 0.00000 0.000 0.00000 0.000 -234.94456 -54.21422 -10.56400 6.74662 -3.817 -58.03159 3p 6. 1.49473 164028.098 1.53292 168218.910 -227.34854 -45.06204 -1.64589 -0.00221 -1.646 -46.70793 3d 10. 0.17191 18864.973 0.18429 20224.034 -218.95188 -30.47799 -0.37676 -0.01081 -0.377 -30.85475 4s 2. 0.00000 0.000 0.00000 0.000 -108.22126 -9.02863 -2.06002 1.30044 -0.760 -9.78821 4p 6. 0.24966 27397.079 0.25575 28064.980 -99.37775 -6.24432 -0.29109 -0.00026 -0.291 -6.53541 4d 10. 0.01547 1698.153 0.01645 1804.895 -75.87238 -2.08846 -0.03955 -0.00095 -0.040 -2.12801 9i 1. 0.00000 0.001 0.00000 0.000 -1.14815 -0.00823 0.00000 0.00000 0.000 -0.00823 ag i d10 9i nconf= 35 z= 47 ion= 0 kut=-1 exf=0.650 corrf=0.000 ca1=0.700 ca0=0.500 without correlation with correlation ----------------------- ----------------------- nl wnl eps fg eps fgr corr eps fg eps fgr n*r n*rc ect ec----------------- 1s 2. -1885.96759 -1885.96759-0.08290 -1886.05049 -1886.05049 0.0230 0.0230 -0.08267 0.00000-0.08267 2s 2. -284.74113 -284.74113-0.08232 -284.82345 -284.82345 0.0593 0.0593 -0.23110 -0.06744-0.08099 2p 6. -255.37598 -255.37598-0.08242 -255.45840 -255.45840 0.0626 0.0626 -0.72296 -0.08169-0.08186-0.08197-0.08206-0.08218 3s 2. -55.54798 -55.54798-0.08107 -55.62905 -55.62905 0.1342 0.1341 -0.86759 -0.06668-0.07795 3p 6. -45.59573 -45.59573-0.08107 -45.67680 -45.67680 0.1481 0.1480 -1.34526 -0.07880-0.07928-0.07960-0.07983-0.08015 3d 10. -29.80299 -29.80299-0.08120 -29.88419 -29.88419 0.1832 0.1829 -2.15235 -0.08039-0.08049-0.08057-0.08064-0.08095 4s 2. -9.29893 -9.29893-0.07796 -9.37689 -9.37689 0.3279 0.3266 -2.28891 -0.06401-0.07255 4p 6. -6.23514 -6.23514-0.07741 -6.31255 -6.31255 0.4005 0.3980 -2.73478 -0.07233-0.07355-0.07430-0.07484-0.07559 4d 10. -1.71058 -1.71058-0.07408 -1.78466 -1.78466 0.7646 0.7486 -3.45992 -0.06933-0.07096-0.07175-0.07230-0.07408 9i 1. -0.01234 -0.01234 0.00000 -0.01234 -0.01234 9.0007 9.0007 -3.45992 0.00000 ecorrt= -3.64659 (old) ect= -3.45992 (new) etotrl= 0.00000 + 0.00000 + 0.00000 etot= -10621.58960 -10621.58960 -10625.23619 -10625.23619 -10625.04952 -10625.04952 -10625.04952 ag i d10 9i 2 -10625.0495 0 0.0000 2 t(run)= 17.19, t(job)= 605.35 seconds 47 1ag i d9 5s7i 4d9 5s 7i ag i d9 5s7i nconf= 36 z= 47 ncores=10 nvales= 1 ion= 0 r(i)/x(i)=0.24532669 ca1=0.700 tolstb=1.000 tolk-2=1.00000 tolend= 0.5E-07 thresh= 0.1E-10 kut= 0 exf=1.000 corrf=0.000 ca0= 0.500 rcn mod 32 ihf1= 0 mesh=2601 idb= 481 rdb= 100.461 emx= 0.10 r(mesh)=5426.209 irel= 1 ib=2600 t(run)= 10.23, t(job)= 615.58 seconds nl wnl ee az (r-3) (r-2) (r-1) (r+1) (r+2) (r+3) (r+4) (r+6) 1s 2. -1885.44472 881.504 0.000E+00 5.213E+03 4.936E+01 3.112E-02 1.308E-03 6.934E-05 4.438E-06 2.867E-08 2s 2. -280.73230 295.093 0.000E+00 5.731E+02 1.123E+01 1.350E-01 2.146E-02 3.880E-03 7.892E-04 4.505E-05 2p 6. -254.59863 3360.615 3.659E+03 1.600E+02 1.083E+01 1.175E-01 1.684E-02 2.853E-03 5.593E-04 3.126E-05 3s 2. -52.94275 127.558 0.000E+00 1.088E+02 3.931E+00 3.700E-01 1.565E-01 7.317E-02 3.748E-02 1.276E-02 3p 6. -43.83304 1500.501 6.406E+02 3.005E+01 3.735E+00 3.687E-01 1.577E-01 7.538E-02 3.986E-02 1.483E-02 3d 10. -29.58788 3212.018 9.187E+01 1.571E+01 3.533E+00 3.449E-01 1.415E-01 6.771E-02 3.719E-02 1.613E-02 4s 2. -8.58148 56.166 0.000E+00 2.160E+01 1.520E+00 9.114E-01 9.418E-01 1.071E+00 1.333E+00 2.683E+00 4p 6. -5.83098 623.307 1.083E+02 5.563E+00 1.363E+00 9.982E-01 1.142E+00 1.455E+00 2.052E+00 5.497E+00 4d 9. -1.83562 1073.600 8.994E+00 1.934E+00 1.004E+00 1.343E+00 2.170E+00 4.123E+00 9.126E+00 6.781E+01 5s 1. -1.16220 17.119 0.000E+00 2.118E+00 4.675E-01 2.734E+00 8.472E+00 2.923E+01 1.116E+02 2.168E+03 7i 1. -0.02041 0.000 1.068E-05 4.485E-04 2.041E-02 5.250E+01 2.940E+03 1.749E+05 1.102E+07 5.130E+10 47. 1.318E+04 2.725E+02 8.257E+01 2.980E+03 1.750E+05 1.102E+07 5.130E+10 1. 2.805E+02 5.798E+00 1.757E+00 6.339E+01 3.724E+03 2.345E+05 1.092E+09 --------------------zeta--------------------- nl wnl ----blume-watson---- -----(r*vi)----- i (ryd) eps s evel edar evel+edar erel (ryd) (cm-1) (ryd) (cm-1) 1s 2. 0.00000 0.000 0.00000 0.000-2274.99709 -1877.18103 -398.57964 331.78282 -66.797 -1943.97784 2s 2. 0.00000 0.000 0.00000 0.000 -567.83896 -282.01694 -54.20917 36.23356 -17.976 -299.99255 2p 6. 8.55126 938392.336 8.80382 966107.341 -555.31980 -254.74579 -7.22309 -0.01377 -7.223 -261.96888 3s 2. 0.00000 0.000 0.00000 0.000 -234.94724 -54.54827 -10.56476 6.74711 -3.818 -58.36592 3p 6. 1.49487 164042.946 1.53306 168233.436 -227.35202 -45.39614 -1.64604 -0.00221 -1.646 -47.04217 3d 10. 0.17194 18868.611 0.18433 20228.020 -218.95974 -30.81364 -0.37684 -0.01081 -0.377 -31.19048 4s 2. 0.00000 0.000 0.00000 0.000 -108.40485 -9.33916 -2.07114 1.30745 -0.764 -10.10285 4p 6. 0.25235 27692.514 0.25851 28367.729 -99.73441 -6.54605 -0.29425 -0.00026 -0.294 -6.84031 4d 9. 0.01659 1820.207 0.01763 1934.371 -77.91714 -2.37102 -0.04242 -0.00102 -0.042 -2.41344 5s 1. 0.00000 0.000 0.00000 0.000 -39.89827 -1.22972 -0.19280 0.12146 -0.071 -1.30106 7i 1. 0.00000 0.003 0.00000 0.000 -1.89796 -0.01112 0.00000 0.00000 0.000 -0.01112 ag i d9 5s7i nconf= 36 z= 47 ion= 0 kut=-1 exf=0.650 corrf=0.000 ca1=0.700 ca0=0.500 without correlation with correlation ----------------------- ----------------------- nl wnl eps fg eps fgr corr eps fg eps fgr n*r n*rc ect ec----------------- 1s 2. -1886.29154 -1886.29154-0.08290 -1886.37444 -1886.37444 0.0230 0.0230 -0.08267 0.00000-0.08267 2s 2. -285.08209 -285.08209-0.08232 -285.16441 -285.16441 0.0592 0.0592 -0.23110 -0.06744-0.08099 2p 6. -255.71334 -255.71334-0.08242 -255.79576 -255.79576 0.0625 0.0625 -0.72296 -0.08169-0.08186-0.08197-0.08206-0.08218 3s 2. -55.88790 -55.88790-0.08107 -55.96896 -55.96896 0.1338 0.1337 -0.86760 -0.06668-0.07795 3p 6. -45.93167 -45.93167-0.08107 -46.01274 -46.01274 0.1476 0.1474 -1.34526 -0.07880-0.07928-0.07960-0.07983-0.08015 3d 10. -30.13539 -30.13539-0.08120 -30.21659 -30.21659 0.1822 0.1819 -2.15235 -0.08039-0.08049-0.08057-0.08064-0.08095 4s 2. -9.60975 -9.60975-0.07794 -9.68769 -9.68769 0.3226 0.3213 -2.28909 -0.06414-0.07260 4p 6. -6.51019 -6.51019-0.07740 -6.58759 -6.58759 0.3919 0.3896 -2.73538 -0.07242-0.07363-0.07437-0.07491-0.07565 4d 9. -1.98775 -1.98775-0.07469 -2.06243 -2.06243 0.7093 0.6963 -3.39164 -0.07030-0.07165-0.07235-0.07285-0.07431 5s 1. -1.11291 -1.11291-0.05730 -1.17020 -1.17020 0.9479 0.9244 -3.44894 -0.05730 7i 1. -0.02041 -0.02041 0.00000 -0.02041 -0.02041 7.0000 7.0000 -3.44894 0.00000 ecorrt= -3.63526 (old) ect= -3.44894 (new) etotrl= 0.00000 + 0.00000 + 0.00000 etot= -10621.25615 -10621.25615 -10624.89141 -10624.89141 -10624.70508 -10624.70508 -10624.70508 ag i d9 5s7i 10 -10624.7051 0 1.8202 2 0.0000 2 0.0051 3 0.0000 3 14.1995 4 0.0000 4 0.0000 4 0.0000 4 0.0000 4 t(run)= 15.46, t(job)= 620.81 seconds 47 1ag i d9 5s8i 4d9 5s 8i ag i d9 5s8i nconf= 37 z= 47 ncores=10 nvales= 1 ion= 0 r(i)/x(i)=0.24532669 ca1=0.700 tolstb=1.000 tolk-2=1.00000 tolend= 0.5E-07 thresh= 0.1E-10 kut= 0 exf=1.000 corrf=0.000 ca0= 0.500 rcn mod 32 ihf1= 0 mesh=2601 idb= 481 rdb= 100.461 emx= 0.10 r(mesh)=5426.209 irel= 1 ib=2600 t(run)= 12.93, t(job)= 633.74 seconds nl wnl ee az (r-3) (r-2) (r-1) (r+1) (r+2) (r+3) (r+4) (r+6) 1s 2. -1885.45428 881.504 0.000E+00 5.213E+03 4.936E+01 3.112E-02 1.308E-03 6.934E-05 4.438E-06 2.867E-08 2s 2. -280.74187 295.093 0.000E+00 5.731E+02 1.123E+01 1.350E-01 2.146E-02 3.880E-03 7.892E-04 4.505E-05 2p 6. -254.60819 3360.615 3.659E+03 1.600E+02 1.083E+01 1.175E-01 1.684E-02 2.853E-03 5.593E-04 3.126E-05 3s 2. -52.95232 127.558 0.000E+00 1.088E+02 3.931E+00 3.700E-01 1.565E-01 7.317E-02 3.748E-02 1.276E-02 3p 6. -43.84261 1500.501 6.406E+02 3.005E+01 3.735E+00 3.687E-01 1.577E-01 7.538E-02 3.986E-02 1.483E-02 3d 10. -29.59744 3212.018 9.187E+01 1.571E+01 3.533E+00 3.449E-01 1.415E-01 6.771E-02 3.719E-02 1.613E-02 4s 2. -8.59105 56.166 0.000E+00 2.160E+01 1.520E+00 9.114E-01 9.418E-01 1.071E+00 1.333E+00 2.683E+00 4p 6. -5.84054 623.307 1.083E+02 5.563E+00 1.363E+00 9.982E-01 1.142E+00 1.455E+00 2.052E+00 5.497E+00 4d 9. -1.84518 1073.600 8.994E+00 1.934E+00 1.004E+00 1.343E+00 2.170E+00 4.123E+00 9.126E+00 6.781E+01 5s 1. -1.17177 17.119 0.000E+00 2.118E+00 4.675E-01 2.734E+00 8.472E+00 2.923E+01 1.116E+02 2.168E+03 8i 1. -0.01562 0.000 7.154E-06 3.005E-04 1.562E-02 7.500E+01 6.240E+03 5.549E+05 5.170E+07 5.001E+11 47. 1.318E+04 2.725E+02 1.051E+02 6.280E+03 5.550E+05 5.170E+07 5.001E+11 1. 2.805E+02 5.798E+00 2.236E+00 1.336E+02 1.181E+04 1.100E+06 1.064E+10 --------------------zeta--------------------- nl wnl ----blume-watson---- -----(r*vi)----- i (ryd) eps s evel edar evel+edar erel (ryd) (cm-1) (ryd) (cm-1) 1s 2. 0.00000 0.000 0.00000 0.000-2274.99709 -1877.19059 -398.57963 331.78281 -66.797 -1943.98742 2s 2. 0.00000 0.000 0.00000 0.000 -567.83896 -282.02651 -54.20917 36.23356 -17.976 -300.00212 2p 6. 8.55126 938392.336 8.80382 966107.342 -555.31980 -254.75536 -7.22309 -0.01377 -7.223 -261.97845 3s 2. 0.00000 0.000 0.00000 0.000 -234.94724 -54.55783 -10.56476 6.74711 -3.818 -58.37548 3p 6. 1.49487 164042.946 1.53306 168233.437 -227.35202 -45.40570 -1.64604 -0.00221 -1.646 -47.05174 3d 10. 0.17194 18868.611 0.18433 20228.020 -218.95974 -30.82321 -0.37684 -0.01081 -0.377 -31.20005 4s 2. 0.00000 0.000 0.00000 0.000 -108.40485 -9.34873 -2.07114 1.30745 -0.764 -10.11242 4p 6. 0.25235 27692.514 0.25851 28367.729 -99.73441 -6.55562 -0.29425 -0.00026 -0.294 -6.84987 4d 9. 0.01659 1820.207 0.01763 1934.371 -77.91714 -2.38059 -0.04242 -0.00102 -0.042 -2.42301 5s 1. 0.00000 0.000 0.00000 0.000 -39.89827 -1.23929 -0.19280 0.12146 -0.071 -1.31063 8i 1. 0.00000 0.002 0.00000 0.000 -1.45312 -0.00971 0.00000 0.00000 0.000 -0.00971 ag i d9 5s8i nconf= 37 z= 47 ion= 0 kut=-1 exf=0.650 corrf=0.000 ca1=0.700 ca0=0.500 without correlation with correlation ----------------------- ----------------------- nl wnl eps fg eps fgr corr eps fg eps fgr n*r n*rc ect ec----------------- 1s 2. -1886.30111 -1886.30111-0.08290 -1886.38401 -1886.38401 0.0230 0.0230 -0.08267 0.00000-0.08267 2s 2. -285.09165 -285.09165-0.08232 -285.17398 -285.17398 0.0592 0.0592 -0.23110 -0.06744-0.08099 2p 6. -255.72291 -255.72291-0.08242 -255.80533 -255.80533 0.0625 0.0625 -0.72296 -0.08169-0.08186-0.08197-0.08206-0.08218 3s 2. -55.89746 -55.89746-0.08107 -55.97853 -55.97853 0.1338 0.1337 -0.86760 -0.06668-0.07795 3p 6. -45.94124 -45.94124-0.08107 -46.02230 -46.02230 0.1475 0.1474 -1.34526 -0.07880-0.07928-0.07960-0.07983-0.08015 3d 10. -30.14496 -30.14496-0.08120 -30.22616 -30.22616 0.1821 0.1819 -2.15235 -0.08039-0.08049-0.08057-0.08064-0.08095 4s 2. -9.61932 -9.61932-0.07794 -9.69726 -9.69726 0.3224 0.3211 -2.28909 -0.06414-0.07260 4p 6. -6.51975 -6.51975-0.07740 -6.59716 -6.59716 0.3916 0.3893 -2.73538 -0.07242-0.07363-0.07437-0.07491-0.07565 4d 9. -1.99731 -1.99731-0.07469 -2.07200 -2.07200 0.7076 0.6947 -3.39164 -0.07030-0.07165-0.07235-0.07285-0.07431 5s 1. -1.12247 -1.12247-0.05730 -1.17977 -1.17977 0.9439 0.9207 -3.44894 -0.05730 8i 1. -0.01563 -0.01563 0.00000 -0.01563 -0.01563 7.9998 7.9998 -3.44894 0.00000 ecorrt= -3.63526 (old) ect= -3.44894 (new) etotrl= 0.00000 + 0.00000 + 0.00000 etot= -10621.25136 -10621.25136 -10624.88662 -10624.88662 -10624.70030 -10624.70030 -10624.70030 ag i d9 5s8i 10 -10624.7003 0 1.8202 2 0.0000 2 0.0034 3 0.0000 3 14.1995 4 0.0000 4 0.0000 4 0.0000 4 0.0000 4 t(run)= 18.19, t(job)= 639.00 seconds 47 1ag i d9 5s9i 4d9 5s 9i ag i d9 5s9i nconf= 38 z= 47 ncores=10 nvales= 1 ion= 0 r(i)/x(i)=0.24532669 ca1=0.700 tolstb=1.000 tolk-2=1.00000 tolend= 0.5E-07 thresh= 0.1E-10 kut= 0 exf=1.000 corrf=0.000 ca0= 0.500 rcn mod 32 ihf1= 0 mesh=2601 idb= 481 rdb= 100.461 emx= 0.10 r(mesh)=5426.209 irel= 1 ib=2600 t(run)= 12.63, t(job)= 651.63 seconds nl wnl ee az (r-3) (r-2) (r-1) (r+1) (r+2) (r+3) (r+4) (r+6) 1s 2. -1885.46084 881.504 0.000E+00 5.213E+03 4.936E+01 3.112E-02 1.308E-03 6.934E-05 4.438E-06 2.867E-08 2s 2. -280.74843 295.093 0.000E+00 5.731E+02 1.123E+01 1.350E-01 2.146E-02 3.880E-03 7.892E-04 4.505E-05 2p 6. -254.61475 3360.615 3.659E+03 1.600E+02 1.083E+01 1.175E-01 1.684E-02 2.853E-03 5.593E-04 3.126E-05 3s 2. -52.95888 127.558 0.000E+00 1.088E+02 3.931E+00 3.700E-01 1.565E-01 7.317E-02 3.748E-02 1.276E-02 3p 6. -43.84917 1500.501 6.406E+02 3.005E+01 3.735E+00 3.687E-01 1.577E-01 7.538E-02 3.986E-02 1.483E-02 3d 10. -29.60400 3212.018 9.187E+01 1.571E+01 3.533E+00 3.449E-01 1.415E-01 6.771E-02 3.719E-02 1.613E-02 4s 2. -8.59761 56.166 0.000E+00 2.160E+01 1.520E+00 9.114E-01 9.418E-01 1.071E+00 1.333E+00 2.683E+00 4p 6. -5.84710 623.307 1.083E+02 5.563E+00 1.363E+00 9.982E-01 1.142E+00 1.455E+00 2.052E+00 5.497E+00 4d 9. -1.85174 1073.600 8.994E+00 1.934E+00 1.004E+00 1.343E+00 2.170E+00 4.123E+00 9.126E+00 6.781E+01 5s 1. -1.17833 17.119 0.000E+00 2.118E+00 4.675E-01 2.734E+00 8.472E+00 2.923E+01 1.116E+02 2.168E+03 9i 1. -0.01235 0.000 5.025E-06 2.110E-04 1.235E-02 1.005E+02 1.134E+04 1.363E+06 1.707E+08 2.920E+12 47. 1.318E+04 2.725E+02 1.306E+02 1.138E+04 1.363E+06 1.707E+08 2.920E+12 1. 2.805E+02 5.798E+00 2.778E+00 2.421E+02 2.901E+04 3.631E+06 6.212E+10 --------------------zeta--------------------- nl wnl ----blume-watson---- -----(r*vi)----- i (ryd) eps s evel edar evel+edar erel (ryd) (cm-1) (ryd) (cm-1) 1s 2. 0.00000 0.000 0.00000 0.000-2274.99709 -1877.19715 -398.57963 331.78280 -66.797 -1943.99398 2s 2. 0.00000 0.000 0.00000 0.000 -567.83896 -282.03306 -54.20917 36.23356 -17.976 -300.00868 2p 6. 8.55126 938392.336 8.80382 966107.342 -555.31980 -254.76192 -7.22309 -0.01377 -7.223 -261.98500 3s 2. 0.00000 0.000 0.00000 0.000 -234.94724 -54.56439 -10.56476 6.74711 -3.818 -58.38204 3p 6. 1.49487 164042.946 1.53306 168233.437 -227.35202 -45.41226 -1.64604 -0.00221 -1.646 -47.05830 3d 10. 0.17194 18868.611 0.18433 20228.020 -218.95974 -30.82977 -0.37684 -0.01081 -0.377 -31.20661 4s 2. 0.00000 0.000 0.00000 0.000 -108.40485 -9.35529 -2.07114 1.30745 -0.764 -10.11898 4p 6. 0.25235 27692.514 0.25851 28367.729 -99.73441 -6.56218 -0.29425 -0.00026 -0.294 -6.85643 4d 9. 0.01659 1820.207 0.01763 1934.371 -77.91714 -2.38714 -0.04242 -0.00102 -0.042 -2.42957 5s 1. 0.00000 0.000 0.00000 0.000 -39.89827 -1.24585 -0.19280 0.12146 -0.071 -1.31719 9i 1. 0.00000 0.001 0.00000 0.000 -1.14815 -0.00823 0.00000 0.00000 0.000 -0.00823 ag i d9 5s9i nconf= 38 z= 47 ion= 0 kut=-1 exf=0.650 corrf=0.000 ca1=0.700 ca0=0.500 without correlation with correlation ----------------------- ----------------------- nl wnl eps fg eps fgr corr eps fg eps fgr n*r n*rc ect ec----------------- 1s 2. -1886.30766 -1886.30766-0.08290 -1886.39057 -1886.39057 0.0230 0.0230 -0.08267 0.00000-0.08267 2s 2. -285.09821 -285.09821-0.08232 -285.18053 -285.18053 0.0592 0.0592 -0.23110 -0.06744-0.08099 2p 6. -255.72947 -255.72947-0.08242 -255.81189 -255.81189 0.0625 0.0625 -0.72296 -0.08169-0.08186-0.08197-0.08206-0.08218 3s 2. -55.90402 -55.90402-0.08107 -55.98509 -55.98509 0.1337 0.1336 -0.86760 -0.06668-0.07795 3p 6. -45.94780 -45.94780-0.08107 -46.02886 -46.02886 0.1475 0.1474 -1.34526 -0.07880-0.07928-0.07960-0.07983-0.08015 3d 10. -30.15152 -30.15152-0.08120 -30.23271 -30.23271 0.1821 0.1819 -2.15235 -0.08039-0.08049-0.08057-0.08064-0.08095 4s 2. -9.62587 -9.62587-0.07794 -9.70382 -9.70382 0.3223 0.3210 -2.28909 -0.06414-0.07260 4p 6. -6.52631 -6.52631-0.07740 -6.60371 -6.60371 0.3914 0.3891 -2.73538 -0.07242-0.07363-0.07437-0.07491-0.07565 4d 9. -2.00387 -2.00387-0.07469 -2.07856 -2.07856 0.7064 0.6936 -3.39164 -0.07030-0.07165-0.07235-0.07285-0.07431 5s 1. -1.12903 -1.12903-0.05730 -1.18633 -1.18633 0.9411 0.9181 -3.44894 -0.05730 9i 1. -0.01234 -0.01234 0.00000 -0.01234 -0.01234 9.0007 9.0007 -3.44894 0.00000 ecorrt= -3.63526 (old) ect= -3.44894 (new) etotrl= 0.00000 + 0.00000 + 0.00000 etot= -10621.24808 -10621.24808 -10624.88333 -10624.88333 -10624.69701 -10624.69701 -10624.69701 ag i d9 5s9i 10 -10624.6970 0 1.8202 2 0.0000 2 0.0024 3 0.0000 3 14.1995 4 0.0000 4 0.0000 4 0.0000 4 0.0000 4 t(run)= 17.59, t(job)= 656.59 seconds 47 1ag i d10 9l 4d1010l ag i d10 9l nconf= 39 z= 47 ncores= 9 nvales= 1 ion= 0 r(i)/x(i)=0.24532669 ca1=0.700 tolstb=1.000 tolk-2=1.00000 tolend= 0.5E-07 thresh= 0.1E-10 kut= 0 exf=1.000 corrf=0.000 ca0= 0.500 rcn mod 32 ihf1= 0 mesh=2601 idb= 481 rdb= 100.461 emx= 0.10 r(mesh)=5426.209 irel= 1 ib=2600 t(run)= 13.23, t(job)= 669.82 seconds nl wnl ee az (r-3) (r-2) (r-1) (r+1) (r+2) (r+3) (r+4) (r+6) 1s 2. -1885.12665 881.507 0.000E+00 5.213E+03 4.936E+01 3.112E-02 1.308E-03 6.934E-05 4.438E-06 2.867E-08 2s 2. -280.39754 295.095 0.000E+00 5.731E+02 1.123E+01 1.350E-01 2.146E-02 3.880E-03 7.892E-04 4.505E-05 2p 6. -254.26520 3360.692 3.659E+03 1.600E+02 1.083E+01 1.175E-01 1.683E-02 2.853E-03 5.593E-04 3.126E-05 3s 2. -52.61378 127.553 0.000E+00 1.088E+02 3.931E+00 3.700E-01 1.565E-01 7.318E-02 3.748E-02 1.276E-02 3p 6. -43.50400 1500.439 6.406E+02 3.004E+01 3.735E+00 3.687E-01 1.577E-01 7.538E-02 3.987E-02 1.484E-02 3d 10. -29.25683 3211.670 9.185E+01 1.570E+01 3.533E+00 3.450E-01 1.415E-01 6.773E-02 3.720E-02 1.614E-02 4s 2. -8.27119 56.016 0.000E+00 2.149E+01 1.516E+00 9.139E-01 9.475E-01 1.082E+00 1.354E+00 2.767E+00 4p 6. -5.53007 619.965 1.071E+02 5.509E+00 1.356E+00 1.004E+00 1.156E+00 1.486E+00 2.119E+00 5.841E+00 4d 10. -1.56879 1036.575 8.404E+00 1.825E+00 9.716E-01 1.397E+00 2.375E+00 4.802E+00 1.143E+01 1.006E+02 10l 1. -0.01000 0.000 1.634E-06 1.176E-04 1.000E-02 1.140E+02 1.425E+04 1.895E+06 2.633E+08 5.603E+12 47. 1.318E+04 2.727E+02 1.433E+02 1.429E+04 1.895E+06 2.633E+08 5.603E+12 1. 2.804E+02 5.802E+00 3.048E+00 3.039E+02 4.033E+04 5.603E+06 1.192E+11 --------------------zeta--------------------- nl wnl ----blume-watson---- -----(r*vi)----- i (ryd) eps s evel edar evel+edar erel (ryd) (cm-1) (ryd) (cm-1) 1s 2. 0.00000 0.000 0.00000 0.000-2274.99729 -1876.86308 -398.58175 331.78490 -66.797 -1943.65992 2s 2. 0.00000 0.000 0.00000 0.000 -567.83950 -281.68258 -54.21010 36.23414 -17.976 -299.65854 2p 6. 8.55158 938426.774 8.80416 966144.844 -555.32084 -254.41249 -7.22339 -0.01376 -7.223 -261.63589 3s 2. 0.00000 0.000 0.00000 0.000 -234.94456 -54.21891 -10.56400 6.74662 -3.817 -58.03629 3p 6. 1.49473 164028.098 1.53292 168218.910 -227.34854 -45.06673 -1.64589 -0.00221 -1.646 -46.71262 3d 10. 0.17191 18864.973 0.18429 20224.034 -218.95188 -30.48268 -0.37676 -0.01081 -0.377 -30.85944 4s 2. 0.00000 0.000 0.00000 0.000 -108.22126 -9.03332 -2.06002 1.30044 -0.760 -9.79290 4p 6. 0.24966 27397.078 0.25575 28064.979 -99.37775 -6.24901 -0.29109 -0.00026 -0.291 -6.54010 4d 10. 0.01547 1698.153 0.01645 1804.895 -75.87238 -2.09315 -0.03955 -0.00095 -0.040 -2.13270 10l 1. 0.00000 0.000 0.00000 0.000 -0.93000 -0.00624 0.00000 0.00000 0.000 -0.00624 ag i d10 9l nconf= 39 z= 47 ion= 0 kut=-1 exf=0.650 corrf=0.000 ca1=0.700 ca0=0.500 without correlation with correlation ----------------------- ----------------------- nl wnl eps fg eps fgr corr eps fg eps fgr n*r n*rc ect ec----------------- 1s 2. -1885.97228 -1885.97228-0.08290 -1886.05518 -1886.05518 0.0230 0.0230 -0.08267 0.00000-0.08267 2s 2. -284.74582 -284.74582-0.08232 -284.82814 -284.82814 0.0593 0.0593 -0.23110 -0.06744-0.08099 2p 6. -255.38067 -255.38067-0.08242 -255.46309 -255.46309 0.0626 0.0626 -0.72296 -0.08169-0.08186-0.08197-0.08206-0.08218 3s 2. -55.55267 -55.55267-0.08107 -55.63374 -55.63374 0.1342 0.1341 -0.86759 -0.06668-0.07795 3p 6. -45.60043 -45.60043-0.08107 -45.68149 -45.68149 0.1481 0.1480 -1.34526 -0.07880-0.07928-0.07960-0.07983-0.08015 3d 10. -29.80768 -29.80768-0.08120 -29.88888 -29.88888 0.1832 0.1829 -2.15235 -0.08039-0.08049-0.08057-0.08064-0.08095 4s 2. -9.30362 -9.30362-0.07796 -9.38158 -9.38158 0.3278 0.3265 -2.28891 -0.06401-0.07255 4p 6. -6.23983 -6.23983-0.07741 -6.31724 -6.31724 0.4003 0.3979 -2.73478 -0.07233-0.07355-0.07430-0.07484-0.07559 4d 10. -1.71527 -1.71527-0.07408 -1.78935 -1.78935 0.7635 0.7476 -3.45992 -0.06933-0.07096-0.07175-0.07230-0.07408 10l 1. -0.01000 -0.01000 0.00000 -0.01000 -0.01000 10.0008 10.0008 -3.45992 0.00000 ecorrt= -3.64659 (old) ect= -3.45992 (new) etotrl= 0.00000 + 0.00000 + 0.00000 etot= -10621.58725 -10621.58725 -10625.23385 -10625.23385 -10625.04717 -10625.04717 -10625.04717 ag i d10 9l 2 -10625.0472 0 0.0000 2 t(run)= 18.05, t(job)= 674.64 seconds 47 1ag i d9 5s9l 4d9 5s 10l ag i d9 5s9l nconf= 40 z= 47 ncores=10 nvales= 1 ion= 0 r(i)/x(i)=0.24532669 ca1=0.700 tolstb=1.000 tolk-2=1.00000 tolend= 0.5E-07 thresh= 0.1E-10 kut= 0 exf=1.000 corrf=0.000 ca0= 0.500 rcn mod 32 ihf1= 0 mesh=2601 idb= 481 rdb= 100.461 emx= 0.10 r(mesh)=5426.209 irel= 1 ib=2600 t(run)= 11.96, t(job)= 686.60 seconds nl wnl ee az (r-3) (r-2) (r-1) (r+1) (r+2) (r+3) (r+4) (r+6) 1s 2. -1885.46553 881.504 0.000E+00 5.213E+03 4.936E+01 3.112E-02 1.308E-03 6.934E-05 4.438E-06 2.867E-08 2s 2. -280.75312 295.093 0.000E+00 5.731E+02 1.123E+01 1.350E-01 2.146E-02 3.880E-03 7.892E-04 4.505E-05 2p 6. -254.61944 3360.614 3.659E+03 1.600E+02 1.083E+01 1.175E-01 1.684E-02 2.853E-03 5.593E-04 3.126E-05 3s 2. -52.96357 127.558 0.000E+00 1.088E+02 3.931E+00 3.700E-01 1.565E-01 7.317E-02 3.748E-02 1.276E-02 3p 6. -43.85386 1500.501 6.406E+02 3.005E+01 3.735E+00 3.687E-01 1.577E-01 7.538E-02 3.986E-02 1.483E-02 3d 10. -29.60869 3212.018 9.187E+01 1.571E+01 3.533E+00 3.449E-01 1.415E-01 6.771E-02 3.719E-02 1.613E-02 4s 2. -8.60230 56.166 0.000E+00 2.160E+01 1.520E+00 9.114E-01 9.418E-01 1.071E+00 1.333E+00 2.683E+00 4p 6. -5.85179 623.307 1.083E+02 5.563E+00 1.363E+00 9.982E-01 1.142E+00 1.455E+00 2.052E+00 5.497E+00 4d 9. -1.85643 1073.600 8.994E+00 1.934E+00 1.004E+00 1.343E+00 2.170E+00 4.123E+00 9.126E+00 6.781E+01 5s 1. -1.18302 17.119 0.000E+00 2.118E+00 4.675E-01 2.734E+00 8.472E+00 2.923E+01 1.116E+02 2.168E+03 10l 1. -0.01000 0.000 1.634E-06 1.176E-04 1.000E-02 1.140E+02 1.425E+04 1.895E+06 2.633E+08 5.603E+12 47. 1.318E+04 2.725E+02 1.441E+02 1.429E+04 1.895E+06 2.633E+08 5.603E+12 1. 2.805E+02 5.798E+00 3.065E+00 3.040E+02 4.033E+04 5.603E+06 1.192E+11 --------------------zeta--------------------- nl wnl ----blume-watson---- -----(r*vi)----- i (ryd) eps s evel edar evel+edar erel (ryd) (cm-1) (ryd) (cm-1) 1s 2. 0.00000 0.000 0.00000 0.000-2274.99709 -1877.20184 -398.57963 331.78279 -66.797 -1943.99868 2s 2. 0.00000 0.000 0.00000 0.000 -567.83896 -282.03776 -54.20917 36.23355 -17.976 -300.01337 2p 6. 8.55126 938392.336 8.80382 966107.342 -555.31980 -254.76661 -7.22309 -0.01377 -7.223 -261.98970 3s 2. 0.00000 0.000 0.00000 0.000 -234.94724 -54.56908 -10.56476 6.74711 -3.818 -58.38673 3p 6. 1.49487 164042.946 1.53306 168233.437 -227.35202 -45.41695 -1.64604 -0.00221 -1.646 -47.06299 3d 10. 0.17194 18868.611 0.18433 20228.020 -218.95974 -30.83446 -0.37684 -0.01081 -0.377 -31.21130 4s 2. 0.00000 0.000 0.00000 0.000 -108.40485 -9.35998 -2.07114 1.30745 -0.764 -10.12367 4p 6. 0.25235 27692.514 0.25851 28367.729 -99.73441 -6.56687 -0.29425 -0.00026 -0.294 -6.86112 4d 9. 0.01659 1820.207 0.01763 1934.371 -77.91714 -2.39184 -0.04242 -0.00102 -0.042 -2.43426 5s 1. 0.00000 0.000 0.00000 0.000 -39.89827 -1.25054 -0.19280 0.12146 -0.071 -1.32188 10l 1. 0.00000 0.000 0.00000 0.000 -0.93000 -0.00624 0.00000 0.00000 0.000 -0.00624 ag i d9 5s9l nconf= 40 z= 47 ion= 0 kut=-1 exf=0.650 corrf=0.000 ca1=0.700 ca0=0.500 without correlation with correlation ----------------------- ----------------------- nl wnl eps fg eps fgr corr eps fg eps fgr n*r n*rc ect ec----------------- 1s 2. -1886.31235 -1886.31235-0.08290 -1886.39526 -1886.39526 0.0230 0.0230 -0.08267 0.00000-0.08267 2s 2. -285.10290 -285.10290-0.08232 -285.18523 -285.18523 0.0592 0.0592 -0.23110 -0.06744-0.08099 2p 6. -255.73416 -255.73416-0.08242 -255.81658 -255.81658 0.0625 0.0625 -0.72296 -0.08169-0.08186-0.08197-0.08206-0.08218 3s 2. -55.90871 -55.90871-0.08107 -55.98978 -55.98978 0.1337 0.1336 -0.86760 -0.06668-0.07795 3p 6. -45.95249 -45.95249-0.08107 -46.03355 -46.03355 0.1475 0.1474 -1.34526 -0.07880-0.07928-0.07960-0.07983-0.08015 3d 10. -30.15621 -30.15621-0.08120 -30.23741 -30.23741 0.1821 0.1819 -2.15235 -0.08039-0.08049-0.08057-0.08064-0.08095 4s 2. -9.63057 -9.63057-0.07794 -9.70851 -9.70851 0.3222 0.3209 -2.28909 -0.06414-0.07260 4p 6. -6.53100 -6.53100-0.07740 -6.60841 -6.60841 0.3913 0.3890 -2.73538 -0.07242-0.07363-0.07437-0.07491-0.07565 4d 9. -2.00856 -2.00856-0.07469 -2.08325 -2.08325 0.7056 0.6928 -3.39164 -0.07030-0.07165-0.07235-0.07285-0.07431 5s 1. -1.13372 -1.13372-0.05730 -1.19102 -1.19102 0.9392 0.9163 -3.44894 -0.05730 10l 1. -0.01000 -0.01000 0.00000 -0.01000 -0.01000 10.0008 10.0008 -3.44894 0.00000 ecorrt= -3.63526 (old) ect= -3.44894 (new) etotrl= 0.00000 + 0.00000 + 0.00000 etot= -10621.24573 -10621.24573 -10624.88099 -10624.88099 -10624.69467 -10624.69467 -10624.69467 ag i d9 5s9l 10 -10624.6947 0 1.8202 2 0.0000 2 0.0008 3 0.0000 3 14.1995 4 0.0000 4 0.0000 4 0.0000 4 0.0000 4 t(run)= 17.10, t(job)= 691.74 seconds 47 1ag i d9 5p2 4d9 5p2 ag i d9 5p2 nconf= 41 z= 47 ncores= 9 nvales= 1 ion= 0 r(i)/x(i)=0.24532669 ca1=0.700 tolstb=1.000 tolk-2=1.00000 tolend= 0.5E-07 thresh= 0.1E-10 kut= 0 exf=1.000 corrf=0.000 ca0= 0.500 rcn mod 32 ihf1= 0 mesh=2601 idb= 481 rdb= 100.461 emx= 0.10 r(mesh)=5426.209 irel= 1 ib=2600 t(run)= 10.81, t(job)= 702.55 seconds nl wnl ee az (r-3) (r-2) (r-1) (r+1) (r+2) (r+3) (r+4) (r+6) 1s 2. -1885.12658 881.506 0.000E+00 5.213E+03 4.936E+01 3.112E-02 1.308E-03 6.934E-05 4.438E-06 2.867E-08 2s 2. -280.41398 295.093 0.000E+00 5.731E+02 1.123E+01 1.350E-01 2.146E-02 3.880E-03 7.892E-04 4.505E-05 2p 6. -254.27996 3360.612 3.659E+03 1.600E+02 1.083E+01 1.175E-01 1.684E-02 2.853E-03 5.593E-04 3.126E-05 3s 2. -52.62601 127.557 0.000E+00 1.088E+02 3.931E+00 3.700E-01 1.565E-01 7.317E-02 3.748E-02 1.276E-02 3p 6. -43.51620 1500.488 6.406E+02 3.005E+01 3.735E+00 3.687E-01 1.577E-01 7.538E-02 3.986E-02 1.483E-02 3d 10. -29.27085 3211.947 9.187E+01 1.571E+01 3.533E+00 3.449E-01 1.415E-01 6.771E-02 3.719E-02 1.613E-02 4s 2. -8.26598 56.162 0.000E+00 2.159E+01 1.520E+00 9.114E-01 9.417E-01 1.071E+00 1.332E+00 2.680E+00 4p 6. -5.51553 623.312 1.083E+02 5.563E+00 1.363E+00 9.981E-01 1.141E+00 1.453E+00 2.049E+00 5.477E+00 4d 9. -1.51826 1075.641 9.027E+00 1.940E+00 1.006E+00 1.340E+00 2.161E+00 4.101E+00 9.083E+00 6.812E+01 5p 2. -0.33130 131.826 4.848E+00 3.171E-01 3.126E-01 4.105E+00 1.983E+01 1.109E+02 7.093E+02 4.157E+04 47. 1.318E+04 2.727E+02 3.552E+01 7.067E+01 2.708E+02 1.516E+03 8.380E+04 1. 2.804E+02 5.802E+00 7.558E-01 1.504E+00 5.762E+00 3.226E+01 1.783E+03 --------------------zeta--------------------- nl wnl ----blume-watson---- -----(r*vi)----- i (ryd) eps s evel edar evel+edar erel (ryd) (cm-1) (ryd) (cm-1) 1s 2. 0.00000 0.000 0.00000 0.000-2274.99718 -1876.86319 -398.58018 331.78365 -66.797 -1943.65972 2s 2. 0.00000 0.000 0.00000 0.000 -567.83888 -281.69859 -54.20909 36.23355 -17.976 -299.67413 2p 6. 8.55123 938388.864 8.80379 966104.711 -555.31965 -254.42721 -7.22306 -0.01377 -7.223 -261.65027 3s 2. 0.00000 0.000 0.00000 0.000 -234.94681 -54.23141 -10.56462 6.74703 -3.818 -58.04900 3p 6. 1.49484 164039.832 1.53303 168230.500 -227.35138 -45.07923 -1.64600 -0.00221 -1.646 -46.72523 3d 10. 0.17194 18867.953 0.18432 20227.295 -218.95855 -30.49660 -0.37683 -0.01081 -0.377 -30.87342 4s 2. 0.00000 0.000 0.00000 0.000 -108.40157 -9.02362 -2.07079 1.30723 -0.764 -9.78718 4p 6. 0.25236 27693.002 0.25851 28368.196 -99.73992 -6.23024 -0.29426 -0.00026 -0.294 -6.52450 4d 9. 0.01665 1827.051 0.01769 1941.685 -78.03411 -2.05377 -0.04259 -0.00102 -0.043 -2.09636 5p 2. 0.01127 1236.768 0.01153 1265.676 -27.66236 -0.41057 -0.01323 -0.00001 -0.013 -0.42380 ag i d9 5p2 nconf= 41 z= 47 ion= 0 kut=-1 exf=0.650 corrf=0.000 ca1=0.700 ca0=0.500 without correlation with correlation ----------------------- ----------------------- nl wnl eps fg eps fgr corr eps fg eps fgr n*r n*rc ect ec----------------- 1s 2. -1885.97304 -1885.97304-0.08290 -1886.05594 -1886.05594 0.0230 0.0230 -0.08267 0.00000-0.08267 2s 2. -284.76159 -284.76159-0.08232 -284.84391 -284.84391 0.0593 0.0593 -0.23110 -0.06744-0.08099 2p 6. -255.39525 -255.39525-0.08242 -255.47767 -255.47767 0.0626 0.0626 -0.72296 -0.08169-0.08186-0.08197-0.08206-0.08218 3s 2. -55.56710 -55.56710-0.08107 -55.64817 -55.64817 0.1342 0.1341 -0.86760 -0.06668-0.07795 3p 6. -45.61541 -45.61541-0.08107 -45.69648 -45.69648 0.1481 0.1479 -1.34526 -0.07880-0.07928-0.07960-0.07983-0.08015 3d 10. -29.81886 -29.81886-0.08120 -29.90006 -29.90006 0.1831 0.1829 -2.15235 -0.08039-0.08049-0.08057-0.08064-0.08095 4s 2. -9.28608 -9.28608-0.07794 -9.36402 -9.36402 0.3282 0.3268 -2.28909 -0.06414-0.07260 4p 6. -6.19810 -6.19810-0.07740 -6.27549 -6.27549 0.4017 0.3992 -2.73540 -0.07243-0.07363-0.07438-0.07491-0.07565 4d 9. -1.67049 -1.67049-0.07474 -1.74523 -1.74523 0.7737 0.7570 -3.39190 -0.07035-0.07168-0.07238-0.07288-0.07433 5p 2. -0.33701 -0.33701-0.05083 -0.38785 -0.38785 1.7226 1.6057 -3.48132 -0.03859-0.05083 ecorrt= -3.68003 (old) ect= -3.48132 (new) etotrl= 0.00000 + 0.00000 + 0.00000 etot= -10621.18855 -10621.18855 -10624.86858 -10624.86858 -10624.66988 -10624.66988 -10624.66988 ag i d9 5p2 7 -10624.6699 0 24.8540 1 1.8271 2 1.2368 2 14.3805 3 5.3626 4 4.3852 4 t(run)= 14.83, t(job)= 706.57 seconds 47 1ag i d10 5p 4d10 5p ag i d10 5p nconf= 42 z= 47 ncores= 9 nvales= 1 ion= 0 r(i)/x(i)=0.24532669 ca1=0.700 tolstb=1.000 tolk-2=1.00000 tolend= 0.5E-07 thresh= 0.1E-10 kut= 0 exf=1.000 corrf=0.000 ca0= 0.500 rcn mod 32 ihf1= 0 mesh=2601 idb= 481 rdb= 100.461 emx= 0.10 r(mesh)=5426.209 irel= 1 ib=2600 t(run)= 13.92, t(job)= 720.49 seconds nl wnl ee az (r-3) (r-2) (r-1) (r+1) (r+2) (r+3) (r+4) (r+6) 1s 2. -1884.69368 881.508 0.000E+00 5.213E+03 4.936E+01 3.112E-02 1.308E-03 6.934E-05 4.438E-06 2.867E-08 2s 2. -279.96758 295.095 0.000E+00 5.731E+02 1.123E+01 1.350E-01 2.146E-02 3.880E-03 7.892E-04 4.505E-05 2p 6. -253.83492 3360.679 3.659E+03 1.600E+02 1.083E+01 1.175E-01 1.683E-02 2.853E-03 5.593E-04 3.126E-05 3s 2. -52.18301 127.554 0.000E+00 1.088E+02 3.931E+00 3.700E-01 1.565E-01 7.318E-02 3.748E-02 1.276E-02 3p 6. -43.07322 1500.448 6.406E+02 3.004E+01 3.735E+00 3.687E-01 1.577E-01 7.538E-02 3.987E-02 1.484E-02 3d 10. -28.82638 3211.723 9.186E+01 1.570E+01 3.533E+00 3.450E-01 1.415E-01 6.772E-02 3.720E-02 1.614E-02 4s 2. -7.83853 56.028 0.000E+00 2.149E+01 1.517E+00 9.137E-01 9.471E-01 1.082E+00 1.353E+00 2.763E+00 4p 6. -5.09669 620.188 1.072E+02 5.513E+00 1.357E+00 1.003E+00 1.156E+00 1.485E+00 2.117E+00 5.841E+00 4d 10. -1.13295 1033.382 8.353E+00 1.815E+00 9.679E-01 1.407E+00 2.422E+00 4.996E+00 1.224E+01 1.171E+02 5p 1. -0.26511 100.752 2.837E+00 2.018E-01 2.610E-01 4.863E+00 2.796E+01 1.864E+02 1.419E+03 1.164E+05 47. 1.318E+04 2.729E+02 3.422E+01 6.383E+01 2.487E+02 1.558E+03 1.176E+05 1. 2.804E+02 5.806E+00 7.282E-01 1.358E+00 5.292E+00 3.315E+01 2.502E+03 --------------------zeta--------------------- nl wnl ----blume-watson---- -----(r*vi)----- i (ryd) eps s evel edar evel+edar erel (ryd) (cm-1) (ryd) (cm-1) 1s 2. 0.00000 0.000 0.00000 0.000-2274.99737 -1876.43014 -398.58166 331.78539 -66.796 -1943.22641 2s 2. 0.00000 0.000 0.00000 0.000 -567.83940 -281.25253 -54.20994 36.23411 -17.976 -299.22836 2p 6. 8.55151 938419.737 8.80409 966137.403 -555.32062 -253.98220 -7.22333 -0.01376 -7.223 -261.20553 3s 2. 0.00000 0.000 0.00000 0.000 -234.94497 -53.78819 -10.56411 6.74671 -3.817 -57.60559 3p 6. 1.49475 164030.148 1.53294 168220.930 -227.34905 -44.63600 -1.64591 -0.00221 -1.646 -46.28191 3d 10. 0.17192 18865.526 0.18430 20224.635 -218.95309 -30.05221 -0.37677 -0.01081 -0.377 -30.42898 4s 2. 0.00000 0.000 0.00000 0.000 -108.23539 -8.60036 -2.06092 1.30101 -0.760 -9.36027 4p 6. 0.24984 27416.708 0.25593 28085.078 -99.39919 -5.81551 -0.29130 -0.00026 -0.291 -6.10681 4d 10. 0.01538 1687.753 0.01635 1793.821 -75.61318 -1.65834 -0.03931 -0.00095 -0.039 -1.69764 5p 1. 0.00659 722.858 0.00674 739.556 -23.47917 -0.25725 -0.00772 -0.00001 -0.008 -0.26498 ag i d10 5p nconf= 42 z= 47 ion= 0 kut=-1 exf=0.650 corrf=0.000 ca1=0.700 ca0=0.500 without correlation with correlation ----------------------- ----------------------- nl wnl eps fg eps fgr corr eps fg eps fgr n*r n*rc ect ec----------------- 1s 2. -1885.53946 -1885.53946-0.08290 -1885.62236 -1885.62236 0.0230 0.0230 -0.08267 0.00000-0.08267 2s 2. -284.31571 -284.31571-0.08232 -284.39803 -284.39803 0.0593 0.0593 -0.23110 -0.06744-0.08099 2p 6. -254.95036 -254.95036-0.08242 -255.03278 -255.03278 0.0626 0.0626 -0.72296 -0.08169-0.08186-0.08197-0.08206-0.08218 3s 2. -55.12230 -55.12230-0.08107 -55.20336 -55.20336 0.1347 0.1346 -0.86759 -0.06668-0.07795 3p 6. -45.17022 -45.17022-0.08107 -45.25128 -45.25128 0.1488 0.1487 -1.34526 -0.07880-0.07928-0.07960-0.07983-0.08015 3d 10. -29.37679 -29.37679-0.08120 -29.45799 -29.45799 0.1845 0.1842 -2.15235 -0.08039-0.08049-0.08057-0.08064-0.08095 4s 2. -8.87059 -8.87059-0.07796 -8.94855 -8.94855 0.3358 0.3343 -2.28892 -0.06402-0.07256 4p 6. -5.80534 -5.80534-0.07741 -5.88275 -5.88275 0.4150 0.4123 -2.73481 -0.07233-0.07356-0.07431-0.07484-0.07559 4d 10. -1.27711 -1.27711-0.07421 -1.35132 -1.35132 0.8849 0.8602 -3.45870 -0.06910-0.07082-0.07162-0.07218-0.07398 5p 1. -0.24936 -0.24936-0.03428 -0.28364 -0.28364 2.0026 1.8777 -3.49298 -0.03428 ecorrt= -3.68221 (old) ect= -3.49298 (new) etotrl= 0.00000 + 0.00000 + 0.00000 etot= -10621.81461 -10621.81461 -10625.49682 -10625.49682 -10625.30759 -10625.30759 -10625.30759 ag i d10 5p 2 -10625.3076 0 0.7229 2 t(run)= 18.87, t(job)= 725.44 seconds 47 1ag i d10 6p 4d10 6p ag i d10 6p nconf= 43 z= 47 ncores= 9 nvales= 1 ion= 0 r(i)/x(i)=0.24532669 ca1=0.700 tolstb=1.000 tolk-2=1.00000 tolend= 0.5E-07 thresh= 0.1E-10 kut= 0 exf=1.000 corrf=0.000 ca0= 0.500 rcn mod 32 ihf1= 0 mesh=2601 idb= 481 rdb= 100.461 emx= 0.10 r(mesh)=5426.209 irel= 1 ib=2600 t(run)= 12.05, t(job)= 737.48 seconds nl wnl ee az (r-3) (r-2) (r-1) (r+1) (r+2) (r+3) (r+4) (r+6) 1s 2. -1884.94622 881.508 0.000E+00 5.213E+03 4.936E+01 3.112E-02 1.308E-03 6.934E-05 4.438E-06 2.867E-08 2s 2. -280.21776 295.095 0.000E+00 5.731E+02 1.123E+01 1.350E-01 2.146E-02 3.880E-03 7.892E-04 4.505E-05 2p 6. -254.08534 3360.690 3.659E+03 1.600E+02 1.083E+01 1.175E-01 1.683E-02 2.853E-03 5.593E-04 3.126E-05 3s 2. -52.43386 127.553 0.000E+00 1.088E+02 3.931E+00 3.700E-01 1.565E-01 7.318E-02 3.748E-02 1.276E-02 3p 6. -43.32407 1500.440 6.406E+02 3.004E+01 3.735E+00 3.687E-01 1.577E-01 7.538E-02 3.987E-02 1.484E-02 3d 10. -29.07697 3211.680 9.185E+01 1.570E+01 3.533E+00 3.450E-01 1.415E-01 6.773E-02 3.720E-02 1.614E-02 4s 2. -8.09096 56.018 0.000E+00 2.149E+01 1.517E+00 9.139E-01 9.475E-01 1.082E+00 1.354E+00 2.766E+00 4p 6. -5.34971 620.003 1.071E+02 5.510E+00 1.356E+00 1.004E+00 1.156E+00 1.486E+00 2.119E+00 5.842E+00 4d 10. -1.38808 1035.895 8.393E+00 1.823E+00 9.709E-01 1.399E+00 2.383E+00 4.836E+00 1.157E+01 1.030E+02 6p 1. -0.11367 48.345 6.525E-01 4.750E-02 1.074E-01 1.242E+01 1.753E+02 2.700E+03 4.491E+04 1.542E+07 47. 1.318E+04 2.728E+02 4.170E+01 2.107E+02 2.760E+03 4.505E+04 1.542E+07 1. 2.804E+02 5.804E+00 8.873E-01 4.484E+00 5.873E+01 9.584E+02 3.280E+05 --------------------zeta--------------------- nl wnl ----blume-watson---- -----(r*vi)----- i (ryd) eps s evel edar evel+edar erel (ryd) (cm-1) (ryd) (cm-1) 1s 2. 0.00000 0.000 0.00000 0.000-2274.99733 -1876.68266 -398.58177 331.78515 -66.797 -1943.47927 2s 2. 0.00000 0.000 0.00000 0.000 -567.83948 -281.50278 -54.21007 36.23415 -17.976 -299.47870 2p 6. 8.55156 938425.190 8.80414 966143.170 -555.32079 -254.23264 -7.22338 -0.01376 -7.223 -261.45602 3s 2. 0.00000 0.000 0.00000 0.000 -234.94462 -54.03900 -10.56401 6.74664 -3.817 -57.85638 3p 6. 1.49474 164028.418 1.53293 168219.220 -227.34861 -44.88682 -1.64589 -0.00221 -1.646 -46.53271 3d 10. 0.17191 18865.071 0.18430 20224.140 -218.95209 -30.30282 -0.37676 -0.01081 -0.377 -30.67958 4s 2. 0.00000 0.000 0.00000 0.000 -108.22379 -8.85304 -2.06018 1.30054 -0.760 -9.61268 4p 6. 0.24969 27400.467 0.25578 28068.448 -99.38134 -6.06864 -0.29113 -0.00026 -0.291 -6.35977 4d 10. 0.01545 1695.936 0.01643 1802.535 -75.81993 -1.91265 -0.03950 -0.00095 -0.039 -1.95215 6p 1. 0.00152 166.421 0.00155 170.261 -9.81323 -0.10145 -0.00178 0.00000 -0.002 -0.10323 ag i d10 6p nconf= 43 z= 47 ion= 0 kut=-1 exf=0.650 corrf=0.000 ca1=0.700 ca0=0.500 without correlation with correlation ----------------------- ----------------------- nl wnl eps fg eps fgr corr eps fg eps fgr n*r n*rc ect ec----------------- 1s 2. -1885.79188 -1885.79188-0.08290 -1885.87478 -1885.87478 0.0230 0.0230 -0.08267 0.00000-0.08267 2s 2. -284.56601 -284.56601-0.08232 -284.64833 -284.64833 0.0593 0.0593 -0.23110 -0.06744-0.08099 2p 6. -255.20081 -255.20081-0.08242 -255.28323 -255.28323 0.0626 0.0626 -0.72296 -0.08169-0.08186-0.08197-0.08206-0.08218 3s 2. -55.37284 -55.37284-0.08107 -55.45391 -55.45391 0.1344 0.1343 -0.86759 -0.06668-0.07795 3p 6. -45.42063 -45.42063-0.08107 -45.50169 -45.50169 0.1484 0.1482 -1.34526 -0.07880-0.07928-0.07960-0.07983-0.08015 3d 10. -29.62773 -29.62773-0.08120 -29.70893 -29.70893 0.1837 0.1835 -2.15235 -0.08039-0.08049-0.08057-0.08064-0.08095 4s 2. -9.12334 -9.12334-0.07796 -9.20130 -9.20130 0.3311 0.3297 -2.28891 -0.06401-0.07255 4p 6. -6.05929 -6.05929-0.07741 -6.13670 -6.13670 0.4062 0.4037 -2.73478 -0.07233-0.07355-0.07430-0.07484-0.07559 4d 10. -1.53405 -1.53405-0.07411 -1.60816 -1.60816 0.8074 0.7886 -3.45969 -0.06929-0.07094-0.07173-0.07228-0.07406 6p 1. -0.10839 -0.10839-0.00529 -0.11368 -0.11368 3.0374 2.9659 -3.46497 -0.00529 ecorrt= -3.65219 (old) ect= -3.46497 (new) etotrl= 0.00000 + 0.00000 + 0.00000 etot= -10621.68353 -10621.68353 -10625.33572 -10625.33572 -10625.14851 -10625.14851 -10625.14851 ag i d10 6p 2 -10625.1485 0 0.1664 2 t(run)= 16.77, t(job)= 742.20 seconds 47 1ag i d10 7p 4d10 7p ag i d10 7p nconf= 44 z= 47 ncores= 9 nvales= 1 ion= 0 r(i)/x(i)=0.24532669 ca1=0.700 tolstb=1.000 tolk-2=1.00000 tolend= 0.5E-07 thresh= 0.1E-10 kut= 0 exf=1.000 corrf=0.000 ca0= 0.500 rcn mod 32 ihf1= 0 mesh=2601 idb= 481 rdb= 100.461 emx= 0.10 r(mesh)=5426.209 irel= 1 ib=2600 t(run)= 14.02, t(job)= 756.22 seconds nl wnl ee az (r-3) (r-2) (r-1) (r+1) (r+2) (r+3) (r+4) (r+6) 1s 2. -1885.03189 881.507 0.000E+00 5.213E+03 4.936E+01 3.112E-02 1.308E-03 6.934E-05 4.438E-06 2.867E-08 2s 2. -280.30304 295.095 0.000E+00 5.731E+02 1.123E+01 1.350E-01 2.146E-02 3.880E-03 7.892E-04 4.505E-05 2p 6. -254.17066 3360.691 3.659E+03 1.600E+02 1.083E+01 1.175E-01 1.683E-02 2.853E-03 5.593E-04 3.126E-05 3s 2. -52.51922 127.553 0.000E+00 1.088E+02 3.931E+00 3.700E-01 1.565E-01 7.318E-02 3.748E-02 1.276E-02 3p 6. -43.40944 1500.439 6.406E+02 3.004E+01 3.735E+00 3.687E-01 1.577E-01 7.538E-02 3.987E-02 1.484E-02 3d 10. -29.16230 3211.674 9.185E+01 1.570E+01 3.533E+00 3.450E-01 1.415E-01 6.773E-02 3.720E-02 1.614E-02 4s 2. -8.17653 56.016 0.000E+00 2.149E+01 1.517E+00 9.139E-01 9.475E-01 1.082E+00 1.354E+00 2.767E+00 4p 6. -5.43536 619.979 1.071E+02 5.509E+00 1.356E+00 1.004E+00 1.156E+00 1.486E+00 2.119E+00 5.842E+00 4d 10. -1.47396 1036.313 8.400E+00 1.824E+00 9.713E-01 1.398E+00 2.378E+00 4.814E+00 1.148E+01 1.015E+02 7p 1. -0.06333 30.381 2.576E-01 1.889E-02 6.014E-02 2.288E+01 5.892E+02 1.628E+04 4.759E+05 4.726E+08 47. 1.318E+04 2.727E+02 5.214E+01 6.246E+02 1.634E+04 4.760E+05 4.726E+08 1. 2.804E+02 5.803E+00 1.109E+00 1.329E+01 3.477E+02 1.013E+04 1.006E+07 --------------------zeta--------------------- nl wnl ----blume-watson---- -----(r*vi)----- i (ryd) eps s evel edar evel+edar erel (ryd) (cm-1) (ryd) (cm-1) 1s 2. 0.00000 0.000 0.00000 0.000-2274.99731 -1876.76832 -398.58177 331.78504 -66.797 -1943.56505 2s 2. 0.00000 0.000 0.00000 0.000 -567.83949 -281.58806 -54.21009 36.23414 -17.976 -299.56401 2p 6. 8.55157 938426.152 8.80415 966144.187 -555.32082 -254.31796 -7.22339 -0.01376 -7.223 -261.54134 3s 2. 0.00000 0.000 0.00000 0.000 -234.94458 -54.12436 -10.56400 6.74663 -3.817 -57.94173 3p 6. 1.49474 164028.205 1.53292 168219.012 -227.34856 -44.97218 -1.64589 -0.00221 -1.646 -46.61807 3d 10. 0.17191 18865.008 0.18430 20224.072 -218.95195 -30.38815 -0.37676 -0.01081 -0.377 -30.76491 4s 2. 0.00000 0.000 0.00000 0.000 -108.22217 -8.93864 -2.06008 1.30048 -0.760 -9.69824 4p 6. 0.24967 27398.285 0.25576 28066.214 -99.37902 -6.15430 -0.29110 -0.00026 -0.291 -6.44540 4d 10. 0.01547 1697.300 0.01644 1803.986 -75.85245 -1.99840 -0.03953 -0.00095 -0.040 -2.03793 7p 1. 0.00060 65.717 0.00061 67.235 -5.52441 -0.05513 -0.00070 0.00000 -0.001 -0.05583 ag i d10 7p nconf= 44 z= 47 ion= 0 kut=-1 exf=0.650 corrf=0.000 ca1=0.700 ca0=0.500 without correlation with correlation ----------------------- ----------------------- nl wnl eps fg eps fgr corr eps fg eps fgr n*r n*rc ect ec----------------- 1s 2. -1885.87753 -1885.87753-0.08290 -1885.96044 -1885.96044 0.0230 0.0230 -0.08267 0.00000-0.08267 2s 2. -284.65130 -284.65130-0.08232 -284.73362 -284.73362 0.0593 0.0593 -0.23110 -0.06744-0.08099 2p 6. -255.28613 -255.28613-0.08242 -255.36855 -255.36855 0.0626 0.0626 -0.72296 -0.08169-0.08186-0.08197-0.08206-0.08218 3s 2. -55.45815 -55.45815-0.08107 -55.53922 -55.53922 0.1343 0.1342 -0.86759 -0.06668-0.07795 3p 6. -45.50592 -45.50592-0.08107 -45.58698 -45.58698 0.1482 0.1481 -1.34526 -0.07880-0.07928-0.07960-0.07983-0.08015 3d 10. -29.71311 -29.71311-0.08120 -29.79431 -29.79431 0.1835 0.1832 -2.15235 -0.08039-0.08049-0.08057-0.08064-0.08095 4s 2. -9.20894 -9.20894-0.07796 -9.28690 -9.28690 0.3295 0.3281 -2.28891 -0.06401-0.07255 4p 6. -6.14506 -6.14506-0.07741 -6.22247 -6.22247 0.4034 0.4009 -2.73478 -0.07233-0.07355-0.07430-0.07484-0.07559 4d 10. -1.62025 -1.62025-0.07409 -1.69434 -1.69434 0.7856 0.7682 -3.45983 -0.06931-0.07095-0.07174-0.07229-0.07407 7p 1. -0.06112 -0.06112-0.00194 -0.06306 -0.06306 4.0450 3.9822 -3.46178 -0.00194 ecorrt= -3.64865 (old) ect= -3.46178 (new) etotrl= 0.00000 + 0.00000 + 0.00000 etot= -10621.63759 -10621.63759 -10625.28624 -10625.28624 -10625.09937 -10625.09937 -10625.09937 ag i d10 7p 2 -10625.0994 0 0.0657 2 t(run)= 18.73, t(job)= 760.94 seconds 47 1ag i d10 8p 4d10 8p ag i d10 8p nconf= 45 z= 47 ncores= 9 nvales= 1 ion= 0 r(i)/x(i)=0.24532669 ca1=0.700 tolstb=1.000 tolk-2=1.00000 tolend= 0.5E-07 thresh= 0.1E-10 kut= 0 exf=1.000 corrf=0.000 ca0= 0.500 rcn mod 32 ihf1= 0 mesh=2601 idb= 481 rdb= 100.461 emx= 0.10 r(mesh)=5426.209 irel= 1 ib=2600 t(run)= 13.73, t(job)= 774.67 seconds nl wnl ee az (r-3) (r-2) (r-1) (r+1) (r+2) (r+3) (r+4) (r+6) 1s 2. -1885.07213 881.507 0.000E+00 5.213E+03 4.936E+01 3.112E-02 1.308E-03 6.934E-05 4.438E-06 2.867E-08 2s 2. -280.34315 295.095 0.000E+00 5.731E+02 1.123E+01 1.350E-01 2.146E-02 3.880E-03 7.892E-04 4.505E-05 2p 6. -254.21079 3360.692 3.659E+03 1.600E+02 1.083E+01 1.175E-01 1.683E-02 2.853E-03 5.593E-04 3.126E-05 3s 2. -52.55936 127.553 0.000E+00 1.088E+02 3.931E+00 3.700E-01 1.565E-01 7.318E-02 3.748E-02 1.276E-02 3p 6. -43.44958 1500.439 6.406E+02 3.004E+01 3.735E+00 3.687E-01 1.577E-01 7.538E-02 3.987E-02 1.484E-02 3d 10. -29.20242 3211.672 9.185E+01 1.570E+01 3.533E+00 3.450E-01 1.415E-01 6.773E-02 3.720E-02 1.614E-02 4s 2. -8.21672 56.016 0.000E+00 2.149E+01 1.516E+00 9.139E-01 9.475E-01 1.082E+00 1.354E+00 2.767E+00 4p 6. -5.47558 619.971 1.071E+02 5.509E+00 1.356E+00 1.004E+00 1.156E+00 1.486E+00 2.119E+00 5.841E+00 4d 10. -1.51424 1036.446 8.402E+00 1.825E+00 9.715E-01 1.398E+00 2.376E+00 4.808E+00 1.146E+01 1.010E+02 8p 1. -0.04037 21.441 1.283E-01 9.440E-03 3.862E-02 3.631E+01 1.478E+03 6.408E+04 2.908E+06 6.734E+09 47. 1.318E+04 2.727E+02 6.558E+01 1.514E+03 6.414E+04 2.908E+06 6.734E+09 1. 2.804E+02 5.802E+00 1.395E+00 3.221E+01 1.365E+03 6.188E+04 1.433E+08 --------------------zeta--------------------- nl wnl ----blume-watson---- -----(r*vi)----- i (ryd) eps s evel edar evel+edar erel (ryd) (cm-1) (ryd) (cm-1) 1s 2. 0.00000 0.000 0.00000 0.000-2274.99730 -1876.80856 -398.58176 331.78498 -66.797 -1943.60534 2s 2. 0.00000 0.000 0.00000 0.000 -567.83949 -281.62818 -54.21010 36.23414 -17.976 -299.60413 2p 6. 8.55157 938426.465 8.80416 966144.517 -555.32083 -254.35808 -7.22339 -0.01376 -7.223 -261.58147 3s 2. 0.00000 0.000 0.00000 0.000 -234.94457 -54.16450 -10.56400 6.74663 -3.817 -57.98187 3p 6. 1.49473 164028.147 1.53292 168218.956 -227.34855 -45.01232 -1.64589 -0.00221 -1.646 -46.65820 3d 10. 0.17191 18864.989 0.18430 20224.052 -218.95191 -30.42828 -0.37676 -0.01081 -0.377 -30.80503 4s 2. 0.00000 0.000 0.00000 0.000 -108.22170 -8.97884 -2.06005 1.30046 -0.760 -9.73844 4p 6. 0.24967 27397.650 0.25575 28065.565 -99.37835 -6.19452 -0.29110 -0.00026 -0.291 -6.48562 4d 10. 0.01547 1697.733 0.01644 1804.447 -75.86263 -2.03864 -0.03954 -0.00095 -0.040 -2.07818 8p 1. 0.00030 32.730 0.00031 33.486 -3.55739 -0.03464 -0.00035 0.00000 0.000 -0.03499 ag i d10 8p nconf= 45 z= 47 ion= 0 kut=-1 exf=0.650 corrf=0.000 ca1=0.700 ca0=0.500 without correlation with correlation ----------------------- ----------------------- nl wnl eps fg eps fgr corr eps fg eps fgr n*r n*rc ect ec----------------- 1s 2. -1885.91777 -1885.91777-0.08290 -1886.00067 -1886.00067 0.0230 0.0230 -0.08267 0.00000-0.08267 2s 2. -284.69142 -284.69142-0.08232 -284.77374 -284.77374 0.0593 0.0593 -0.23110 -0.06744-0.08099 2p 6. -255.32626 -255.32626-0.08242 -255.40868 -255.40868 0.0626 0.0626 -0.72296 -0.08169-0.08186-0.08197-0.08206-0.08218 3s 2. -55.49827 -55.49827-0.08107 -55.57934 -55.57934 0.1342 0.1341 -0.86759 -0.06668-0.07795 3p 6. -45.54603 -45.54603-0.08107 -45.62710 -45.62710 0.1482 0.1480 -1.34526 -0.07880-0.07928-0.07960-0.07983-0.08015 3d 10. -29.75326 -29.75326-0.08120 -29.83446 -29.83446 0.1833 0.1831 -2.15235 -0.08039-0.08049-0.08057-0.08064-0.08095 4s 2. -9.24915 -9.24915-0.07796 -9.32711 -9.32711 0.3288 0.3274 -2.28891 -0.06401-0.07255 4p 6. -6.18531 -6.18531-0.07741 -6.26272 -6.26272 0.4021 0.3996 -2.73478 -0.07233-0.07355-0.07430-0.07484-0.07559 4d 10. -1.66063 -1.66063-0.07408 -1.73471 -1.73471 0.7760 0.7593 -3.45988 -0.06932-0.07096-0.07175-0.07230-0.07407 8p 1. -0.03924 -0.03924-0.00094 -0.04018 -0.04018 5.0482 4.9887 -3.46082 -0.00094 ecorrt= -3.64759 (old) ect= -3.46082 (new) etotrl= 0.00000 + 0.00000 + 0.00000 etot= -10621.61612 -10621.61612 -10625.26371 -10625.26371 -10625.07694 -10625.07694 -10625.07694 ag i d10 8p 2 -10625.0769 0 0.0327 2 t(run)= 18.13, t(job)= 779.07 seconds 47 1ag i d10 9p 4d10 9p ag i d10 9p nconf= 46 z= 47 ncores= 9 nvales= 1 ion= 0 r(i)/x(i)=0.24532669 ca1=0.700 tolstb=1.000 tolk-2=1.00000 tolend= 0.5E-07 thresh= 0.1E-10 kut= 0 exf=1.000 corrf=0.000 ca0= 0.500 rcn mod 32 ihf1= 0 mesh=2601 idb= 481 rdb= 100.461 emx= 0.10 r(mesh)=5426.209 irel= 1 ib=2600 t(run)= 13.42, t(job)= 792.49 seconds nl wnl ee az (r-3) (r-2) (r-1) (r+1) (r+2) (r+3) (r+4) (r+6) 1s 2. -1885.09434 881.507 0.000E+00 5.213E+03 4.936E+01 3.112E-02 1.308E-03 6.934E-05 4.438E-06 2.867E-08 2s 2. -280.36530 295.095 0.000E+00 5.731E+02 1.123E+01 1.350E-01 2.146E-02 3.880E-03 7.892E-04 4.505E-05 2p 6. -254.23295 3360.692 3.659E+03 1.600E+02 1.083E+01 1.175E-01 1.683E-02 2.853E-03 5.593E-04 3.126E-05 3s 2. -52.58153 127.553 0.000E+00 1.088E+02 3.931E+00 3.700E-01 1.565E-01 7.318E-02 3.748E-02 1.276E-02 3p 6. -43.47174 1500.439 6.406E+02 3.004E+01 3.735E+00 3.687E-01 1.577E-01 7.538E-02 3.987E-02 1.484E-02 3d 10. -29.22458 3211.671 9.185E+01 1.570E+01 3.533E+00 3.450E-01 1.415E-01 6.773E-02 3.720E-02 1.614E-02 4s 2. -8.23891 56.016 0.000E+00 2.149E+01 1.516E+00 9.139E-01 9.475E-01 1.082E+00 1.354E+00 2.767E+00 4p 6. -5.49777 619.969 1.071E+02 5.509E+00 1.356E+00 1.004E+00 1.156E+00 1.486E+00 2.119E+00 5.841E+00 4d 10. -1.53647 1036.502 8.403E+00 1.825E+00 9.715E-01 1.397E+00 2.376E+00 4.805E+00 1.145E+01 1.008E+02 9p 1. -0.02798 16.186 7.309E-02 5.390E-03 2.692E-02 5.274E+01 3.111E+03 1.946E+05 1.267E+07 5.924E+10 47. 1.318E+04 2.727E+02 8.200E+01 3.147E+03 1.946E+05 1.267E+07 5.924E+10 1. 2.804E+02 5.802E+00 1.745E+00 6.695E+01 4.141E+03 2.696E+05 1.261E+09 --------------------zeta--------------------- nl wnl ----blume-watson---- -----(r*vi)----- i (ryd) eps s evel edar evel+edar erel (ryd) (cm-1) (ryd) (cm-1) 1s 2. 0.00000 0.000 0.00000 0.000-2274.99730 -1876.83077 -398.58175 331.78495 -66.797 -1943.62757 2s 2. 0.00000 0.000 0.00000 0.000 -567.83950 -281.65033 -54.21010 36.23414 -17.976 -299.62629 2p 6. 8.55157 938426.598 8.80416 966144.658 -555.32083 -254.38024 -7.22339 -0.01376 -7.223 -261.60364 3s 2. 0.00000 0.000 0.00000 0.000 -234.94456 -54.18666 -10.56400 6.74663 -3.817 -58.00403 3p 6. 1.49473 164028.124 1.53292 168218.935 -227.34854 -45.03448 -1.64589 -0.00221 -1.646 -46.68037 3d 10. 0.17191 18864.982 0.18430 20224.044 -218.95190 -30.45044 -0.37676 -0.01081 -0.377 -30.82719 4s 2. 0.00000 0.000 0.00000 0.000 -108.22150 -9.00103 -2.06004 1.30045 -0.760 -9.76062 4p 6. 0.24966 27397.395 0.25575 28065.304 -99.37808 -6.21672 -0.29109 -0.00026 -0.291 -6.50781 4d 10. 0.01547 1697.915 0.01645 1804.641 -75.86688 -2.06085 -0.03954 -0.00095 -0.040 -2.10039 9p 1. 0.00017 18.651 0.00017 19.083 -2.48458 -0.02377 -0.00020 0.00000 0.000 -0.02397 ag i d10 9p nconf= 46 z= 47 ion= 0 kut=-1 exf=0.650 corrf=0.000 ca1=0.700 ca0=0.500 without correlation with correlation ----------------------- ----------------------- nl wnl eps fg eps fgr corr eps fg eps fgr n*r n*rc ect ec----------------- 1s 2. -1885.93997 -1885.93997-0.08290 -1886.02287 -1886.02287 0.0230 0.0230 -0.08267 0.00000-0.08267 2s 2. -284.71358 -284.71358-0.08232 -284.79590 -284.79590 0.0593 0.0593 -0.23110 -0.06744-0.08099 2p 6. -255.34842 -255.34842-0.08242 -255.43084 -255.43084 0.0626 0.0626 -0.72296 -0.08169-0.08186-0.08197-0.08206-0.08218 3s 2. -55.52043 -55.52043-0.08107 -55.60150 -55.60150 0.1342 0.1341 -0.86759 -0.06668-0.07795 3p 6. -45.56819 -45.56819-0.08107 -45.64925 -45.64925 0.1481 0.1480 -1.34526 -0.07880-0.07928-0.07960-0.07983-0.08015 3d 10. -29.77543 -29.77543-0.08120 -29.85662 -29.85662 0.1833 0.1830 -2.15235 -0.08039-0.08049-0.08057-0.08064-0.08095 4s 2. -9.27134 -9.27134-0.07796 -9.34930 -9.34930 0.3284 0.3270 -2.28891 -0.06401-0.07255 4p 6. -6.20752 -6.20752-0.07741 -6.28493 -6.28493 0.4014 0.3989 -2.73478 -0.07233-0.07355-0.07430-0.07484-0.07559 4d 10. -1.68290 -1.68290-0.07408 -1.75698 -1.75698 0.7709 0.7544 -3.45989 -0.06932-0.07096-0.07175-0.07230-0.07408 9p 1. -0.02732 -0.02732-0.00053 -0.02785 -0.02785 6.0501 5.9922 -3.46042 -0.00053 ecorrt= -3.64715 (old) ect= -3.46042 (new) etotrl= 0.00000 + 0.00000 + 0.00000 etot= -10621.60437 -10621.60437 -10625.25152 -10625.25152 -10625.06479 -10625.06479 -10625.06479 ag i d10 9p 2 -10625.0648 0 0.0187 2 t(run)= 17.91, t(job)= 796.98 seconds 47 1ag i d9 5s5p 4d9 5s 5p ag i d9 5s5p nconf= 47 z= 47 ncores=10 nvales= 1 ion= 0 r(i)/x(i)=0.24532669 ca1=0.700 tolstb=1.000 tolk-2=1.00000 tolend= 0.5E-07 thresh= 0.1E-10 kut= 0 exf=1.000 corrf=0.000 ca0= 0.500 rcn mod 32 ihf1= 0 mesh=2601 idb= 481 rdb= 100.461 emx= 0.10 r(mesh)=5426.209 irel= 1 ib=2600 t(run)= 13.13, t(job)= 810.11 seconds nl wnl ee az (r-3) (r-2) (r-1) (r+1) (r+2) (r+3) (r+4) (r+6) 1s 2. -1884.99022 881.506 0.000E+00 5.213E+03 4.936E+01 3.112E-02 1.308E-03 6.934E-05 4.438E-06 2.867E-08 2s 2. -280.28058 295.093 0.000E+00 5.731E+02 1.123E+01 1.350E-01 2.146E-02 3.880E-03 7.892E-04 4.505E-05 2p 6. -254.14655 3360.602 3.659E+03 1.600E+02 1.083E+01 1.175E-01 1.684E-02 2.853E-03 5.593E-04 3.126E-05 3s 2. -52.49082 127.558 0.000E+00 1.088E+02 3.931E+00 3.700E-01 1.565E-01 7.317E-02 3.748E-02 1.276E-02 3p 6. -43.38108 1500.503 6.406E+02 3.005E+01 3.735E+00 3.687E-01 1.577E-01 7.538E-02 3.986E-02 1.483E-02 3d 10. -29.13615 3212.035 9.187E+01 1.571E+01 3.533E+00 3.449E-01 1.415E-01 6.771E-02 3.719E-02 1.613E-02 4s 2. -8.12902 56.172 0.000E+00 2.160E+01 1.521E+00 9.113E-01 9.416E-01 1.071E+00 1.332E+00 2.682E+00 4p 6. -5.37818 623.401 1.083E+02 5.564E+00 1.363E+00 9.981E-01 1.142E+00 1.455E+00 2.052E+00 5.504E+00 4d 9. -1.38192 1070.914 8.950E+00 1.925E+00 1.001E+00 1.350E+00 2.201E+00 4.240E+00 9.580E+00 7.579E+01 5s 1. -0.74892 16.009 0.000E+00 1.863E+00 4.430E-01 2.888E+00 9.547E+00 3.552E+01 1.479E+02 3.515E+03 5p 1. -0.31266 121.293 4.106E+00 2.763E-01 2.973E-01 4.282E+00 2.157E+01 1.257E+02 8.384E+02 5.334E+04 47. 1.318E+04 2.728E+02 3.457E+01 6.247E+01 2.116E+02 1.088E+03 5.758E+04 1. 2.805E+02 5.803E+00 7.355E-01 1.329E+00 4.501E+00 2.315E+01 1.225E+03 --------------------zeta--------------------- nl wnl ----blume-watson---- -----(r*vi)----- i (ryd) eps s evel edar evel+edar erel (ryd) (cm-1) (ryd) (cm-1) 1s 2. 0.00000 0.000 0.00000 0.000-2274.99718 -1876.72660 -398.57963 331.78340 -66.796 -1943.52284 2s 2. 0.00000 0.000 0.00000 0.000 -567.83885 -281.56514 -54.20900 36.23353 -17.975 -299.54061 2p 6. 8.55120 938385.171 8.80375 966099.904 -555.31957 -254.29372 -7.22303 -0.01378 -7.223 -261.51675 3s 2. 0.00000 0.000 0.00000 0.000 -234.94732 -54.09637 -10.56478 6.74714 -3.818 -57.91401 3p 6. 1.49487 164043.283 1.53306 168233.739 -227.35209 -44.94422 -1.64604 -0.00221 -1.646 -46.59026 3d 10. 0.17195 18868.824 0.18433 20228.250 -218.96019 -30.36191 -0.37685 -0.01081 -0.377 -30.73875 4s 2. 0.00000 0.000 0.00000 0.000 -108.41124 -8.88653 -2.07154 1.30770 -0.764 -9.65037 4p 6. 0.25243 27700.797 0.25858 28376.197 -99.74282 -6.09318 -0.29434 -0.00026 -0.294 -6.38752 4d 9. 0.01650 1811.178 0.01754 1924.761 -77.71769 -1.91795 -0.04221 -0.00101 -0.042 -1.96017 5s 1. 0.00000 0.000 0.00000 0.000 -38.10738 -0.82113 -0.16859 0.10621 -0.062 -0.88350 5p 1. 0.00954 1047.050 0.00977 1071.608 -26.46099 -0.33178 -0.01120 -0.00001 -0.011 -0.34298 ag i d9 5s5p nconf= 47 z= 47 ion= 0 kut=-1 exf=0.650 corrf=0.000 ca1=0.700 ca0=0.500 without correlation with correlation ----------------------- ----------------------- nl wnl eps fg eps fgr corr eps fg eps fgr n*r n*rc ect ec----------------- 1s 2. -1885.83714 -1885.83714-0.08290 -1885.92004 -1885.92004 0.0230 0.0230 -0.08267 0.00000-0.08267 2s 2. -284.62995 -284.62995-0.08232 -284.71227 -284.71227 0.0593 0.0593 -0.23110 -0.06744-0.08099 2p 6. -255.26133 -255.26133-0.08242 -255.34374 -255.34374 0.0626 0.0626 -0.72296 -0.08169-0.08186-0.08197-0.08206-0.08218 3s 2. -55.43582 -55.43582-0.08107 -55.51688 -55.51688 0.1343 0.1342 -0.86760 -0.06668-0.07795 3p 6. -45.48033 -45.48033-0.08107 -45.56140 -45.56140 0.1483 0.1481 -1.34526 -0.07880-0.07928-0.07960-0.07983-0.08015 3d 10. -29.68338 -29.68338-0.08120 -29.76457 -29.76457 0.1835 0.1833 -2.15235 -0.08039-0.08049-0.08057-0.08064-0.08095 4s 2. -9.15643 -9.15643-0.07794 -9.23437 -9.23437 0.3305 0.3291 -2.28909 -0.06414-0.07260 4p 6. -6.05747 -6.05747-0.07741 -6.13488 -6.13488 0.4063 0.4037 -2.73539 -0.07242-0.07363-0.07437-0.07491-0.07565 4d 9. -1.53283 -1.53283-0.07475 -1.60757 -1.60757 0.8077 0.7887 -3.39083 -0.07015-0.07154-0.07226-0.07277-0.07424 5s 1. -0.71238 -0.71238-0.06036 -0.77274 -0.77274 1.1848 1.1376 -3.44620 -0.05537 5p 1. -0.30895 -0.30895-0.04582 -0.35477 -0.35477 1.7991 1.6789 -3.49203 -0.04582 ecorrt= -3.68470 (old) ect= -3.49203 (new) etotrl= 0.00000 + 0.00000 + 0.00000 etot= -10621.53476 -10621.53476 -10625.21945 -10625.21945 -10625.02678 -10625.02678 -10625.02678 ag i d9 5s5p 8 -10625.0268 0 1.8112 2 1.0471 2 13.1786 3 12.9973 4 4.8661 4 3.9278 4 31.0745 4 t(run)= 17.95, t(job)= 814.93 seconds 47 1ag i d9 5s6p 4d9 5s 6p ag i d9 5s6p nconf= 48 z= 47 ncores=10 nvales= 1 ion= 0 r(i)/x(i)=0.24532669 ca1=0.700 tolstb=1.000 tolk-2=1.00000 tolend= 0.5E-07 thresh= 0.1E-10 kut= 0 exf=1.000 corrf=0.000 ca0= 0.500 rcn mod 32 ihf1= 0 mesh=2601 idb= 481 rdb= 100.461 emx= 0.10 r(mesh)=5426.209 irel= 1 ib=2600 t(run)= 12.89, t(job)= 827.82 seconds nl wnl ee az (r-3) (r-2) (r-1) (r+1) (r+2) (r+3) (r+4) (r+6) 1s 2. -1885.27906 881.505 0.000E+00 5.213E+03 4.936E+01 3.112E-02 1.308E-03 6.934E-05 4.438E-06 2.867E-08 2s 2. -280.56714 295.093 0.000E+00 5.731E+02 1.123E+01 1.350E-01 2.146E-02 3.880E-03 7.892E-04 4.505E-05 2p 6. -254.43340 3360.613 3.659E+03 1.600E+02 1.083E+01 1.175E-01 1.684E-02 2.853E-03 5.593E-04 3.126E-05 3s 2. -52.77758 127.558 0.000E+00 1.088E+02 3.931E+00 3.700E-01 1.565E-01 7.317E-02 3.748E-02 1.276E-02 3p 6. -43.66786 1500.501 6.406E+02 3.005E+01 3.735E+00 3.687E-01 1.577E-01 7.538E-02 3.986E-02 1.483E-02 3d 10. -29.42273 3212.019 9.187E+01 1.571E+01 3.533E+00 3.449E-01 1.415E-01 6.771E-02 3.719E-02 1.613E-02 4s 2. -8.41632 56.167 0.000E+00 2.160E+01 1.520E+00 9.114E-01 9.417E-01 1.071E+00 1.333E+00 2.683E+00 4p 6. -5.66578 623.315 1.083E+02 5.563E+00 1.363E+00 9.982E-01 1.142E+00 1.455E+00 2.052E+00 5.499E+00 4d 9. -1.67039 1073.129 8.986E+00 1.933E+00 1.003E+00 1.344E+00 2.174E+00 4.139E+00 9.186E+00 6.876E+01 5s 1. -1.00286 17.003 0.000E+00 2.091E+00 4.650E-01 2.748E+00 8.566E+00 2.976E+01 1.146E+02 2.273E+03 6p 1. -0.12066 49.097 6.725E-01 4.847E-02 1.101E-01 1.178E+01 1.565E+02 2.271E+03 3.570E+04 1.103E+07 47. 1.318E+04 2.726E+02 4.187E+01 1.962E+02 2.350E+03 3.592E+04 1.103E+07 1. 2.805E+02 5.800E+00 8.909E-01 4.173E+00 5.001E+01 7.642E+02 2.347E+05 --------------------zeta--------------------- nl wnl ----blume-watson---- -----(r*vi)----- i (ryd) eps s evel edar evel+edar erel (ryd) (cm-1) (ryd) (cm-1) 1s 2. 0.00000 0.000 0.00000 0.000-2274.99713 -1877.01539 -398.57967 331.78306 -66.797 -1943.81200 2s 2. 0.00000 0.000 0.00000 0.000 -567.83895 -281.85176 -54.20914 36.23357 -17.976 -299.82734 2p 6. 8.55125 938391.048 8.80381 966105.996 -555.31976 -254.58056 -7.22308 -0.01377 -7.223 -261.80364 3s 2. 0.00000 0.000 0.00000 0.000 -234.94723 -54.38310 -10.56476 6.74711 -3.818 -58.20074 3p 6. 1.49487 164042.886 1.53306 168233.365 -227.35200 -45.23097 -1.64603 -0.00221 -1.646 -46.87700 3d 10. 0.17194 18868.628 0.18433 20228.038 -218.95976 -30.64850 -0.37684 -0.01081 -0.377 -31.02534 4s 2. 0.00000 0.000 0.00000 0.000 -108.40549 -9.17397 -2.07118 1.30747 -0.764 -9.93768 4p 6. 0.25236 27693.188 0.25851 28368.417 -99.73494 -6.38085 -0.29426 -0.00026 -0.294 -6.67511 4d 9. 0.01657 1818.627 0.01761 1932.689 -77.88431 -2.20587 -0.04239 -0.00102 -0.042 -2.24826 5s 1. 0.00000 0.000 0.00000 0.000 -39.72136 -1.07129 -0.19018 0.11981 -0.070 -1.14166 6p 1. 0.00156 171.575 0.00160 175.557 -10.05573 -0.10808 -0.00184 0.00000 -0.002 -0.10991 ag i d9 5s6p nconf= 48 z= 47 ion= 0 kut=-1 exf=0.650 corrf=0.000 ca1=0.700 ca0=0.500 without correlation with correlation ----------------------- ----------------------- nl wnl eps fg eps fgr corr eps fg eps fgr n*r n*rc ect ec----------------- 1s 2. -1886.12591 -1886.12591-0.08290 -1886.20881 -1886.20881 0.0230 0.0230 -0.08267 0.00000-0.08267 2s 2. -284.91687 -284.91687-0.08232 -284.99919 -284.99919 0.0592 0.0592 -0.23110 -0.06744-0.08099 2p 6. -255.54812 -255.54812-0.08242 -255.63054 -255.63054 0.0626 0.0625 -0.72296 -0.08169-0.08186-0.08197-0.08206-0.08218 3s 2. -55.72273 -55.72273-0.08107 -55.80380 -55.80380 0.1340 0.1339 -0.86760 -0.06668-0.07795 3p 6. -45.76660 -45.76660-0.08107 -45.84766 -45.84766 0.1478 0.1477 -1.34526 -0.07880-0.07928-0.07960-0.07983-0.08015 3d 10. -29.97020 -29.97020-0.08120 -30.05140 -30.05140 0.1827 0.1824 -2.15235 -0.08039-0.08049-0.08057-0.08064-0.08095 4s 2. -9.44452 -9.44452-0.07794 -9.52246 -9.52246 0.3254 0.3241 -2.28909 -0.06414-0.07260 4p 6. -6.34501 -6.34501-0.07740 -6.42242 -6.42242 0.3970 0.3946 -2.73538 -0.07242-0.07363-0.07437-0.07491-0.07565 4d 9. -1.82230 -1.82230-0.07470 -1.89699 -1.89699 0.7408 0.7261 -3.39151 -0.07028-0.07163-0.07234-0.07284-0.07430 5s 1. -0.95433 -0.95433-0.05787 -1.01220 -1.01220 1.0236 0.9940 -3.44865 -0.05714 6p 1. -0.11702 -0.11702-0.00667 -0.12369 -0.12369 2.9233 2.8434 -3.45532 -0.00667 ecorrt= -3.64258 (old) ect= -3.45532 (new) etotrl= 0.00000 + 0.00000 + 0.00000 etot= -10621.35188 -10621.35188 -10624.99445 -10624.99445 -10624.80720 -10624.80720 -10624.80720 ag i d9 5s6p 8 -10624.8072 0 1.8186 2 0.1716 2 2.0238 3 14.0878 4 0.6813 4 0.5760 4 3.1039 4 t(run)= 17.83, t(job)= 832.76 seconds 47 1ag i d9 5s7p 4d9 5s 7p ag i d9 5s7p nconf= 49 z= 47 ncores=10 nvales= 1 ion= 0 r(i)/x(i)=0.24532669 ca1=0.700 tolstb=1.000 tolk-2=1.00000 tolend= 0.5E-07 thresh= 0.1E-10 kut= 0 exf=1.000 corrf=0.000 ca0= 0.500 rcn mod 32 ihf1= 0 mesh=2601 idb= 481 rdb= 100.461 emx= 0.10 r(mesh)=5426.209 irel= 1 ib=2600 t(run)= 11.98, t(job)= 844.73 seconds nl wnl ee az (r-3) (r-2) (r-1) (r+1) (r+2) (r+3) (r+4) (r+6) 1s 2. -1885.36824 881.505 0.000E+00 5.213E+03 4.936E+01 3.112E-02 1.308E-03 6.934E-05 4.438E-06 2.867E-08 2s 2. -280.65601 295.093 0.000E+00 5.731E+02 1.123E+01 1.350E-01 2.146E-02 3.880E-03 7.892E-04 4.505E-05 2p 6. -254.52231 3360.614 3.659E+03 1.600E+02 1.083E+01 1.175E-01 1.684E-02 2.853E-03 5.593E-04 3.126E-05 3s 2. -52.86647 127.558 0.000E+00 1.088E+02 3.931E+00 3.700E-01 1.565E-01 7.317E-02 3.748E-02 1.276E-02 3p 6. -43.75675 1500.501 6.406E+02 3.005E+01 3.735E+00 3.687E-01 1.577E-01 7.538E-02 3.986E-02 1.483E-02 3d 10. -29.51160 3212.018 9.187E+01 1.571E+01 3.533E+00 3.449E-01 1.415E-01 6.771E-02 3.719E-02 1.613E-02 4s 2. -8.50521 56.166 0.000E+00 2.160E+01 1.520E+00 9.114E-01 9.418E-01 1.071E+00 1.333E+00 2.683E+00 4p 6. -5.75469 623.309 1.083E+02 5.563E+00 1.363E+00 9.982E-01 1.142E+00 1.455E+00 2.052E+00 5.497E+00 4d 9. -1.75933 1073.418 8.991E+00 1.933E+00 1.004E+00 1.343E+00 2.172E+00 4.129E+00 9.148E+00 6.816E+01 5s 1. -1.08809 17.078 0.000E+00 2.109E+00 4.666E-01 2.739E+00 8.505E+00 2.942E+01 1.127E+02 2.206E+03 7p 1. -0.06584 30.563 2.605E-01 1.894E-02 6.122E-02 2.204E+01 5.457E+02 1.451E+04 4.082E+05 3.771E+08 47. 1.318E+04 2.726E+02 5.212E+01 5.853E+02 1.458E+04 4.084E+05 3.771E+08 1. 2.805E+02 5.799E+00 1.109E+00 1.245E+01 3.103E+02 8.689E+03 8.024E+06 --------------------zeta--------------------- nl wnl ----blume-watson---- -----(r*vi)----- i (ryd) eps s evel edar evel+edar erel (ryd) (cm-1) (ryd) (cm-1) 1s 2. 0.00000 0.000 0.00000 0.000-2274.99711 -1877.10455 -398.57966 331.78294 -66.797 -1943.90128 2s 2. 0.00000 0.000 0.00000 0.000 -567.83896 -281.94065 -54.20916 36.23356 -17.976 -299.91624 2p 6. 8.55126 938391.831 8.80381 966106.813 -555.31979 -254.66948 -7.22308 -0.01377 -7.223 -261.89256 3s 2. 0.00000 0.000 0.00000 0.000 -234.94723 -54.47198 -10.56476 6.74711 -3.818 -58.28963 3p 6. 1.49487 164042.909 1.53306 168233.395 -227.35201 -45.31985 -1.64604 -0.00221 -1.646 -46.96589 3d 10. 0.17194 18868.615 0.18433 20228.024 -218.95974 -30.73737 -0.37684 -0.01081 -0.377 -31.11421 4s 2. 0.00000 0.000 0.00000 0.000 -108.40506 -9.26288 -2.07115 1.30746 -0.764 -10.02658 4p 6. 0.25235 27692.703 0.25851 28367.922 -99.73453 -6.46976 -0.29426 -0.00026 -0.294 -6.76402 4d 9. 0.01658 1819.596 0.01762 1933.721 -77.90462 -2.29476 -0.04241 -0.00102 -0.042 -2.33717 5s 1. 0.00000 0.000 0.00000 0.000 -39.83525 -1.15612 -0.19186 0.12087 -0.071 -1.22711 7p 1. 0.00061 66.481 0.00062 68.025 -5.62383 -0.05728 -0.00071 0.00000 -0.001 -0.05800 ag i d9 5s7p nconf= 49 z= 47 ion= 0 kut=-1 exf=0.650 corrf=0.000 ca1=0.700 ca0=0.500 without correlation with correlation ----------------------- ----------------------- nl wnl eps fg eps fgr corr eps fg eps fgr n*r n*rc ect ec----------------- 1s 2. -1886.21507 -1886.21507-0.08290 -1886.29798 -1886.29798 0.0230 0.0230 -0.08267 0.00000-0.08267 2s 2. -285.00578 -285.00578-0.08232 -285.08810 -285.08810 0.0592 0.0592 -0.23110 -0.06744-0.08099 2p 6. -255.63703 -255.63703-0.08242 -255.71945 -255.71945 0.0625 0.0625 -0.72296 -0.08169-0.08186-0.08197-0.08206-0.08218 3s 2. -55.81161 -55.81161-0.08107 -55.89268 -55.89268 0.1339 0.1338 -0.86760 -0.06668-0.07795 3p 6. -45.85542 -45.85542-0.08107 -45.93649 -45.93649 0.1477 0.1475 -1.34526 -0.07880-0.07928-0.07960-0.07983-0.08015 3d 10. -30.05910 -30.05910-0.08120 -30.14029 -30.14029 0.1824 0.1821 -2.15235 -0.08039-0.08049-0.08057-0.08064-0.08095 4s 2. -9.53346 -9.53346-0.07794 -9.61140 -9.61140 0.3239 0.3226 -2.28909 -0.06414-0.07260 4p 6. -6.43391 -6.43391-0.07740 -6.51132 -6.51132 0.3942 0.3919 -2.73538 -0.07242-0.07363-0.07437-0.07491-0.07565 4d 9. -1.91138 -1.91138-0.07469 -1.98607 -1.98607 0.7233 0.7096 -3.39159 -0.07030-0.07164-0.07234-0.07285-0.07431 5s 1. -1.03904 -1.03904-0.05758 -1.09662 -1.09662 0.9810 0.9549 -3.44883 -0.05724 7p 1. -0.06432 -0.06432-0.00237 -0.06669 -0.06669 3.9430 3.8724 -3.45120 -0.00237 ecorrt= -3.63793 (old) ect= -3.45120 (new) etotrl= 0.00000 + 0.00000 + 0.00000 etot= -10621.29973 -10621.29973 -10624.93766 -10624.93766 -10624.75093 -10624.75093 -10624.75093 ag i d9 5s7p 8 -10624.7509 0 1.8196 2 0.0665 2 0.7484 3 14.1604 4 0.2544 4 0.2174 4 1.0750 4 t(run)= 17.34, t(job)= 850.10 seconds 47 1ag i d9 5s8p 4d9 5s 8p ag i d9 5s8p nconf= 50 z= 47 ncores=10 nvales= 1 ion= 0 r(i)/x(i)=0.24532669 ca1=0.700 tolstb=1.000 tolk-2=1.00000 tolend= 0.5E-07 thresh= 0.1E-10 kut= 0 exf=1.000 corrf=0.000 ca0= 0.500 rcn mod 32 ihf1= 0 mesh=2601 idb= 481 rdb= 100.461 emx= 0.10 r(mesh)=5426.209 irel= 1 ib=2600 t(run)= 11.00, t(job)= 861.10 seconds nl wnl ee az (r-3) (r-2) (r-1) (r+1) (r+2) (r+3) (r+4) (r+6) 1s 2. -1885.40966 881.504 0.000E+00 5.213E+03 4.936E+01 3.112E-02 1.308E-03 6.934E-05 4.438E-06 2.867E-08 2s 2. -280.69734 295.093 0.000E+00 5.731E+02 1.123E+01 1.350E-01 2.146E-02 3.880E-03 7.892E-04 4.505E-05 2p 6. -254.56365 3360.614 3.659E+03 1.600E+02 1.083E+01 1.175E-01 1.684E-02 2.853E-03 5.593E-04 3.126E-05 3s 2. -52.90779 127.558 0.000E+00 1.088E+02 3.931E+00 3.700E-01 1.565E-01 7.317E-02 3.748E-02 1.276E-02 3p 6. -43.79808 1500.501 6.406E+02 3.005E+01 3.735E+00 3.687E-01 1.577E-01 7.538E-02 3.986E-02 1.483E-02 3d 10. -29.55292 3212.018 9.187E+01 1.571E+01 3.533E+00 3.449E-01 1.415E-01 6.771E-02 3.719E-02 1.613E-02 4s 2. -8.54653 56.166 0.000E+00 2.160E+01 1.520E+00 9.114E-01 9.418E-01 1.071E+00 1.333E+00 2.683E+00 4p 6. -5.79602 623.308 1.083E+02 5.563E+00 1.363E+00 9.982E-01 1.142E+00 1.455E+00 2.052E+00 5.497E+00 4d 9. -1.80066 1073.510 8.992E+00 1.934E+00 1.004E+00 1.343E+00 2.171E+00 4.126E+00 9.137E+00 6.798E+01 5s 1. -1.12831 17.099 0.000E+00 2.114E+00 4.671E-01 2.736E+00 8.488E+00 2.932E+01 1.121E+02 2.186E+03 8p 1. -0.04158 21.522 1.292E-01 9.421E-03 3.920E-02 3.528E+01 1.394E+03 5.868E+04 2.587E+06 5.663E+09 47. 1.318E+04 2.725E+02 6.535E+01 1.434E+03 5.875E+04 2.587E+06 5.663E+09 1. 2.805E+02 5.799E+00 1.390E+00 3.051E+01 1.250E+03 5.504E+04 1.205E+08 --------------------zeta--------------------- nl wnl ----blume-watson---- -----(r*vi)----- i (ryd) eps s evel edar evel+edar erel (ryd) (cm-1) (ryd) (cm-1) 1s 2. 0.00000 0.000 0.00000 0.000-2274.99710 -1877.14597 -398.57965 331.78287 -66.797 -1943.94275 2s 2. 0.00000 0.000 0.00000 0.000 -567.83896 -281.98198 -54.20917 36.23356 -17.976 -299.95758 2p 6. 8.55126 938392.084 8.80382 966107.078 -555.31980 -254.71082 -7.22309 -0.01377 -7.223 -261.93390 3s 2. 0.00000 0.000 0.00000 0.000 -234.94724 -54.51331 -10.56476 6.74711 -3.818 -58.33096 3p 6. 1.49487 164042.925 1.53306 168233.413 -227.35201 -45.36118 -1.64604 -0.00221 -1.646 -47.00721 3d 10. 0.17194 18868.613 0.18433 20228.022 -218.95974 -30.77869 -0.37684 -0.01081 -0.377 -31.15553 4s 2. 0.00000 0.000 0.00000 0.000 -108.40494 -9.30421 -2.07115 1.30745 -0.764 -10.06790 4p 6. 0.25235 27692.593 0.25851 28367.809 -99.73445 -6.51109 -0.29426 -0.00026 -0.294 -6.80535 4d 9. 0.01658 1819.904 0.01762 1934.049 -77.91097 -2.33608 -0.04242 -0.00102 -0.042 -2.37850 5s 1. 0.00000 0.000 0.00000 0.000 -39.86828 -1.19617 -0.19235 0.12117 -0.071 -1.26734 8p 1. 0.00030 32.966 0.00031 33.732 -3.61067 -0.03568 -0.00035 0.00000 0.000 -0.03604 ag i d9 5s8p nconf= 50 z= 47 ion= 0 kut=-1 exf=0.650 corrf=0.000 ca1=0.700 ca0=0.500 without correlation with correlation ----------------------- ----------------------- nl wnl eps fg eps fgr corr eps fg eps fgr n*r n*rc ect ec----------------- 1s 2. -1886.25649 -1886.25649-0.08290 -1886.33939 -1886.33939 0.0230 0.0230 -0.08267 0.00000-0.08267 2s 2. -285.04712 -285.04712-0.08232 -285.12944 -285.12944 0.0592 0.0592 -0.23110 -0.06744-0.08099 2p 6. -255.67837 -255.67837-0.08242 -255.76079 -255.76079 0.0625 0.0625 -0.72296 -0.08169-0.08186-0.08197-0.08206-0.08218 3s 2. -55.85294 -55.85294-0.08107 -55.93400 -55.93400 0.1338 0.1337 -0.86760 -0.06668-0.07795 3p 6. -45.89673 -45.89673-0.08107 -45.97780 -45.97780 0.1476 0.1475 -1.34526 -0.07880-0.07928-0.07960-0.07983-0.08015 3d 10. -30.10043 -30.10043-0.08120 -30.18163 -30.18163 0.1823 0.1820 -2.15235 -0.08039-0.08049-0.08057-0.08064-0.08095 4s 2. -9.57479 -9.57479-0.07794 -9.65273 -9.65273 0.3232 0.3219 -2.28909 -0.06414-0.07260 4p 6. -6.47524 -6.47524-0.07740 -6.55264 -6.55264 0.3930 0.3907 -2.73538 -0.07242-0.07363-0.07437-0.07491-0.07565 4d 9. -1.95275 -1.95275-0.07469 -2.02744 -2.02744 0.7156 0.7023 -3.39161 -0.07030-0.07165-0.07235-0.07285-0.07431 5s 1. -1.07912 -1.07912-0.05748 -1.13660 -1.13660 0.9626 0.9380 -3.44889 -0.05727 8p 1. -0.04079 -0.04079-0.00114 -0.04193 -0.04193 4.9512 4.8835 -3.45003 -0.00114 ecorrt= -3.63659 (old) ect= -3.45003 (new) etotrl= 0.00000 + 0.00000 + 0.00000 etot= -10621.27637 -10621.27637 -10624.91296 -10624.91296 -10624.72640 -10624.72640 -10624.72640 ag i d9 5s8p 8 -10624.7264 0 1.8199 2 0.0330 2 0.3626 3 14.1810 4 0.1241 4 0.1066 4 0.5077 4 t(run)= 16.69, t(job)= 866.79 seconds 47 1ag i d9 5s9p 4d9 5s 9p ag i d9 5s9p nconf= 51 z= 47 ncores=10 nvales= 1 ion= 0 r(i)/x(i)=0.24532669 ca1=0.700 tolstb=1.000 tolk-2=1.00000 tolend= 0.5E-07 thresh= 0.1E-10 kut= 0 exf=1.000 corrf=0.000 ca0= 0.500 rcn mod 32 ihf1= 0 mesh=2601 idb= 481 rdb= 100.461 emx= 0.10 r(mesh)=5426.209 irel= 1 ib=2600 t(run)= 10.49, t(job)= 877.28 seconds nl wnl ee az (r-3) (r-2) (r-1) (r+1) (r+2) (r+3) (r+4) (r+6) 1s 2. -1885.43240 881.504 0.000E+00 5.213E+03 4.936E+01 3.112E-02 1.308E-03 6.934E-05 4.438E-06 2.867E-08 2s 2. -280.72005 295.093 0.000E+00 5.731E+02 1.123E+01 1.350E-01 2.146E-02 3.880E-03 7.892E-04 4.505E-05 2p 6. -254.58636 3360.614 3.659E+03 1.600E+02 1.083E+01 1.175E-01 1.684E-02 2.853E-03 5.593E-04 3.126E-05 3s 2. -52.93050 127.558 0.000E+00 1.088E+02 3.931E+00 3.700E-01 1.565E-01 7.317E-02 3.748E-02 1.276E-02 3p 6. -43.82079 1500.501 6.406E+02 3.005E+01 3.735E+00 3.687E-01 1.577E-01 7.538E-02 3.986E-02 1.483E-02 3d 10. -29.57563 3212.018 9.187E+01 1.571E+01 3.533E+00 3.449E-01 1.415E-01 6.771E-02 3.719E-02 1.613E-02 4s 2. -8.56923 56.166 0.000E+00 2.160E+01 1.520E+00 9.114E-01 9.418E-01 1.071E+00 1.333E+00 2.683E+00 4p 6. -5.81872 623.308 1.083E+02 5.563E+00 1.363E+00 9.982E-01 1.142E+00 1.455E+00 2.052E+00 5.497E+00 4d 9. -1.82337 1073.549 8.993E+00 1.934E+00 1.004E+00 1.343E+00 2.170E+00 4.124E+00 9.132E+00 6.790E+01 5s 1. -1.15055 17.108 0.000E+00 2.116E+00 4.673E-01 2.735E+00 8.481E+00 2.928E+01 1.119E+02 2.178E+03 9p 1. -0.02866 16.238 7.351E-02 5.370E-03 2.727E-02 5.151E+01 2.966E+03 1.811E+05 1.152E+07 5.143E+10 47. 1.318E+04 2.725E+02 8.158E+01 3.006E+03 1.812E+05 1.152E+07 5.143E+10 1. 2.805E+02 5.799E+00 1.736E+00 6.396E+01 3.855E+03 2.451E+05 1.094E+09 --------------------zeta--------------------- nl wnl ----blume-watson---- -----(r*vi)----- i (ryd) eps s evel edar evel+edar erel (ryd) (cm-1) (ryd) (cm-1) 1s 2. 0.00000 0.000 0.00000 0.000-2274.99710 -1877.16872 -398.57964 331.78284 -66.797 -1943.96552 2s 2. 0.00000 0.000 0.00000 0.000 -567.83896 -282.00468 -54.20917 36.23356 -17.976 -299.98029 2p 6. 8.55126 938392.192 8.80382 966107.191 -555.31980 -254.73353 -7.22309 -0.01377 -7.223 -261.95662 3s 2. 0.00000 0.000 0.00000 0.000 -234.94724 -54.53601 -10.56476 6.74711 -3.818 -58.35366 3p 6. 1.49487 164042.933 1.53306 168233.422 -227.35202 -45.38388 -1.64604 -0.00221 -1.646 -47.02992 3d 10. 0.17194 18868.612 0.18433 20228.021 -218.95974 -30.80139 -0.37684 -0.01081 -0.377 -31.17823 4s 2. 0.00000 0.000 0.00000 0.000 -108.40490 -9.32691 -2.07114 1.30745 -0.764 -10.09060 4p 6. 0.25235 27692.554 0.25851 28367.770 -99.73443 -6.53380 -0.29426 -0.00026 -0.294 -6.82805 4d 9. 0.01659 1820.035 0.01763 1934.188 -77.91364 -2.35878 -0.04242 -0.00102 -0.042 -2.40120 5s 1. 0.00000 0.000 0.00000 0.000 -39.88163 -1.21831 -0.19255 0.12130 -0.071 -1.28956 9p 1. 0.00017 18.765 0.00017 19.201 -2.51692 -0.02438 -0.00020 0.00000 0.000 -0.02458 ag i d9 5s9p nconf= 51 z= 47 ion= 0 kut=-1 exf=0.650 corrf=0.000 ca1=0.700 ca0=0.500 without correlation with correlation ----------------------- ----------------------- nl wnl eps fg eps fgr corr eps fg eps fgr n*r n*rc ect ec----------------- 1s 2. -1886.27923 -1886.27923-0.08290 -1886.36213 -1886.36213 0.0230 0.0230 -0.08267 0.00000-0.08267 2s 2. -285.06983 -285.06983-0.08232 -285.15215 -285.15215 0.0592 0.0592 -0.23110 -0.06744-0.08099 2p 6. -255.70108 -255.70108-0.08242 -255.78350 -255.78350 0.0625 0.0625 -0.72296 -0.08169-0.08186-0.08197-0.08206-0.08218 3s 2. -55.87564 -55.87564-0.08107 -55.95671 -55.95671 0.1338 0.1337 -0.86760 -0.06668-0.07795 3p 6. -45.91943 -45.91943-0.08107 -46.00049 -46.00049 0.1476 0.1474 -1.34526 -0.07880-0.07928-0.07960-0.07983-0.08015 3d 10. -30.12313 -30.12313-0.08120 -30.20433 -30.20433 0.1822 0.1820 -2.15235 -0.08039-0.08049-0.08057-0.08064-0.08095 4s 2. -9.59750 -9.59750-0.07794 -9.67544 -9.67544 0.3228 0.3215 -2.28909 -0.06414-0.07260 4p 6. -6.49794 -6.49794-0.07740 -6.57534 -6.57534 0.3923 0.3900 -2.73538 -0.07242-0.07363-0.07437-0.07491-0.07565 4d 9. -1.97547 -1.97547-0.07469 -2.05016 -2.05016 0.7115 0.6984 -3.39162 -0.07030-0.07165-0.07235-0.07285-0.07431 5s 1. -1.10131 -1.10131-0.05743 -1.15874 -1.15874 0.9529 0.9290 -3.44891 -0.05728 9p 1. -0.02819 -0.02819-0.00064 -0.02883 -0.02883 5.9555 5.8891 -3.44955 -0.00064 ecorrt= -3.63603 (old) ect= -3.44955 (new) etotrl= 0.00000 + 0.00000 + 0.00000 etot= -10621.26384 -10621.26384 -10624.89987 -10624.89987 -10624.71339 -10624.71339 -10624.71339 ag i d9 5s9p 8 -10624.7134 0 1.8200 2 0.0188 2 0.2037 3 14.1893 4 0.0700 4 0.0603 4 0.2814 4 t(run)= 15.66, t(job)= 882.45 seconds 47 1ag i d8 5s2 5p 4d8 5s2 5p ag i d8 5s2 5p nconf= 52 z= 47 ncores=10 nvales= 1 ion= 0 r(i)/x(i)=0.24532669 ca1=0.700 tolstb=1.000 tolk-2=1.00000 tolend= 0.5E-07 thresh= 0.1E-10 kut= 0 exf=1.000 corrf=0.000 ca0= 0.500 rcn mod 32 ihf1= 0 mesh=2601 idb= 481 rdb= 100.461 emx= 0.10 r(mesh)=5426.209 irel= 1 ib=2600 t(run)= 11.80, t(job)= 894.26 seconds nl wnl ee az (r-3) (r-2) (r-1) (r+1) (r+2) (r+3) (r+4) (r+6) 1s 2. -1885.33294 881.502 0.000E+00 5.213E+03 4.936E+01 3.112E-02 1.308E-03 6.934E-05 4.438E-06 2.867E-08 2s 2. -280.64380 295.090 0.000E+00 5.731E+02 1.123E+01 1.350E-01 2.146E-02 3.880E-03 7.892E-04 4.505E-05 2p 6. -254.50820 3360.510 3.659E+03 1.600E+02 1.083E+01 1.175E-01 1.684E-02 2.853E-03 5.594E-04 3.126E-05 3s 2. -52.84427 127.566 0.000E+00 1.088E+02 3.931E+00 3.699E-01 1.565E-01 7.316E-02 3.747E-02 1.276E-02 3p 6. -43.73464 1500.622 6.407E+02 3.005E+01 3.736E+00 3.687E-01 1.577E-01 7.536E-02 3.985E-02 1.483E-02 3d 10. -29.49255 3212.634 9.190E+01 1.571E+01 3.534E+00 3.449E-01 1.415E-01 6.767E-02 3.716E-02 1.611E-02 4s 2. -8.45352 56.362 0.000E+00 2.174E+01 1.526E+00 9.084E-01 9.348E-01 1.058E+00 1.308E+00 2.590E+00 4p 6. -5.69129 627.380 1.097E+02 5.628E+00 1.372E+00 9.919E-01 1.126E+00 1.421E+00 1.981E+00 5.152E+00 4d 8. -1.65690 1108.204 9.559E+00 2.037E+00 1.033E+00 1.300E+00 2.021E+00 3.671E+00 7.734E+00 5.190E+01 5s 2. -0.77658 17.163 0.000E+00 2.127E+00 4.652E-01 2.774E+00 8.820E+00 3.159E+01 1.267E+02 2.813E+03 5p 1. -0.36477 139.600 5.435E+00 3.517E-01 3.291E-01 3.877E+00 1.757E+01 9.164E+01 5.458E+02 2.775E+04 47. 1.318E+04 2.726E+02 3.503E+01 6.282E+01 1.961E+02 8.764E+02 3.383E+04 1. 2.805E+02 5.800E+00 7.454E-01 1.337E+00 4.173E+00 1.865E+01 7.198E+02 --------------------zeta--------------------- nl wnl ----blume-watson---- -----(r*vi)----- i (ryd) eps s evel edar evel+edar erel (ryd) (cm-1) (ryd) (cm-1) 1s 2. 0.00000 0.000 0.00000 0.000-2274.99695 -1877.06921 -398.57705 331.78091 -66.796 -1943.86535 2s 2. 0.00000 0.000 0.00000 0.000 -567.83833 -281.92778 -54.20800 36.23292 -17.975 -299.90286 2p 6. 8.55082 938344.217 8.80334 966055.322 -555.31841 -254.65515 -7.22266 -0.01379 -7.223 -261.87781 3s 2. 0.00000 0.000 0.00000 0.000 -234.95259 -54.45019 -10.56619 6.74803 -3.818 -58.26835 3p 6. 1.49512 164070.577 1.53331 168260.891 -227.35897 -45.29813 -1.64632 -0.00222 -1.646 -46.94445 3d 10. 0.17200 18874.995 0.18439 20234.990 -218.97396 -30.71805 -0.37698 -0.01081 -0.377 -31.09504 4s 2. 0.00000 0.000 0.00000 0.000 -108.63695 -9.20575 -2.08560 1.31657 -0.769 -9.97478 4p 6. 0.25565 28054.528 0.26189 28738.681 -100.15650 -6.40186 -0.29814 -0.00026 -0.298 -6.69999 4d 8. 0.01766 1937.775 0.01876 2059.041 -79.70669 -2.20203 -0.04520 -0.00108 -0.045 -2.24724 5s 2. 0.00000 0.000 0.00000 0.000 -39.68335 -0.93012 -0.19381 0.12208 -0.072 -1.00185 5p 1. 0.01263 1386.261 0.01293 1419.143 -29.01135 -0.40478 -0.01484 -0.00001 -0.015 -0.41962 ag i d8 5s2 5p nconf= 52 z= 47 ion= 0 kut=-1 exf=0.650 corrf=0.000 ca1=0.700 ca0=0.500 without correlation with correlation ----------------------- ----------------------- nl wnl eps fg eps fgr corr eps fg eps fgr n*r n*rc ect ec----------------- 1s 2. -1886.18133 -1886.18133-0.08290 -1886.26423 -1886.26423 0.0230 0.0230 -0.08267 0.00000-0.08267 2s 2. -284.99468 -284.99468-0.08232 -285.07700 -285.07700 0.0592 0.0592 -0.23110 -0.06744-0.08099 2p 6. -255.62193 -255.62193-0.08242 -255.70435 -255.70435 0.0625 0.0625 -0.72296 -0.08169-0.08186-0.08197-0.08206-0.08218 3s 2. -55.79648 -55.79648-0.08107 -55.87755 -55.87755 0.1339 0.1338 -0.86760 -0.06668-0.07795 3p 6. -45.83657 -45.83657-0.08107 -45.91763 -45.91763 0.1477 0.1476 -1.34527 -0.07880-0.07928-0.07960-0.07983-0.08016 3d 10. -30.03538 -30.03538-0.08120 -30.11658 -30.11658 0.1825 0.1822 -2.15236 -0.08040-0.08049-0.08057-0.08064-0.08095 4s 2. -9.47505 -9.47505-0.07792 -9.55297 -9.55297 0.3249 0.3235 -2.28931 -0.06430-0.07265 4p 6. -6.33624 -6.33624-0.07740 -6.41365 -6.41365 0.3973 0.3949 -2.73608 -0.07253-0.07372-0.07445-0.07498-0.07571 4d 8. -1.81345 -1.81345-0.07515 -1.88860 -1.88860 0.7426 0.7277 -3.32164 -0.07102-0.07217-0.07281-0.07328-0.07445 5s 2. -0.76345 -0.76345-0.06249 -0.82593 -0.82593 1.1445 1.1003 -3.43673 -0.05497-0.06013 5p 1. -0.38266 -0.38266-0.05147 -0.43413 -0.43413 1.6166 1.5177 -3.48821 -0.05147 ecorrt= -3.68341 (old) ect= -3.48821 (new) etotrl= 0.00000 + 0.00000 + 0.00000 etot= -10621.02934 -10621.02934 -10624.71275 -10624.71275 -10624.51754 -10624.51754 -10624.51754 ag i d8 5s2 5p 8 -10624.5175 0 76.1039 1 49.7416 1 1.9378 2 1.3863 2 15.3116 3 5.3974 4 4.5130 4 t(run)= 17.17, t(job)= 899.63 seconds 47 1ag i d10 4f 4d10 4f ag i d10 4f nconf= 53 z= 47 ncores= 9 nvales= 1 ion= 0 r(i)/x(i)=0.24532669 ca1=0.700 tolstb=1.000 tolk-2=1.00000 tolend= 0.5E-07 thresh= 0.1E-10 kut= 0 exf=1.000 corrf=0.000 ca0= 0.500 rcn mod 32 ihf1= 0 mesh=2601 idb= 481 rdb= 100.461 emx= 0.10 r(mesh)=5426.209 irel= 1 ib=2600 t(run)= 12.52, t(job)= 912.15 seconds nl wnl ee az (r-3) (r-2) (r-1) (r+1) (r+2) (r+3) (r+4) (r+6) 1s 2. -1885.02154 881.508 0.000E+00 5.213E+03 4.936E+01 3.112E-02 1.308E-03 6.934E-05 4.438E-06 2.867E-08 2s 2. -280.29241 295.095 0.000E+00 5.731E+02 1.123E+01 1.350E-01 2.146E-02 3.880E-03 7.892E-04 4.505E-05 2p 6. -254.16006 3360.693 3.659E+03 1.600E+02 1.083E+01 1.175E-01 1.683E-02 2.853E-03 5.593E-04 3.126E-05 3s 2. -52.50865 127.553 0.000E+00 1.088E+02 3.931E+00 3.700E-01 1.565E-01 7.318E-02 3.748E-02 1.276E-02 3p 6. -43.39886 1500.439 6.406E+02 3.004E+01 3.735E+00 3.687E-01 1.577E-01 7.538E-02 3.987E-02 1.484E-02 3d 10. -29.15170 3211.671 9.185E+01 1.570E+01 3.533E+00 3.450E-01 1.415E-01 6.773E-02 3.720E-02 1.614E-02 4s 2. -8.16605 56.016 0.000E+00 2.149E+01 1.516E+00 9.139E-01 9.475E-01 1.082E+00 1.354E+00 2.767E+00 4p 6. -5.42493 619.965 1.071E+02 5.509E+00 1.356E+00 1.004E+00 1.156E+00 1.486E+00 2.119E+00 5.841E+00 4d 10. -1.46364 1036.574 8.404E+00 1.825E+00 9.716E-01 1.397E+00 2.375E+00 4.802E+00 1.143E+01 1.006E+02 4f 1. -0.06252 0.125 3.761E-04 4.482E-03 6.258E-02 1.798E+01 3.595E+02 7.904E+03 1.896E+05 1.379E+08 47. 1.318E+04 2.727E+02 4.725E+01 3.949E+02 7.964E+03 1.897E+05 1.379E+08 1. 2.804E+02 5.803E+00 1.005E+00 8.401E+00 1.695E+02 4.037E+03 2.935E+06 --------------------zeta--------------------- nl wnl ----blume-watson---- -----(r*vi)----- i (ryd) eps s evel edar evel+edar erel (ryd) (cm-1) (ryd) (cm-1) 1s 2. 0.00000 0.000 0.00000 0.000-2274.99732 -1876.75797 -398.58180 331.78508 -66.797 -1943.55468 2s 2. 0.00000 0.000 0.00000 0.000 -567.83950 -281.57744 -54.21011 36.23416 -17.976 -299.55340 2p 6. 8.55158 938426.772 8.80416 966144.842 -555.32084 -254.30736 -7.22339 -0.01376 -7.223 -261.53075 3s 2. 0.00000 0.000 0.00000 0.000 -234.94456 -54.11378 -10.56400 6.74663 -3.817 -57.93115 3p 6. 1.49473 164028.102 1.53292 168218.913 -227.34854 -44.96160 -1.64589 -0.00221 -1.646 -46.60748 3d 10. 0.17191 18864.974 0.18429 20224.035 -218.95188 -30.37755 -0.37676 -0.01081 -0.377 -30.75431 4s 2. 0.00000 0.000 0.00000 0.000 -108.22128 -8.92818 -2.06002 1.30044 -0.760 -9.68776 4p 6. 0.24966 27397.103 0.25575 28065.004 -99.37778 -6.14387 -0.29109 -0.00026 -0.291 -6.43496 4d 10. 0.01547 1698.149 0.01645 1804.890 -75.87223 -1.98802 -0.03955 -0.00095 -0.040 -2.02757 4f 1. 0.00000 0.049 0.00000 0.002 -5.82015 -0.03302 0.00000 0.00000 0.000 -0.03302 ag i d10 4f nconf= 53 z= 47 ion= 0 kut=-1 exf=0.650 corrf=0.000 ca1=0.700 ca0=0.500 without correlation with correlation ----------------------- ----------------------- nl wnl eps fg eps fgr corr eps fg eps fgr n*r n*rc ect ec----------------- 1s 2. -1885.86717 -1885.86717-0.08290 -1885.95007 -1885.95007 0.0230 0.0230 -0.08267 0.00000-0.08267 2s 2. -284.64069 -284.64069-0.08232 -284.72301 -284.72301 0.0593 0.0593 -0.23110 -0.06744-0.08099 2p 6. -255.27554 -255.27554-0.08242 -255.35796 -255.35796 0.0626 0.0626 -0.72296 -0.08169-0.08186-0.08197-0.08206-0.08218 3s 2. -55.44754 -55.44754-0.08107 -55.52861 -55.52861 0.1343 0.1342 -0.86759 -0.06668-0.07795 3p 6. -45.49529 -45.49529-0.08107 -45.57636 -45.57636 0.1483 0.1481 -1.34526 -0.07880-0.07928-0.07960-0.07983-0.08015 3d 10. -29.70255 -29.70255-0.08120 -29.78374 -29.78374 0.1835 0.1832 -2.15235 -0.08039-0.08049-0.08057-0.08064-0.08095 4s 2. -9.19848 -9.19848-0.07796 -9.27644 -9.27644 0.3297 0.3283 -2.28891 -0.06401-0.07255 4p 6. -6.13469 -6.13469-0.07741 -6.21210 -6.21210 0.4037 0.4012 -2.73478 -0.07233-0.07355-0.07430-0.07484-0.07559 4d 10. -1.61013 -1.61013-0.07408 -1.68421 -1.68421 0.7881 0.7706 -3.45992 -0.06933-0.07096-0.07175-0.07230-0.07408 4f 1. -0.06252 -0.06252-0.00035 -0.06287 -0.06287 3.9995 3.9882 -3.46027 -0.00035 ecorrt= -3.64697 (old) ect= -3.46027 (new) etotrl= 0.00000 + 0.00000 + 0.00000 etot= -10621.63982 -10621.63982 -10625.28679 -10625.28679 -10625.10009 -10625.10009 -10625.10009 ag i d10 4f 2 -10625.1001 0 0.0000 2 t(run)= 17.66, t(job)= 917.29 seconds 47 1ag i d10 5f 4d10 5f ag i d10 5f nconf= 54 z= 47 ncores= 9 nvales= 1 ion= 0 r(i)/x(i)=0.24532669 ca1=0.700 tolstb=1.000 tolk-2=1.00000 tolend= 0.5E-07 thresh= 0.1E-10 kut= 0 exf=1.000 corrf=0.000 ca0= 0.500 rcn mod 32 ihf1= 0 mesh=2601 idb= 481 rdb= 100.461 emx= 0.10 r(mesh)=5426.209 irel= 1 ib=2600 t(run)= 12.38, t(job)= 929.66 seconds nl wnl ee az (r-3) (r-2) (r-1) (r+1) (r+2) (r+3) (r+4) (r+6) 1s 2. -1885.06650 881.507 0.000E+00 5.213E+03 4.936E+01 3.112E-02 1.308E-03 6.934E-05 4.438E-06 2.867E-08 2s 2. -280.33738 295.095 0.000E+00 5.731E+02 1.123E+01 1.350E-01 2.146E-02 3.880E-03 7.892E-04 4.505E-05 2p 6. -254.20503 3360.692 3.659E+03 1.600E+02 1.083E+01 1.175E-01 1.683E-02 2.853E-03 5.593E-04 3.126E-05 3s 2. -52.55362 127.553 0.000E+00 1.088E+02 3.931E+00 3.700E-01 1.565E-01 7.318E-02 3.748E-02 1.276E-02 3p 6. -43.44383 1500.439 6.406E+02 3.004E+01 3.735E+00 3.687E-01 1.577E-01 7.538E-02 3.987E-02 1.484E-02 3d 10. -29.19667 3211.671 9.185E+01 1.570E+01 3.533E+00 3.450E-01 1.415E-01 6.773E-02 3.720E-02 1.614E-02 4s 2. -8.21103 56.016 0.000E+00 2.149E+01 1.516E+00 9.139E-01 9.475E-01 1.082E+00 1.354E+00 2.767E+00 4p 6. -5.46990 619.965 1.071E+02 5.509E+00 1.356E+00 1.004E+00 1.156E+00 1.486E+00 2.119E+00 5.841E+00 4d 10. -1.50862 1036.574 8.404E+00 1.825E+00 9.716E-01 1.397E+00 2.375E+00 4.802E+00 1.143E+01 1.006E+02 5f 1. -0.04003 0.123 1.949E-04 2.305E-03 4.010E-02 3.146E+01 1.123E+03 4.319E+04 1.757E+06 3.362E+09 47. 1.318E+04 2.727E+02 6.073E+01 1.158E+03 4.325E+04 1.757E+06 3.362E+09 1. 2.804E+02 5.802E+00 1.292E+00 2.464E+01 9.203E+02 3.739E+04 7.154E+07 --------------------zeta--------------------- nl wnl ----blume-watson---- -----(r*vi)----- i (ryd) eps s evel edar evel+edar erel (ryd) (cm-1) (ryd) (cm-1) 1s 2. 0.00000 0.000 0.00000 0.000-2274.99731 -1876.80293 -398.58177 331.78500 -66.797 -1943.59970 2s 2. 0.00000 0.000 0.00000 0.000 -567.83950 -281.62242 -54.21010 36.23415 -17.976 -299.59837 2p 6. 8.55158 938426.773 8.80416 966144.842 -555.32084 -254.35233 -7.22339 -0.01376 -7.223 -261.57572 3s 2. 0.00000 0.000 0.00000 0.000 -234.94456 -54.15875 -10.56400 6.74663 -3.817 -57.97612 3p 6. 1.49473 164028.101 1.53292 168218.913 -227.34854 -45.00657 -1.64589 -0.00221 -1.646 -46.65246 3d 10. 0.17191 18864.974 0.18429 20224.035 -218.95188 -30.42252 -0.37676 -0.01081 -0.377 -30.79928 4s 2. 0.00000 0.000 0.00000 0.000 -108.22128 -8.97315 -2.06002 1.30044 -0.760 -9.73274 4p 6. 0.24966 27397.100 0.25575 28065.002 -99.37778 -6.18885 -0.29109 -0.00026 -0.291 -6.47994 4d 10. 0.01547 1698.150 0.01645 1804.891 -75.87225 -2.03299 -0.03955 -0.00095 -0.040 -2.07254 5f 1. 0.00000 0.025 0.00000 0.001 -3.72874 -0.02567 0.00000 0.00000 0.000 -0.02567 ag i d10 5f nconf= 54 z= 47 ion= 0 kut=-1 exf=0.650 corrf=0.000 ca1=0.700 ca0=0.500 without correlation with correlation ----------------------- ----------------------- nl wnl eps fg eps fgr corr eps fg eps fgr n*r n*rc ect ec----------------- 1s 2. -1885.91213 -1885.91213-0.08290 -1885.99503 -1885.99503 0.0230 0.0230 -0.08267 0.00000-0.08267 2s 2. -284.68566 -284.68566-0.08232 -284.76798 -284.76798 0.0593 0.0593 -0.23110 -0.06744-0.08099 2p 6. -255.32051 -255.32051-0.08242 -255.40293 -255.40293 0.0626 0.0626 -0.72296 -0.08169-0.08186-0.08197-0.08206-0.08218 3s 2. -55.49251 -55.49251-0.08107 -55.57358 -55.57358 0.1342 0.1341 -0.86759 -0.06668-0.07795 3p 6. -45.54026 -45.54026-0.08107 -45.62133 -45.62133 0.1482 0.1481 -1.34526 -0.07880-0.07928-0.07960-0.07983-0.08015 3d 10. -29.74752 -29.74752-0.08120 -29.82872 -29.82872 0.1833 0.1831 -2.15235 -0.08039-0.08049-0.08057-0.08064-0.08095 4s 2. -9.24346 -9.24346-0.07796 -9.32141 -9.32141 0.3289 0.3275 -2.28891 -0.06401-0.07255 4p 6. -6.17967 -6.17967-0.07741 -6.25707 -6.25707 0.4023 0.3998 -2.73478 -0.07233-0.07355-0.07430-0.07484-0.07559 4d 10. -1.65510 -1.65510-0.07408 -1.72918 -1.72918 0.7773 0.7605 -3.45992 -0.06933-0.07096-0.07175-0.07230-0.07408 5f 1. -0.04001 -0.04001-0.00025 -0.04026 -0.04026 4.9993 4.9838 -3.46016 -0.00025 ecorrt= -3.64686 (old) ect= -3.46016 (new) etotrl= 0.00000 + 0.00000 + 0.00000 etot= -10621.61730 -10621.61730 -10625.26415 -10625.26415 -10625.07746 -10625.07746 -10625.07746 ag i d10 5f 2 -10625.0775 0 0.0000 2 t(run)= 17.35, t(job)= 934.64 seconds 47 1ag i d10 6f 4d10 6f ag i d10 6f nconf= 55 z= 47 ncores= 9 nvales= 1 ion= 0 r(i)/x(i)=0.24532669 ca1=0.700 tolstb=1.000 tolk-2=1.00000 tolend= 0.5E-07 thresh= 0.1E-10 kut= 0 exf=1.000 corrf=0.000 ca0= 0.500 rcn mod 32 ihf1= 0 mesh=2601 idb= 481 rdb= 100.461 emx= 0.10 r(mesh)=5426.209 irel= 1 ib=2600 t(run)= 11.97, t(job)= 946.61 seconds nl wnl ee az (r-3) (r-2) (r-1) (r+1) (r+2) (r+3) (r+4) (r+6) 1s 2. -1885.09096 881.507 0.000E+00 5.213E+03 4.936E+01 3.112E-02 1.308E-03 6.934E-05 4.438E-06 2.867E-08 2s 2. -280.36185 295.095 0.000E+00 5.731E+02 1.123E+01 1.350E-01 2.146E-02 3.880E-03 7.892E-04 4.505E-05 2p 6. -254.22950 3360.692 3.659E+03 1.600E+02 1.083E+01 1.175E-01 1.683E-02 2.853E-03 5.593E-04 3.126E-05 3s 2. -52.57808 127.553 0.000E+00 1.088E+02 3.931E+00 3.700E-01 1.565E-01 7.318E-02 3.748E-02 1.276E-02 3p 6. -43.46830 1500.439 6.406E+02 3.004E+01 3.735E+00 3.687E-01 1.577E-01 7.538E-02 3.987E-02 1.484E-02 3d 10. -29.22113 3211.671 9.185E+01 1.570E+01 3.533E+00 3.450E-01 1.415E-01 6.773E-02 3.720E-02 1.614E-02 4s 2. -8.23549 56.016 0.000E+00 2.149E+01 1.516E+00 9.139E-01 9.475E-01 1.082E+00 1.354E+00 2.767E+00 4p 6. -5.49437 619.965 1.071E+02 5.509E+00 1.356E+00 1.004E+00 1.156E+00 1.486E+00 2.119E+00 5.841E+00 4d 10. -1.53308 1036.574 8.404E+00 1.825E+00 9.716E-01 1.397E+00 2.375E+00 4.802E+00 1.143E+01 1.006E+02 6f 1. -0.02780 0.108 1.139E-04 1.338E-03 2.786E-02 4.794E+01 2.604E+03 1.510E+05 9.160E+06 3.762E+10 47. 1.318E+04 2.727E+02 7.720E+01 2.640E+03 1.511E+05 9.160E+06 3.762E+10 1. 2.804E+02 5.802E+00 1.643E+00 5.617E+01 3.214E+03 1.949E+05 8.005E+08 --------------------zeta--------------------- nl wnl ----blume-watson---- -----(r*vi)----- i (ryd) eps s evel edar evel+edar erel (ryd) (cm-1) (ryd) (cm-1) 1s 2. 0.00000 0.000 0.00000 0.000-2274.99730 -1876.82739 -398.58176 331.78496 -66.797 -1943.62419 2s 2. 0.00000 0.000 0.00000 0.000 -567.83950 -281.64688 -54.21010 36.23414 -17.976 -299.62284 2p 6. 8.55158 938426.773 8.80416 966144.843 -555.32084 -254.37680 -7.22339 -0.01376 -7.223 -261.60019 3s 2. 0.00000 0.000 0.00000 0.000 -234.94456 -54.18322 -10.56400 6.74663 -3.817 -58.00059 3p 6. 1.49473 164028.100 1.53292 168218.912 -227.34854 -45.03103 -1.64589 -0.00221 -1.646 -46.67692 3d 10. 0.17191 18864.973 0.18429 20224.035 -218.95188 -30.44699 -0.37676 -0.01081 -0.377 -30.82374 4s 2. 0.00000 0.000 0.00000 0.000 -108.22127 -8.99762 -2.06002 1.30044 -0.760 -9.75720 4p 6. 0.24966 27397.094 0.25575 28064.996 -99.37777 -6.21331 -0.29109 -0.00026 -0.291 -6.50440 4d 10. 0.01547 1698.150 0.01645 1804.892 -75.87229 -2.05746 -0.03955 -0.00095 -0.040 -2.09701 6f 1. 0.00000 0.014 0.00000 0.001 -2.59078 -0.01923 0.00000 0.00000 0.000 -0.01923 ag i d10 6f nconf= 55 z= 47 ion= 0 kut=-1 exf=0.650 corrf=0.000 ca1=0.700 ca0=0.500 without correlation with correlation ----------------------- ----------------------- nl wnl eps fg eps fgr corr eps fg eps fgr n*r n*rc ect ec----------------- 1s 2. -1885.93659 -1885.93659-0.08290 -1886.01949 -1886.01949 0.0230 0.0230 -0.08267 0.00000-0.08267 2s 2. -284.71013 -284.71013-0.08232 -284.79245 -284.79245 0.0593 0.0593 -0.23110 -0.06744-0.08099 2p 6. -255.34497 -255.34497-0.08242 -255.42739 -255.42739 0.0626 0.0626 -0.72296 -0.08169-0.08186-0.08197-0.08206-0.08218 3s 2. -55.51698 -55.51698-0.08107 -55.59804 -55.59804 0.1342 0.1341 -0.86759 -0.06668-0.07795 3p 6. -45.56473 -45.56473-0.08107 -45.64579 -45.64579 0.1481 0.1480 -1.34526 -0.07880-0.07928-0.07960-0.07983-0.08015 3d 10. -29.77199 -29.77199-0.08120 -29.85318 -29.85318 0.1833 0.1830 -2.15235 -0.08039-0.08049-0.08057-0.08064-0.08095 4s 2. -9.26792 -9.26792-0.07796 -9.34588 -9.34588 0.3285 0.3271 -2.28891 -0.06401-0.07255 4p 6. -6.20413 -6.20413-0.07741 -6.28154 -6.28154 0.4015 0.3990 -2.73478 -0.07233-0.07355-0.07430-0.07484-0.07559 4d 10. -1.67957 -1.67957-0.07408 -1.75365 -1.75365 0.7716 0.7551 -3.45992 -0.06933-0.07096-0.07175-0.07230-0.07408 6f 1. -0.02779 -0.02779-0.00016 -0.02795 -0.02795 5.9989 5.9813 -3.46008 -0.00016 ecorrt= -3.64677 (old) ect= -3.46008 (new) etotrl= 0.00000 + 0.00000 + 0.00000 etot= -10621.60506 -10621.60506 -10625.25183 -10625.25183 -10625.06514 -10625.06514 -10625.06514 ag i d10 6f 2 -10625.0651 0 0.0000 2 t(run)= 17.48, t(job)= 952.13 seconds 47 1ag i d10 7f 4d10 7f ag i d10 7f nconf= 56 z= 47 ncores= 9 nvales= 1 ion= 0 r(i)/x(i)=0.24532669 ca1=0.700 tolstb=1.000 tolk-2=1.00000 tolend= 0.5E-07 thresh= 0.1E-10 kut= 0 exf=1.000 corrf=0.000 ca0= 0.500 rcn mod 32 ihf1= 0 mesh=2601 idb= 481 rdb= 100.461 emx= 0.10 r(mesh)=5426.209 irel= 1 ib=2600 t(run)= 12.48, t(job)= 964.61 seconds nl wnl ee az (r-3) (r-2) (r-1) (r+1) (r+2) (r+3) (r+4) (r+6) 1s 2. -1885.10572 881.507 0.000E+00 5.213E+03 4.936E+01 3.112E-02 1.308E-03 6.934E-05 4.438E-06 2.867E-08 2s 2. -280.37661 295.095 0.000E+00 5.731E+02 1.123E+01 1.350E-01 2.146E-02 3.880E-03 7.892E-04 4.505E-05 2p 6. -254.24427 3360.692 3.659E+03 1.600E+02 1.083E+01 1.175E-01 1.683E-02 2.853E-03 5.593E-04 3.126E-05 3s 2. -52.59285 127.553 0.000E+00 1.088E+02 3.931E+00 3.700E-01 1.565E-01 7.318E-02 3.748E-02 1.276E-02 3p 6. -43.48307 1500.439 6.406E+02 3.004E+01 3.735E+00 3.687E-01 1.577E-01 7.538E-02 3.987E-02 1.484E-02 3d 10. -29.23590 3211.671 9.185E+01 1.570E+01 3.533E+00 3.450E-01 1.415E-01 6.773E-02 3.720E-02 1.614E-02 4s 2. -8.25026 56.016 0.000E+00 2.149E+01 1.516E+00 9.139E-01 9.475E-01 1.082E+00 1.354E+00 2.767E+00 4p 6. -5.50913 619.965 1.071E+02 5.509E+00 1.356E+00 1.004E+00 1.156E+00 1.486E+00 2.119E+00 5.841E+00 4d 10. -1.54785 1036.574 8.404E+00 1.825E+00 9.716E-01 1.397E+00 2.375E+00 4.802E+00 1.143E+01 1.006E+02 7f 1. -0.02043 0.094 7.223E-05 8.448E-04 2.047E-02 6.742E+01 5.134E+03 4.151E+05 3.492E+07 2.710E+11 47. 1.318E+04 2.727E+02 9.668E+01 5.169E+03 4.152E+05 3.492E+07 2.710E+11 1. 2.804E+02 5.802E+00 2.057E+00 1.100E+02 8.833E+03 7.430E+05 5.766E+09 --------------------zeta--------------------- nl wnl ----blume-watson---- -----(r*vi)----- i (ryd) eps s evel edar evel+edar erel (ryd) (cm-1) (ryd) (cm-1) 1s 2. 0.00000 0.000 0.00000 0.000-2274.99730 -1876.84215 -398.58176 331.78494 -66.797 -1943.63897 2s 2. 0.00000 0.000 0.00000 0.000 -567.83950 -281.66165 -54.21010 36.23414 -17.976 -299.63761 2p 6. 8.55158 938426.773 8.80416 966144.843 -555.32084 -254.39156 -7.22339 -0.01376 -7.223 -261.61496 3s 2. 0.00000 0.000 0.00000 0.000 -234.94456 -54.19798 -10.56400 6.74662 -3.817 -58.01535 3p 6. 1.49473 164028.100 1.53292 168218.912 -227.34854 -45.04580 -1.64589 -0.00221 -1.646 -46.69169 3d 10. 0.17191 18864.973 0.18429 20224.034 -218.95188 -30.46175 -0.37676 -0.01081 -0.377 -30.83851 4s 2. 0.00000 0.000 0.00000 0.000 -108.22127 -9.01239 -2.06002 1.30044 -0.760 -9.77197 4p 6. 0.24966 27397.090 0.25575 28064.991 -99.37777 -6.22808 -0.29109 -0.00026 -0.291 -6.51917 4d 10. 0.01547 1698.151 0.01645 1804.892 -75.87232 -2.07222 -0.03955 -0.00095 -0.040 -2.11177 7f 1. 0.00000 0.008 0.00000 0.000 -1.90389 -0.01470 0.00000 0.00000 0.000 -0.01470 ag i d10 7f nconf= 56 z= 47 ion= 0 kut=-1 exf=0.650 corrf=0.000 ca1=0.700 ca0=0.500 without correlation with correlation ----------------------- ----------------------- nl wnl eps fg eps fgr corr eps fg eps fgr n*r n*rc ect ec----------------- 1s 2. -1885.95135 -1885.95135-0.08290 -1886.03425 -1886.03425 0.0230 0.0230 -0.08267 0.00000-0.08267 2s 2. -284.72489 -284.72489-0.08232 -284.80721 -284.80721 0.0593 0.0593 -0.23110 -0.06744-0.08099 2p 6. -255.35974 -255.35974-0.08242 -255.44216 -255.44216 0.0626 0.0626 -0.72296 -0.08169-0.08186-0.08197-0.08206-0.08218 3s 2. -55.53174 -55.53174-0.08107 -55.61281 -55.61281 0.1342 0.1341 -0.86759 -0.06668-0.07795 3p 6. -45.57949 -45.57949-0.08107 -45.66056 -45.66056 0.1481 0.1480 -1.34526 -0.07880-0.07928-0.07960-0.07983-0.08015 3d 10. -29.78675 -29.78675-0.08120 -29.86795 -29.86795 0.1832 0.1830 -2.15235 -0.08039-0.08049-0.08057-0.08064-0.08095 4s 2. -9.28269 -9.28269-0.07796 -9.36065 -9.36065 0.3282 0.3268 -2.28891 -0.06401-0.07255 4p 6. -6.21890 -6.21890-0.07741 -6.29631 -6.29631 0.4010 0.3985 -2.73478 -0.07233-0.07355-0.07430-0.07484-0.07559 4d 10. -1.69434 -1.69434-0.07408 -1.76841 -1.76841 0.7682 0.7520 -3.45992 -0.06933-0.07096-0.07175-0.07230-0.07408 7f 1. -0.02042 -0.02042-0.00011 -0.02053 -0.02053 6.9986 6.9798 -3.46003 -0.00011 ecorrt= -3.64671 (old) ect= -3.46003 (new) etotrl= 0.00000 + 0.00000 + 0.00000 etot= -10621.59768 -10621.59768 -10625.24439 -10625.24439 -10625.05771 -10625.05771 -10625.05771 ag i d10 7f 2 -10625.0577 0 0.0000 2 t(run)= 17.11, t(job)= 969.23 seconds 47 1ag i d10 8f 4d10 8f ag i d10 8f nconf= 57 z= 47 ncores= 9 nvales= 1 ion= 0 r(i)/x(i)=0.24532669 ca1=0.700 tolstb=1.000 tolk-2=1.00000 tolend= 0.5E-07 thresh= 0.1E-10 kut= 0 exf=1.000 corrf=0.000 ca0= 0.500 rcn mod 32 ihf1= 0 mesh=2601 idb= 481 rdb= 100.461 emx= 0.10 r(mesh)=5426.209 irel= 1 ib=2600 t(run)= 12.90, t(job)= 982.13 seconds nl wnl ee az (r-3) (r-2) (r-1) (r+1) (r+2) (r+3) (r+4) (r+6) 1s 2. -1885.11531 881.507 0.000E+00 5.213E+03 4.936E+01 3.112E-02 1.308E-03 6.934E-05 4.438E-06 2.867E-08 2s 2. -280.38620 295.095 0.000E+00 5.731E+02 1.123E+01 1.350E-01 2.146E-02 3.880E-03 7.892E-04 4.505E-05 2p 6. -254.25386 3360.692 3.659E+03 1.600E+02 1.083E+01 1.175E-01 1.683E-02 2.853E-03 5.593E-04 3.126E-05 3s 2. -52.60244 127.553 0.000E+00 1.088E+02 3.931E+00 3.700E-01 1.565E-01 7.318E-02 3.748E-02 1.276E-02 3p 6. -43.49266 1500.439 6.406E+02 3.004E+01 3.735E+00 3.687E-01 1.577E-01 7.538E-02 3.987E-02 1.484E-02 3d 10. -29.24549 3211.671 9.185E+01 1.570E+01 3.533E+00 3.450E-01 1.415E-01 6.773E-02 3.720E-02 1.614E-02 4s 2. -8.25985 56.016 0.000E+00 2.149E+01 1.516E+00 9.139E-01 9.475E-01 1.082E+00 1.354E+00 2.767E+00 4p 6. -5.51872 619.965 1.071E+02 5.509E+00 1.356E+00 1.004E+00 1.156E+00 1.486E+00 2.119E+00 5.841E+00 4d 10. -1.55744 1036.575 8.404E+00 1.825E+00 9.716E-01 1.397E+00 2.375E+00 4.802E+00 1.143E+01 1.006E+02 8f 1. -0.01564 0.081 4.867E-05 5.671E-04 1.568E-02 8.990E+01 9.101E+03 9.753E+05 1.084E+08 1.453E+12 47. 1.318E+04 2.727E+02 1.192E+02 9.136E+03 9.753E+05 1.084E+08 1.453E+12 1. 2.804E+02 5.802E+00 2.535E+00 1.944E+02 2.075E+04 2.307E+06 3.091E+10 --------------------zeta--------------------- nl wnl ----blume-watson---- -----(r*vi)----- i (ryd) eps s evel edar evel+edar erel (ryd) (cm-1) (ryd) (cm-1) 1s 2. 0.00000 0.000 0.00000 0.000-2274.99730 -1876.85174 -398.58175 331.78492 -66.797 -1943.64857 2s 2. 0.00000 0.000 0.00000 0.000 -567.83950 -281.67124 -54.21010 36.23414 -17.976 -299.64720 2p 6. 8.55158 938426.773 8.80416 966144.843 -555.32084 -254.40115 -7.22339 -0.01376 -7.223 -261.62455 3s 2. 0.00000 0.000 0.00000 0.000 -234.94456 -54.20757 -10.56400 6.74662 -3.817 -58.02494 3p 6. 1.49473 164028.099 1.53292 168218.911 -227.34854 -45.05539 -1.64589 -0.00221 -1.646 -46.70128 3d 10. 0.17191 18864.973 0.18429 20224.034 -218.95188 -30.47134 -0.37676 -0.01081 -0.377 -30.84810 4s 2. 0.00000 0.000 0.00000 0.000 -108.22127 -9.02198 -2.06002 1.30044 -0.760 -9.78156 4p 6. 0.24966 27397.087 0.25575 28064.988 -99.37776 -6.23767 -0.29109 -0.00026 -0.291 -6.52876 4d 10. 0.01547 1698.152 0.01645 1804.893 -75.87233 -2.08181 -0.03955 -0.00095 -0.040 -2.12136 8f 1. 0.00000 0.006 0.00000 0.000 -1.45778 -0.01154 0.00000 0.00000 0.000 -0.01154 ag i d10 8f nconf= 57 z= 47 ion= 0 kut=-1 exf=0.650 corrf=0.000 ca1=0.700 ca0=0.500 without correlation with correlation ----------------------- ----------------------- nl wnl eps fg eps fgr corr eps fg eps fgr n*r n*rc ect ec----------------- 1s 2. -1885.96094 -1885.96094-0.08290 -1886.04384 -1886.04384 0.0230 0.0230 -0.08267 0.00000-0.08267 2s 2. -284.73448 -284.73448-0.08232 -284.81680 -284.81680 0.0593 0.0593 -0.23110 -0.06744-0.08099 2p 6. -255.36933 -255.36933-0.08242 -255.45175 -255.45175 0.0626 0.0626 -0.72296 -0.08169-0.08186-0.08197-0.08206-0.08218 3s 2. -55.54133 -55.54133-0.08107 -55.62240 -55.62240 0.1342 0.1341 -0.86759 -0.06668-0.07795 3p 6. -45.58908 -45.58908-0.08107 -45.67015 -45.67015 0.1481 0.1480 -1.34526 -0.07880-0.07928-0.07960-0.07983-0.08015 3d 10. -29.79634 -29.79634-0.08120 -29.87754 -29.87754 0.1832 0.1829 -2.15235 -0.08039-0.08049-0.08057-0.08064-0.08095 4s 2. -9.29228 -9.29228-0.07796 -9.37024 -9.37024 0.3280 0.3267 -2.28891 -0.06401-0.07255 4p 6. -6.22849 -6.22849-0.07741 -6.30590 -6.30590 0.4007 0.3982 -2.73478 -0.07233-0.07355-0.07430-0.07484-0.07559 4d 10. -1.70393 -1.70393-0.07408 -1.77801 -1.77801 0.7661 0.7500 -3.45992 -0.06933-0.07096-0.07175-0.07230-0.07408 8f 1. -0.01563 -0.01563-0.00008 -0.01571 -0.01571 7.9984 7.9788 -3.45999 -0.00008 ecorrt= -3.64668 (old) ect= -3.45999 (new) etotrl= 0.00000 + 0.00000 + 0.00000 etot= -10621.59289 -10621.59289 -10625.23957 -10625.23957 -10625.05289 -10625.05289 -10625.05289 ag i d10 8f 2 -10625.0529 0 0.0000 2 t(run)= 17.33, t(job)= 986.56 seconds 47 1ag i d10 9f 4d10 9f ag i d10 9f nconf= 58 z= 47 ncores= 9 nvales= 1 ion= 0 r(i)/x(i)=0.24532669 ca1=0.700 tolstb=1.000 tolk-2=1.00000 tolend= 0.5E-07 thresh= 0.1E-10 kut= 0 exf=1.000 corrf=0.000 ca0= 0.500 rcn mod 32 ihf1= 0 mesh=2601 idb= 481 rdb= 100.461 emx= 0.10 r(mesh)=5426.209 irel= 1 ib=2600 t(run)= 13.19, t(job)= 999.75 seconds nl wnl ee az (r-3) (r-2) (r-1) (r+1) (r+2) (r+3) (r+4) (r+6) 1s 2. -1885.12188 881.507 0.000E+00 5.213E+03 4.936E+01 3.112E-02 1.308E-03 6.934E-05 4.438E-06 2.867E-08 2s 2. -280.39278 295.095 0.000E+00 5.731E+02 1.123E+01 1.350E-01 2.146E-02 3.880E-03 7.892E-04 4.505E-05 2p 6. -254.26043 3360.692 3.659E+03 1.600E+02 1.083E+01 1.175E-01 1.683E-02 2.853E-03 5.593E-04 3.126E-05 3s 2. -52.60902 127.553 0.000E+00 1.088E+02 3.931E+00 3.700E-01 1.565E-01 7.318E-02 3.748E-02 1.276E-02 3p 6. -43.49923 1500.439 6.406E+02 3.004E+01 3.735E+00 3.687E-01 1.577E-01 7.538E-02 3.987E-02 1.484E-02 3d 10. -29.25207 3211.671 9.185E+01 1.570E+01 3.533E+00 3.450E-01 1.415E-01 6.773E-02 3.720E-02 1.614E-02 4s 2. -8.26643 56.016 0.000E+00 2.149E+01 1.516E+00 9.139E-01 9.475E-01 1.082E+00 1.354E+00 2.767E+00 4p 6. -5.52530 619.965 1.071E+02 5.509E+00 1.356E+00 1.004E+00 1.156E+00 1.486E+00 2.119E+00 5.841E+00 4d 10. -1.56402 1036.575 8.404E+00 1.825E+00 9.716E-01 1.397E+00 2.375E+00 4.802E+00 1.143E+01 1.006E+02 9f 1. -0.01236 0.070 3.435E-05 3.990E-04 1.239E-02 1.154E+02 1.495E+04 2.048E+06 2.903E+08 6.284E+12 47. 1.318E+04 2.727E+02 1.446E+02 1.499E+04 2.048E+06 2.903E+08 6.284E+12 1. 2.804E+02 5.802E+00 3.077E+00 3.189E+02 4.357E+04 6.177E+06 1.337E+11 --------------------zeta--------------------- nl wnl ----blume-watson---- -----(r*vi)----- i (ryd) eps s evel edar evel+edar erel (ryd) (cm-1) (ryd) (cm-1) 1s 2. 0.00000 0.000 0.00000 0.000-2274.99729 -1876.85831 -398.58175 331.78491 -66.797 -1943.65515 2s 2. 0.00000 0.000 0.00000 0.000 -567.83950 -281.67781 -54.21010 36.23414 -17.976 -299.65378 2p 6. 8.55158 938426.774 8.80416 966144.843 -555.32084 -254.40773 -7.22339 -0.01376 -7.223 -261.63112 3s 2. 0.00000 0.000 0.00000 0.000 -234.94456 -54.21415 -10.56400 6.74662 -3.817 -58.03152 3p 6. 1.49473 164028.099 1.53292 168218.911 -227.34854 -45.06197 -1.64589 -0.00221 -1.646 -46.70785 3d 10. 0.17191 18864.973 0.18429 20224.034 -218.95188 -30.47792 -0.37676 -0.01081 -0.377 -30.85468 4s 2. 0.00000 0.000 0.00000 0.000 -108.22127 -9.02855 -2.06002 1.30044 -0.760 -9.78814 4p 6. 0.24966 27397.085 0.25575 28064.986 -99.37776 -6.24425 -0.29109 -0.00026 -0.291 -6.53534 4d 10. 0.01547 1698.152 0.01645 1804.893 -75.87235 -2.08839 -0.03955 -0.00095 -0.040 -2.12794 9f 1. 0.00000 0.004 0.00000 0.000 -1.15184 -0.00927 0.00000 0.00000 0.000 -0.00927 ag i d10 9f nconf= 58 z= 47 ion= 0 kut=-1 exf=0.650 corrf=0.000 ca1=0.700 ca0=0.500 without correlation with correlation ----------------------- ----------------------- nl wnl eps fg eps fgr corr eps fg eps fgr n*r n*rc ect ec----------------- 1s 2. -1885.96751 -1885.96751-0.08290 -1886.05042 -1886.05042 0.0230 0.0230 -0.08267 0.00000-0.08267 2s 2. -284.74106 -284.74106-0.08232 -284.82338 -284.82338 0.0593 0.0593 -0.23110 -0.06744-0.08099 2p 6. -255.37591 -255.37591-0.08242 -255.45833 -255.45833 0.0626 0.0626 -0.72296 -0.08169-0.08186-0.08197-0.08206-0.08218 3s 2. -55.54791 -55.54791-0.08107 -55.62898 -55.62898 0.1342 0.1341 -0.86759 -0.06668-0.07795 3p 6. -45.59566 -45.59566-0.08107 -45.67673 -45.67673 0.1481 0.1480 -1.34526 -0.07880-0.07928-0.07960-0.07983-0.08015 3d 10. -29.80292 -29.80292-0.08120 -29.88412 -29.88412 0.1832 0.1829 -2.15235 -0.08039-0.08049-0.08057-0.08064-0.08095 4s 2. -9.29886 -9.29886-0.07796 -9.37682 -9.37682 0.3279 0.3266 -2.28891 -0.06401-0.07255 4p 6. -6.23507 -6.23507-0.07741 -6.31248 -6.31248 0.4005 0.3980 -2.73478 -0.07233-0.07355-0.07430-0.07484-0.07559 4d 10. -1.71051 -1.71051-0.07408 -1.78458 -1.78458 0.7646 0.7486 -3.45992 -0.06933-0.07096-0.07175-0.07230-0.07408 9f 1. -0.01235 -0.01235-0.00006 -0.01240 -0.01240 8.9988 8.9786 -3.45997 -0.00006 ecorrt= -3.64665 (old) ect= -3.45997 (new) etotrl= 0.00000 + 0.00000 + 0.00000 etot= -10621.58961 -10621.58961 -10625.23626 -10625.23626 -10625.04958 -10625.04958 -10625.04958 ag i d10 9f 2 -10625.0496 0 0.0000 2 t(run)= 17.65, t(job)=1004.21 seconds 47 1ag i d9 5s4f 4d9 5s 4f ag i d9 5s4f nconf= 59 z= 47 ncores=10 nvales= 1 ion= 0 r(i)/x(i)=0.24532669 ca1=0.700 tolstb=1.000 tolk-2=1.00000 tolend= 0.5E-07 thresh= 0.1E-10 kut= 0 exf=1.000 corrf=0.000 ca0= 0.500 rcn mod 32 ihf1= 0 mesh=2601 idb= 481 rdb= 100.461 emx= 0.10 r(mesh)=5426.209 irel= 1 ib=2600 t(run)= 11.10, t(job)=1015.31 seconds nl wnl ee az (r-3) (r-2) (r-1) (r+1) (r+2) (r+3) (r+4) (r+6) 1s 2. -1885.36022 881.505 0.000E+00 5.213E+03 4.936E+01 3.112E-02 1.308E-03 6.934E-05 4.438E-06 2.867E-08 2s 2. -280.64779 295.093 0.000E+00 5.731E+02 1.123E+01 1.350E-01 2.146E-02 3.880E-03 7.892E-04 4.505E-05 2p 6. -254.51411 3360.615 3.659E+03 1.600E+02 1.083E+01 1.175E-01 1.684E-02 2.853E-03 5.593E-04 3.126E-05 3s 2. -52.85824 127.558 0.000E+00 1.088E+02 3.931E+00 3.700E-01 1.565E-01 7.317E-02 3.748E-02 1.276E-02 3p 6. -43.74853 1500.501 6.406E+02 3.005E+01 3.735E+00 3.687E-01 1.577E-01 7.538E-02 3.986E-02 1.483E-02 3d 10. -29.50336 3212.018 9.187E+01 1.571E+01 3.533E+00 3.449E-01 1.415E-01 6.771E-02 3.719E-02 1.613E-02 4s 2. -8.49696 56.166 0.000E+00 2.160E+01 1.520E+00 9.114E-01 9.418E-01 1.071E+00 1.333E+00 2.683E+00 4p 6. -5.74646 623.307 1.083E+02 5.563E+00 1.363E+00 9.982E-01 1.142E+00 1.455E+00 2.052E+00 5.497E+00 4d 9. -1.75109 1073.601 8.994E+00 1.934E+00 1.004E+00 1.343E+00 2.170E+00 4.123E+00 9.126E+00 6.782E+01 5s 1. -1.07768 17.117 0.000E+00 2.118E+00 4.675E-01 2.734E+00 8.475E+00 2.925E+01 1.117E+02 2.173E+03 4f 1. -0.06256 0.162 3.808E-04 4.505E-03 6.270E-02 1.796E+01 3.587E+02 7.880E+03 1.889E+05 1.373E+08 47. 1.318E+04 2.726E+02 4.803E+01 3.982E+02 7.959E+03 1.891E+05 1.373E+08 1. 2.805E+02 5.799E+00 1.022E+00 8.473E+00 1.693E+02 4.024E+03 2.920E+06 --------------------zeta--------------------- nl wnl ----blume-watson---- -----(r*vi)----- i (ryd) eps s evel edar evel+edar erel (ryd) (cm-1) (ryd) (cm-1) 1s 2. 0.00000 0.000 0.00000 0.000-2274.99711 -1877.09653 -398.57968 331.78296 -66.797 -1943.89325 2s 2. 0.00000 0.000 0.00000 0.000 -567.83897 -281.93243 -54.20918 36.23357 -17.976 -299.90803 2p 6. 8.55126 938392.339 8.80382 966107.345 -555.31980 -254.66128 -7.22309 -0.01377 -7.223 -261.88436 3s 2. 0.00000 0.000 0.00000 0.000 -234.94724 -54.46375 -10.56476 6.74711 -3.818 -58.28140 3p 6. 1.49487 164042.949 1.53306 168233.440 -227.35202 -45.31162 -1.64604 -0.00221 -1.646 -46.95766 3d 10. 0.17194 18868.612 0.18433 20228.021 -218.95974 -30.72913 -0.37684 -0.01081 -0.377 -31.10597 4s 2. 0.00000 0.000 0.00000 0.000 -108.40487 -9.25464 -2.07114 1.30745 -0.764 -10.01834 4p 6. 0.25235 27692.531 0.25851 28367.747 -99.73443 -6.46153 -0.29425 -0.00026 -0.294 -6.75579 4d 9. 0.01659 1820.210 0.01763 1934.374 -77.91716 -2.28650 -0.04242 -0.00102 -0.042 -2.32892 5s 1. 0.00000 0.000 0.00000 0.000 -39.89498 -1.14565 -0.19276 0.12143 -0.071 -1.21697 4f 1. 0.00000 0.049 0.00000 0.002 -5.83097 -0.03377 0.00000 0.00000 0.000 -0.03377 ag i d9 5s4f nconf= 59 z= 47 ion= 0 kut=-1 exf=0.650 corrf=0.000 ca1=0.700 ca0=0.500 without correlation with correlation ----------------------- ----------------------- nl wnl eps fg eps fgr corr eps fg eps fgr n*r n*rc ect ec----------------- 1s 2. -1886.20705 -1886.20705-0.08290 -1886.28995 -1886.28995 0.0230 0.0230 -0.08267 0.00000-0.08267 2s 2. -284.99757 -284.99757-0.08232 -285.07990 -285.07990 0.0592 0.0592 -0.23110 -0.06744-0.08099 2p 6. -255.62883 -255.62883-0.08242 -255.71125 -255.71125 0.0625 0.0625 -0.72296 -0.08169-0.08186-0.08197-0.08206-0.08218 3s 2. -55.80338 -55.80338-0.08107 -55.88445 -55.88445 0.1339 0.1338 -0.86760 -0.06668-0.07795 3p 6. -45.84715 -45.84715-0.08107 -45.92822 -45.92822 0.1477 0.1476 -1.34526 -0.07880-0.07928-0.07960-0.07983-0.08015 3d 10. -30.05088 -30.05088-0.08120 -30.13207 -30.13207 0.1824 0.1822 -2.15235 -0.08039-0.08049-0.08057-0.08064-0.08095 4s 2. -9.52523 -9.52523-0.07794 -9.60317 -9.60317 0.3240 0.3227 -2.28909 -0.06414-0.07260 4p 6. -6.42567 -6.42567-0.07740 -6.50307 -6.50307 0.3945 0.3921 -2.73538 -0.07242-0.07363-0.07437-0.07491-0.07565 4d 9. -1.90322 -1.90322-0.07469 -1.97791 -1.97791 0.7249 0.7110 -3.39164 -0.07030-0.07165-0.07235-0.07285-0.07431 5s 1. -1.02836 -1.02836-0.05750 -1.08586 -1.08586 0.9861 0.9597 -3.44893 -0.05729 4f 1. -0.06254 -0.06254-0.00085 -0.06339 -0.06339 3.9989 3.9719 -3.44978 -0.00085 ecorrt= -3.63631 (old) ect= -3.44978 (new) etotrl= 0.00000 + 0.00000 + 0.00000 etot= -10621.29833 -10621.29833 -10624.93464 -10624.93464 -10624.74811 -10624.74811 -10624.74811 ag i d9 5s4f 10 -10624.7481 0 1.8202 2 0.0000 2 0.1807 3 0.0098 3 14.1972 4 0.0021 4 0.0012 4 0.0008 4 0.0250 4 t(run)= 16.38, t(job)=1020.59 seconds 47 1ag i d9 5s5f 4d9 5s 5f ag i d9 5s5f nconf= 60 z= 47 ncores=10 nvales= 1 ion= 0 r(i)/x(i)=0.24532669 ca1=0.700 tolstb=1.000 tolk-2=1.00000 tolend= 0.5E-07 thresh= 0.1E-10 kut= 0 exf=1.000 corrf=0.000 ca0= 0.500 rcn mod 32 ihf1= 0 mesh=2601 idb= 481 rdb= 100.461 emx= 0.10 r(mesh)=5426.209 irel= 1 ib=2600 t(run)= 10.80, t(job)=1031.40 seconds nl wnl ee az (r-3) (r-2) (r-1) (r+1) (r+2) (r+3) (r+4) (r+6) 1s 2. -1885.40513 881.505 0.000E+00 5.213E+03 4.936E+01 3.112E-02 1.308E-03 6.934E-05 4.438E-06 2.867E-08 2s 2. -280.69271 295.093 0.000E+00 5.731E+02 1.123E+01 1.350E-01 2.146E-02 3.880E-03 7.892E-04 4.505E-05 2p 6. -254.55904 3360.615 3.659E+03 1.600E+02 1.083E+01 1.175E-01 1.684E-02 2.853E-03 5.593E-04 3.126E-05 3s 2. -52.90316 127.558 0.000E+00 1.088E+02 3.931E+00 3.700E-01 1.565E-01 7.317E-02 3.748E-02 1.276E-02 3p 6. -43.79345 1500.501 6.406E+02 3.005E+01 3.735E+00 3.687E-01 1.577E-01 7.538E-02 3.986E-02 1.483E-02 3d 10. -29.54828 3212.018 9.187E+01 1.571E+01 3.533E+00 3.449E-01 1.415E-01 6.771E-02 3.719E-02 1.613E-02 4s 2. -8.54189 56.166 0.000E+00 2.160E+01 1.520E+00 9.114E-01 9.418E-01 1.071E+00 1.333E+00 2.683E+00 4p 6. -5.79138 623.307 1.083E+02 5.563E+00 1.363E+00 9.982E-01 1.142E+00 1.455E+00 2.052E+00 5.497E+00 4d 9. -1.79602 1073.600 8.994E+00 1.934E+00 1.004E+00 1.343E+00 2.170E+00 4.123E+00 9.126E+00 6.781E+01 5s 1. -1.12261 17.118 0.000E+00 2.118E+00 4.675E-01 2.734E+00 8.474E+00 2.924E+01 1.117E+02 2.172E+03 5f 1. -0.04007 0.164 2.002E-04 2.330E-03 4.023E-02 3.141E+01 1.119E+03 4.301E+04 1.748E+06 3.337E+09 47. 1.318E+04 2.725E+02 6.148E+01 1.159E+03 4.309E+04 1.748E+06 3.337E+09 1. 2.805E+02 5.799E+00 1.308E+00 2.466E+01 9.168E+02 3.720E+04 7.100E+07 --------------------zeta--------------------- nl wnl ----blume-watson---- -----(r*vi)----- i (ryd) eps s evel edar evel+edar erel (ryd) (cm-1) (ryd) (cm-1) 1s 2. 0.00000 0.000 0.00000 0.000-2274.99710 -1877.14144 -398.57966 331.78289 -66.797 -1943.93821 2s 2. 0.00000 0.000 0.00000 0.000 -567.83897 -281.97735 -54.20917 36.23357 -17.976 -299.95296 2p 6. 8.55126 938392.338 8.80382 966107.343 -555.31980 -254.70620 -7.22309 -0.01377 -7.223 -261.92929 3s 2. 0.00000 0.000 0.00000 0.000 -234.94724 -54.50867 -10.56476 6.74711 -3.818 -58.32632 3p 6. 1.49487 164042.949 1.53306 168233.440 -227.35202 -45.35654 -1.64604 -0.00221 -1.646 -47.00258 3d 10. 0.17194 18868.612 0.18433 20228.021 -218.95974 -30.77405 -0.37684 -0.01081 -0.377 -31.15089 4s 2. 0.00000 0.000 0.00000 0.000 -108.40486 -9.29957 -2.07114 1.30745 -0.764 -10.06326 4p 6. 0.25235 27692.530 0.25851 28367.746 -99.73443 -6.50645 -0.29425 -0.00026 -0.294 -6.80071 4d 9. 0.01659 1820.209 0.01763 1934.373 -77.91714 -2.33142 -0.04242 -0.00102 -0.042 -2.37385 5s 1. 0.00000 0.000 0.00000 0.000 -39.89569 -1.19051 -0.19277 0.12144 -0.071 -1.26184 5f 1. 0.00000 0.025 0.00000 0.001 -3.74146 -0.02623 0.00000 0.00000 0.000 -0.02623 ag i d9 5s5f nconf= 60 z= 47 ion= 0 kut=-1 exf=0.650 corrf=0.000 ca1=0.700 ca0=0.500 without correlation with correlation ----------------------- ----------------------- nl wnl eps fg eps fgr corr eps fg eps fgr n*r n*rc ect ec----------------- 1s 2. -1886.25195 -1886.25195-0.08290 -1886.33486 -1886.33486 0.0230 0.0230 -0.08267 0.00000-0.08267 2s 2. -285.04250 -285.04250-0.08232 -285.12482 -285.12482 0.0592 0.0592 -0.23110 -0.06744-0.08099 2p 6. -255.67375 -255.67375-0.08242 -255.75617 -255.75617 0.0625 0.0625 -0.72296 -0.08169-0.08186-0.08197-0.08206-0.08218 3s 2. -55.84830 -55.84830-0.08107 -55.92937 -55.92937 0.1338 0.1337 -0.86760 -0.06668-0.07795 3p 6. -45.89208 -45.89208-0.08107 -45.97314 -45.97314 0.1476 0.1475 -1.34526 -0.07880-0.07928-0.07960-0.07983-0.08015 3d 10. -30.09580 -30.09580-0.08120 -30.17700 -30.17700 0.1823 0.1820 -2.15235 -0.08039-0.08049-0.08057-0.08064-0.08095 4s 2. -9.57015 -9.57015-0.07794 -9.64809 -9.64809 0.3233 0.3219 -2.28909 -0.06414-0.07260 4p 6. -6.47059 -6.47059-0.07740 -6.54799 -6.54799 0.3931 0.3908 -2.73538 -0.07242-0.07363-0.07437-0.07491-0.07565 4d 9. -1.94815 -1.94815-0.07469 -2.02283 -2.02283 0.7165 0.7031 -3.39164 -0.07030-0.07165-0.07235-0.07285-0.07431 5s 1. -1.07329 -1.07329-0.05748 -1.13077 -1.13077 0.9653 0.9404 -3.44893 -0.05730 5f 1. -0.04003 -0.04003-0.00056 -0.04058 -0.04058 4.9984 4.9639 -3.44949 -0.00056 ecorrt= -3.63600 (old) ect= -3.44949 (new) etotrl= 0.00000 + 0.00000 + 0.00000 etot= -10621.27579 -10621.27579 -10624.91179 -10624.91179 -10624.72528 -10624.72528 -10624.72528 ag i d9 5s5f 10 -10624.7253 0 1.8202 2 0.0000 2 0.0947 3 0.0068 3 14.1977 4 0.0020 4 0.0011 4 0.0007 4 0.0213 4 t(run)= 15.84, t(job)=1036.44 seconds 47 1ag i d9 5s6f 4d9 5s 6f ag i d9 5s6f nconf= 61 z= 47 ncores=10 nvales= 1 ion= 0 r(i)/x(i)=0.24532669 ca1=0.700 tolstb=1.000 tolk-2=1.00000 tolend= 0.5E-07 thresh= 0.1E-10 kut= 0 exf=1.000 corrf=0.000 ca0= 0.500 rcn mod 32 ihf1= 0 mesh=2601 idb= 481 rdb= 100.461 emx= 0.10 r(mesh)=5426.209 irel= 1 ib=2600 t(run)= 13.25, t(job)=1049.69 seconds nl wnl ee az (r-3) (r-2) (r-1) (r+1) (r+2) (r+3) (r+4) (r+6) 1s 2. -1885.42962 881.504 0.000E+00 5.213E+03 4.936E+01 3.112E-02 1.308E-03 6.934E-05 4.438E-06 2.867E-08 2s 2. -280.71720 295.093 0.000E+00 5.731E+02 1.123E+01 1.350E-01 2.146E-02 3.880E-03 7.892E-04 4.505E-05 2p 6. -254.58353 3360.615 3.659E+03 1.600E+02 1.083E+01 1.175E-01 1.684E-02 2.853E-03 5.593E-04 3.126E-05 3s 2. -52.92765 127.558 0.000E+00 1.088E+02 3.931E+00 3.700E-01 1.565E-01 7.317E-02 3.748E-02 1.276E-02 3p 6. -43.81794 1500.501 6.406E+02 3.005E+01 3.735E+00 3.687E-01 1.577E-01 7.538E-02 3.986E-02 1.483E-02 3d 10. -29.57278 3212.018 9.187E+01 1.571E+01 3.533E+00 3.449E-01 1.415E-01 6.771E-02 3.719E-02 1.613E-02 4s 2. -8.56638 56.166 0.000E+00 2.160E+01 1.520E+00 9.114E-01 9.418E-01 1.071E+00 1.333E+00 2.683E+00 4p 6. -5.81587 623.307 1.083E+02 5.563E+00 1.363E+00 9.982E-01 1.142E+00 1.455E+00 2.052E+00 5.497E+00 4d 9. -1.82051 1073.600 8.994E+00 1.934E+00 1.004E+00 1.343E+00 2.170E+00 4.123E+00 9.126E+00 6.781E+01 5s 1. -1.14710 17.118 0.000E+00 2.118E+00 4.675E-01 2.734E+00 8.473E+00 2.924E+01 1.117E+02 2.170E+03 6f 1. -0.02783 0.147 1.183E-04 1.359E-03 2.798E-02 4.785E+01 2.596E+03 1.503E+05 9.104E+06 3.730E+10 47. 1.318E+04 2.725E+02 7.792E+01 2.635E+03 1.504E+05 9.104E+06 3.730E+10 1. 2.805E+02 5.799E+00 1.658E+00 5.607E+01 3.200E+03 1.937E+05 7.935E+08 --------------------zeta--------------------- nl wnl ----blume-watson---- -----(r*vi)----- i (ryd) eps s evel edar evel+edar erel (ryd) (cm-1) (ryd) (cm-1) 1s 2. 0.00000 0.000 0.00000 0.000-2274.99710 -1877.16593 -398.57965 331.78285 -66.797 -1943.96273 2s 2. 0.00000 0.000 0.00000 0.000 -567.83896 -282.00184 -54.20917 36.23356 -17.976 -299.97745 2p 6. 8.55126 938392.338 8.80382 966107.343 -555.31980 -254.73069 -7.22309 -0.01377 -7.223 -261.95378 3s 2. 0.00000 0.000 0.00000 0.000 -234.94724 -54.53316 -10.56476 6.74711 -3.818 -58.35081 3p 6. 1.49487 164042.948 1.53306 168233.439 -227.35202 -45.38104 -1.64604 -0.00221 -1.646 -47.02707 3d 10. 0.17194 18868.612 0.18433 20228.020 -218.95974 -30.79854 -0.37684 -0.01081 -0.377 -31.17538 4s 2. 0.00000 0.000 0.00000 0.000 -108.40486 -9.32406 -2.07114 1.30745 -0.764 -10.08775 4p 6. 0.25235 27692.526 0.25851 28367.741 -99.73442 -6.53095 -0.29425 -0.00026 -0.294 -6.82520 4d 9. 0.01659 1820.208 0.01763 1934.372 -77.91714 -2.35591 -0.04242 -0.00102 -0.042 -2.39834 5s 1. 0.00000 0.000 0.00000 0.000 -39.89652 -1.21492 -0.19278 0.12144 -0.071 -1.28625 6f 1. 0.00000 0.014 0.00000 0.001 -2.60185 -0.01962 0.00000 0.00000 0.000 -0.01962 ag i d9 5s6f nconf= 61 z= 47 ion= 0 kut=-1 exf=0.650 corrf=0.000 ca1=0.700 ca0=0.500 without correlation with correlation ----------------------- ----------------------- nl wnl eps fg eps fgr corr eps fg eps fgr n*r n*rc ect ec----------------- 1s 2. -1886.27644 -1886.27644-0.08290 -1886.35935 -1886.35935 0.0230 0.0230 -0.08267 0.00000-0.08267 2s 2. -285.06699 -285.06699-0.08232 -285.14931 -285.14931 0.0592 0.0592 -0.23110 -0.06744-0.08099 2p 6. -255.69824 -255.69824-0.08242 -255.78066 -255.78066 0.0625 0.0625 -0.72296 -0.08169-0.08186-0.08197-0.08206-0.08218 3s 2. -55.87279 -55.87279-0.08107 -55.95386 -55.95386 0.1338 0.1337 -0.86760 -0.06668-0.07795 3p 6. -45.91657 -45.91657-0.08107 -45.99763 -45.99763 0.1476 0.1474 -1.34526 -0.07880-0.07928-0.07960-0.07983-0.08015 3d 10. -30.12029 -30.12029-0.08120 -30.20149 -30.20149 0.1822 0.1820 -2.15235 -0.08039-0.08049-0.08057-0.08064-0.08095 4s 2. -9.59464 -9.59464-0.07794 -9.67258 -9.67258 0.3228 0.3215 -2.28909 -0.06414-0.07260 4p 6. -6.49508 -6.49508-0.07740 -6.57248 -6.57248 0.3924 0.3901 -2.73538 -0.07242-0.07363-0.07437-0.07491-0.07565 4d 9. -1.97264 -1.97264-0.07469 -2.04733 -2.04733 0.7120 0.6989 -3.39164 -0.07030-0.07165-0.07235-0.07285-0.07431 5s 1. -1.09779 -1.09779-0.05744 -1.15523 -1.15523 0.9544 0.9304 -3.44893 -0.05730 6f 1. -0.02780 -0.02780-0.00036 -0.02815 -0.02815 5.9980 5.9598 -3.44929 -0.00036 ecorrt= -3.63576 (old) ect= -3.44929 (new) etotrl= 0.00000 + 0.00000 + 0.00000 etot= -10621.26355 -10621.26355 -10624.89931 -10624.89931 -10624.71284 -10624.71284 -10624.71284 ag i d9 5s6f 10 -10624.7128 0 1.8202 2 0.0000 2 0.0559 3 0.0046 3 14.1983 4 0.0015 4 0.0008 4 0.0006 4 0.0156 4 t(run)= 18.44, t(job)=1054.88 seconds 47 1ag i d9 5s7f 4d9 5s 7f ag i d9 5s7f nconf= 62 z= 47 ncores=10 nvales= 1 ion= 0 r(i)/x(i)=0.24532669 ca1=0.700 tolstb=1.000 tolk-2=1.00000 tolend= 0.5E-07 thresh= 0.1E-10 kut= 0 exf=1.000 corrf=0.000 ca0= 0.500 rcn mod 32 ihf1= 0 mesh=2601 idb= 481 rdb= 100.461 emx= 0.10 r(mesh)=5426.209 irel= 1 ib=2600 t(run)= 13.01, t(job)=1067.88 seconds nl wnl ee az (r-3) (r-2) (r-1) (r+1) (r+2) (r+3) (r+4) (r+6) 1s 2. -1885.44442 881.504 0.000E+00 5.213E+03 4.936E+01 3.112E-02 1.308E-03 6.934E-05 4.438E-06 2.867E-08 2s 2. -280.73201 295.093 0.000E+00 5.731E+02 1.123E+01 1.350E-01 2.146E-02 3.880E-03 7.892E-04 4.505E-05 2p 6. -254.59833 3360.615 3.659E+03 1.600E+02 1.083E+01 1.175E-01 1.684E-02 2.853E-03 5.593E-04 3.126E-05 3s 2. -52.94246 127.558 0.000E+00 1.088E+02 3.931E+00 3.700E-01 1.565E-01 7.317E-02 3.748E-02 1.276E-02 3p 6. -43.83275 1500.501 6.406E+02 3.005E+01 3.735E+00 3.687E-01 1.577E-01 7.538E-02 3.986E-02 1.483E-02 3d 10. -29.58758 3212.018 9.187E+01 1.571E+01 3.533E+00 3.449E-01 1.415E-01 6.771E-02 3.719E-02 1.613E-02 4s 2. -8.58119 56.166 0.000E+00 2.160E+01 1.520E+00 9.114E-01 9.418E-01 1.071E+00 1.333E+00 2.683E+00 4p 6. -5.83068 623.307 1.083E+02 5.563E+00 1.363E+00 9.982E-01 1.142E+00 1.455E+00 2.052E+00 5.497E+00 4d 9. -1.83532 1073.600 8.994E+00 1.934E+00 1.004E+00 1.343E+00 2.170E+00 4.123E+00 9.126E+00 6.781E+01 5s 1. -1.16191 17.119 0.000E+00 2.118E+00 4.675E-01 2.734E+00 8.473E+00 2.924E+01 1.117E+02 2.170E+03 7f 1. -0.02045 0.128 7.576E-05 8.615E-04 2.057E-02 6.729E+01 5.116E+03 4.131E+05 3.470E+07 2.685E+11 47. 1.318E+04 2.725E+02 9.736E+01 5.156E+03 4.131E+05 3.470E+07 2.685E+11 1. 2.805E+02 5.798E+00 2.072E+00 1.097E+02 8.790E+03 7.383E+05 5.712E+09 --------------------zeta--------------------- nl wnl ----blume-watson---- -----(r*vi)----- i (ryd) eps s evel edar evel+edar erel (ryd) (cm-1) (ryd) (cm-1) 1s 2. 0.00000 0.000 0.00000 0.000-2274.99709 -1877.18073 -398.57964 331.78282 -66.797 -1943.97755 2s 2. 0.00000 0.000 0.00000 0.000 -567.83896 -282.01664 -54.20917 36.23356 -17.976 -299.99226 2p 6. 8.55126 938392.338 8.80382 966107.343 -555.31980 -254.74550 -7.22309 -0.01377 -7.223 -261.96858 3s 2. 0.00000 0.000 0.00000 0.000 -234.94724 -54.54797 -10.56476 6.74711 -3.818 -58.36562 3p 6. 1.49487 164042.948 1.53306 168233.438 -227.35202 -45.39584 -1.64604 -0.00221 -1.646 -47.04188 3d 10. 0.17194 18868.611 0.18433 20228.020 -218.95974 -30.81335 -0.37684 -0.01081 -0.377 -31.19019 4s 2. 0.00000 0.000 0.00000 0.000 -108.40486 -9.33886 -2.07114 1.30745 -0.764 -10.10256 4p 6. 0.25235 27692.523 0.25851 28367.738 -99.73442 -6.54575 -0.29425 -0.00026 -0.294 -6.84001 4d 9. 0.01659 1820.207 0.01763 1934.371 -77.91713 -2.37072 -0.04242 -0.00102 -0.042 -2.41315 5s 1. 0.00000 0.000 0.00000 0.000 -39.89708 -1.22966 -0.19278 0.12145 -0.071 -1.30099 7f 1. 0.00000 0.009 0.00000 0.001 -1.91284 -0.01499 0.00000 0.00000 0.000 -0.01499 ag i d9 5s7f nconf= 62 z= 47 ion= 0 kut=-1 exf=0.650 corrf=0.000 ca1=0.700 ca0=0.500 without correlation with correlation ----------------------- ----------------------- nl wnl eps fg eps fgr corr eps fg eps fgr n*r n*rc ect ec----------------- 1s 2. -1886.29125 -1886.29125-0.08290 -1886.37415 -1886.37415 0.0230 0.0230 -0.08267 0.00000-0.08267 2s 2. -285.08179 -285.08179-0.08232 -285.16411 -285.16411 0.0592 0.0592 -0.23110 -0.06744-0.08099 2p 6. -255.71305 -255.71305-0.08242 -255.79546 -255.79546 0.0625 0.0625 -0.72296 -0.08169-0.08186-0.08197-0.08206-0.08218 3s 2. -55.88760 -55.88760-0.08107 -55.96867 -55.96867 0.1338 0.1337 -0.86760 -0.06668-0.07795 3p 6. -45.93138 -45.93138-0.08107 -46.01244 -46.01244 0.1476 0.1474 -1.34526 -0.07880-0.07928-0.07960-0.07983-0.08015 3d 10. -30.13510 -30.13510-0.08120 -30.21629 -30.21629 0.1822 0.1819 -2.15235 -0.08039-0.08049-0.08057-0.08064-0.08095 4s 2. -9.60945 -9.60945-0.07794 -9.68739 -9.68739 0.3226 0.3213 -2.28909 -0.06414-0.07260 4p 6. -6.50989 -6.50989-0.07740 -6.58729 -6.58729 0.3919 0.3896 -2.73538 -0.07242-0.07363-0.07437-0.07491-0.07565 4d 9. -1.98745 -1.98745-0.07469 -2.06214 -2.06214 0.7093 0.6964 -3.39164 -0.07030-0.07165-0.07235-0.07285-0.07431 5s 1. -1.11260 -1.11260-0.05741 -1.17002 -1.17002 0.9480 0.9245 -3.44893 -0.05730 7f 1. -0.02042 -0.02042-0.00024 -0.02066 -0.02066 6.9978 6.9573 -3.44917 -0.00024 ecorrt= -3.63561 (old) ect= -3.44917 (new) etotrl= 0.00000 + 0.00000 + 0.00000 etot= -10621.25617 -10621.25617 -10624.89178 -10624.89178 -10624.70534 -10624.70534 -10624.70534 ag i d9 5s7f 10 -10624.7053 0 1.8202 2 0.0000 2 0.0357 3 0.0031 3 14.1987 4 0.0011 4 0.0006 4 0.0004 4 0.0113 4 t(run)= 18.26, t(job)=1073.13 seconds 47 1ag i d9 5s8f 4d9 5s 8f ag i d9 5s8f nconf= 63 z= 47 ncores=10 nvales= 1 ion= 0 r(i)/x(i)=0.24532669 ca1=0.700 tolstb=1.000 tolk-2=1.00000 tolend= 0.5E-07 thresh= 0.1E-10 kut= 0 exf=1.000 corrf=0.000 ca0= 0.500 rcn mod 32 ihf1= 0 mesh=2601 idb= 481 rdb= 100.461 emx= 0.10 r(mesh)=5426.209 irel= 1 ib=2600 t(run)= 12.97, t(job)=1086.10 seconds nl wnl ee az (r-3) (r-2) (r-1) (r+1) (r+2) (r+3) (r+4) (r+6) 1s 2. -1885.45404 881.504 0.000E+00 5.213E+03 4.936E+01 3.112E-02 1.308E-03 6.934E-05 4.438E-06 2.867E-08 2s 2. -280.74163 295.093 0.000E+00 5.731E+02 1.123E+01 1.350E-01 2.146E-02 3.880E-03 7.892E-04 4.505E-05 2p 6. -254.60796 3360.615 3.659E+03 1.600E+02 1.083E+01 1.175E-01 1.684E-02 2.853E-03 5.593E-04 3.126E-05 3s 2. -52.95208 127.558 0.000E+00 1.088E+02 3.931E+00 3.700E-01 1.565E-01 7.317E-02 3.748E-02 1.276E-02 3p 6. -43.84237 1500.501 6.406E+02 3.005E+01 3.735E+00 3.687E-01 1.577E-01 7.538E-02 3.986E-02 1.483E-02 3d 10. -29.59721 3212.018 9.187E+01 1.571E+01 3.533E+00 3.449E-01 1.415E-01 6.771E-02 3.719E-02 1.613E-02 4s 2. -8.59081 56.166 0.000E+00 2.160E+01 1.520E+00 9.114E-01 9.418E-01 1.071E+00 1.333E+00 2.683E+00 4p 6. -5.84030 623.307 1.083E+02 5.563E+00 1.363E+00 9.982E-01 1.142E+00 1.455E+00 2.052E+00 5.497E+00 4d 9. -1.84494 1073.600 8.994E+00 1.934E+00 1.004E+00 1.343E+00 2.170E+00 4.123E+00 9.126E+00 6.781E+01 5s 1. -1.17153 17.119 0.000E+00 2.118E+00 4.675E-01 2.734E+00 8.473E+00 2.923E+01 1.116E+02 2.169E+03 8f 1. -0.01566 0.112 5.143E-05 5.800E-04 1.575E-02 8.973E+01 9.070E+03 9.705E+05 1.077E+08 1.439E+12 47. 1.318E+04 2.725E+02 1.198E+02 9.109E+03 9.705E+05 1.077E+08 1.439E+12 1. 2.805E+02 5.798E+00 2.549E+00 1.938E+02 2.065E+04 2.292E+06 3.062E+10 --------------------zeta--------------------- nl wnl ----blume-watson---- -----(r*vi)----- i (ryd) eps s evel edar evel+edar erel (ryd) (cm-1) (ryd) (cm-1) 1s 2. 0.00000 0.000 0.00000 0.000-2274.99709 -1877.19035 -398.57963 331.78281 -66.797 -1943.98718 2s 2. 0.00000 0.000 0.00000 0.000 -567.83896 -282.02627 -54.20917 36.23356 -17.976 -300.00188 2p 6. 8.55126 938392.337 8.80382 966107.343 -555.31980 -254.75512 -7.22309 -0.01377 -7.223 -261.97821 3s 2. 0.00000 0.000 0.00000 0.000 -234.94724 -54.55760 -10.56476 6.74711 -3.818 -58.37525 3p 6. 1.49487 164042.947 1.53306 168233.438 -227.35202 -45.40547 -1.64604 -0.00221 -1.646 -47.05150 3d 10. 0.17194 18868.611 0.18433 20228.020 -218.95974 -30.82297 -0.37684 -0.01081 -0.377 -31.19981 4s 2. 0.00000 0.000 0.00000 0.000 -108.40486 -9.34849 -2.07114 1.30745 -0.764 -10.11218 4p 6. 0.25235 27692.520 0.25851 28367.736 -99.73442 -6.55538 -0.29425 -0.00026 -0.294 -6.84963 4d 9. 0.01659 1820.207 0.01763 1934.371 -77.91714 -2.38035 -0.04242 -0.00102 -0.042 -2.42277 5s 1. 0.00000 0.000 0.00000 0.000 -39.89744 -1.23923 -0.19279 0.12145 -0.071 -1.31057 8f 1. 0.00000 0.006 0.00000 0.000 -1.46491 -0.01175 0.00000 0.00000 0.000 -0.01175 ag i d9 5s8f nconf= 63 z= 47 ion= 0 kut=-1 exf=0.650 corrf=0.000 ca1=0.700 ca0=0.500 without correlation with correlation ----------------------- ----------------------- nl wnl eps fg eps fgr corr eps fg eps fgr n*r n*rc ect ec----------------- 1s 2. -1886.30087 -1886.30087-0.08290 -1886.38377 -1886.38377 0.0230 0.0230 -0.08267 0.00000-0.08267 2s 2. -285.09142 -285.09142-0.08232 -285.17374 -285.17374 0.0592 0.0592 -0.23110 -0.06744-0.08099 2p 6. -255.72267 -255.72267-0.08242 -255.80509 -255.80509 0.0625 0.0625 -0.72296 -0.08169-0.08186-0.08197-0.08206-0.08218 3s 2. -55.89723 -55.89723-0.08107 -55.97829 -55.97829 0.1338 0.1337 -0.86760 -0.06668-0.07795 3p 6. -45.94100 -45.94100-0.08107 -46.02207 -46.02207 0.1475 0.1474 -1.34526 -0.07880-0.07928-0.07960-0.07983-0.08015 3d 10. -30.14472 -30.14472-0.08120 -30.22592 -30.22592 0.1821 0.1819 -2.15235 -0.08039-0.08049-0.08057-0.08064-0.08095 4s 2. -9.61908 -9.61908-0.07794 -9.69702 -9.69702 0.3224 0.3211 -2.28909 -0.06414-0.07260 4p 6. -6.51951 -6.51951-0.07740 -6.59692 -6.59692 0.3916 0.3893 -2.73538 -0.07242-0.07363-0.07437-0.07491-0.07565 4d 9. -1.99707 -1.99707-0.07469 -2.07176 -2.07176 0.7076 0.6948 -3.39164 -0.07030-0.07165-0.07235-0.07285-0.07431 5s 1. -1.12223 -1.12223-0.05739 -1.17962 -1.17962 0.9440 0.9207 -3.44893 -0.05730 8f 1. -0.01563 -0.01563-0.00017 -0.01580 -0.01580 7.9976 7.9557 -3.44910 -0.00017 ecorrt= -3.63552 (old) ect= -3.44910 (new) etotrl= 0.00000 + 0.00000 + 0.00000 etot= -10621.25137 -10621.25137 -10624.88689 -10624.88689 -10624.70047 -10624.70047 -10624.70047 ag i d9 5s8f 10 -10624.7005 0 1.8202 2 0.0000 2 0.0242 3 0.0022 3 14.1989 4 0.0008 4 0.0005 4 0.0003 4 0.0083 4 t(run)= 18.44, t(job)=1091.57 seconds 47 1ag i d9 5s9f 4d9 5s 9f ag i d9 5s9f nconf= 64 z= 47 ncores=10 nvales= 1 ion= 0 r(i)/x(i)=0.24532669 ca1=0.700 tolstb=1.000 tolk-2=1.00000 tolend= 0.5E-07 thresh= 0.1E-10 kut= 0 exf=1.000 corrf=0.000 ca0= 0.500 rcn mod 32 ihf1= 0 mesh=2601 idb= 481 rdb= 100.461 emx= 0.10 r(mesh)=5426.209 irel= 1 ib=2600 t(run)= 12.82, t(job)=1104.39 seconds nl wnl ee az (r-3) (r-2) (r-1) (r+1) (r+2) (r+3) (r+4) (r+6) 1s 2. -1885.46065 881.504 0.000E+00 5.213E+03 4.936E+01 3.112E-02 1.308E-03 6.934E-05 4.438E-06 2.867E-08 2s 2. -280.74824 295.093 0.000E+00 5.731E+02 1.123E+01 1.350E-01 2.146E-02 3.880E-03 7.892E-04 4.505E-05 2p 6. -254.61456 3360.615 3.659E+03 1.600E+02 1.083E+01 1.175E-01 1.684E-02 2.853E-03 5.593E-04 3.126E-05 3s 2. -52.95869 127.558 0.000E+00 1.088E+02 3.931E+00 3.700E-01 1.565E-01 7.317E-02 3.748E-02 1.276E-02 3p 6. -43.84898 1500.501 6.406E+02 3.005E+01 3.735E+00 3.687E-01 1.577E-01 7.538E-02 3.986E-02 1.483E-02 3d 10. -29.60381 3212.018 9.187E+01 1.571E+01 3.533E+00 3.449E-01 1.415E-01 6.771E-02 3.719E-02 1.613E-02 4s 2. -8.59742 56.166 0.000E+00 2.160E+01 1.520E+00 9.114E-01 9.418E-01 1.071E+00 1.333E+00 2.683E+00 4p 6. -5.84691 623.307 1.083E+02 5.563E+00 1.363E+00 9.982E-01 1.142E+00 1.455E+00 2.052E+00 5.497E+00 4d 9. -1.85155 1073.600 8.994E+00 1.934E+00 1.004E+00 1.343E+00 2.170E+00 4.123E+00 9.126E+00 6.781E+01 5s 1. -1.17814 17.119 0.000E+00 2.118E+00 4.675E-01 2.734E+00 8.472E+00 2.923E+01 1.116E+02 2.169E+03 9f 1. -0.01238 0.098 3.652E-05 4.091E-04 1.245E-02 1.152E+02 1.490E+04 2.038E+06 2.885E+08 6.225E+12 47. 1.318E+04 2.725E+02 1.452E+02 1.494E+04 2.038E+06 2.885E+08 6.225E+12 1. 2.805E+02 5.798E+00 3.090E+00 3.180E+02 4.336E+04 6.138E+06 1.324E+11 --------------------zeta--------------------- nl wnl ----blume-watson---- -----(r*vi)----- i (ryd) eps s evel edar evel+edar erel (ryd) (cm-1) (ryd) (cm-1) 1s 2. 0.00000 0.000 0.00000 0.000-2274.99709 -1877.19696 -398.57963 331.78280 -66.797 -1943.99379 2s 2. 0.00000 0.000 0.00000 0.000 -567.83896 -282.03288 -54.20917 36.23356 -17.976 -300.00849 2p 6. 8.55126 938392.337 8.80382 966107.342 -555.31980 -254.76173 -7.22309 -0.01377 -7.223 -261.98482 3s 2. 0.00000 0.000 0.00000 0.000 -234.94724 -54.56420 -10.56476 6.74711 -3.818 -58.38185 3p 6. 1.49487 164042.947 1.53306 168233.438 -227.35202 -45.41207 -1.64604 -0.00221 -1.646 -47.05811 3d 10. 0.17194 18868.611 0.18433 20228.020 -218.95974 -30.82958 -0.37684 -0.01081 -0.377 -31.20642 4s 2. 0.00000 0.000 0.00000 0.000 -108.40486 -9.35510 -2.07114 1.30745 -0.764 -10.11879 4p 6. 0.25235 27692.519 0.25851 28367.734 -99.73441 -6.56198 -0.29425 -0.00026 -0.294 -6.85624 4d 9. 0.01659 1820.207 0.01763 1934.371 -77.91714 -2.38695 -0.04242 -0.00102 -0.042 -2.42938 5s 1. 0.00000 0.000 0.00000 0.000 -39.89767 -1.24580 -0.19279 0.12145 -0.071 -1.31714 9f 1. 0.00000 0.004 0.00000 0.000 -1.15752 -0.00943 0.00000 0.00000 0.000 -0.00943 ag i d9 5s9f nconf= 64 z= 47 ion= 0 kut=-1 exf=0.650 corrf=0.000 ca1=0.700 ca0=0.500 without correlation with correlation ----------------------- ----------------------- nl wnl eps fg eps fgr corr eps fg eps fgr n*r n*rc ect ec----------------- 1s 2. -1886.30747 -1886.30747-0.08290 -1886.39038 -1886.39038 0.0230 0.0230 -0.08267 0.00000-0.08267 2s 2. -285.09802 -285.09802-0.08232 -285.18035 -285.18035 0.0592 0.0592 -0.23110 -0.06744-0.08099 2p 6. -255.72928 -255.72928-0.08242 -255.81170 -255.81170 0.0625 0.0625 -0.72296 -0.08169-0.08186-0.08197-0.08206-0.08218 3s 2. -55.90383 -55.90383-0.08107 -55.98490 -55.98490 0.1337 0.1336 -0.86760 -0.06668-0.07795 3p 6. -45.94761 -45.94761-0.08107 -46.02867 -46.02867 0.1475 0.1474 -1.34526 -0.07880-0.07928-0.07960-0.07983-0.08015 3d 10. -30.15133 -30.15133-0.08120 -30.23253 -30.23253 0.1821 0.1819 -2.15235 -0.08039-0.08049-0.08057-0.08064-0.08095 4s 2. -9.62568 -9.62568-0.07794 -9.70362 -9.70362 0.3223 0.3210 -2.28909 -0.06414-0.07260 4p 6. -6.52612 -6.52612-0.07740 -6.60352 -6.60352 0.3914 0.3891 -2.73538 -0.07242-0.07363-0.07437-0.07491-0.07565 4d 9. -2.00368 -2.00368-0.07469 -2.07837 -2.07837 0.7065 0.6936 -3.39164 -0.07030-0.07165-0.07235-0.07285-0.07431 5s 1. -1.12884 -1.12884-0.05738 -1.18621 -1.18621 0.9412 0.9182 -3.44893 -0.05730 9f 1. -0.01235 -0.01235-0.00012 -0.01247 -0.01247 8.9982 8.9553 -3.44905 -0.00012 ecorrt= -3.63545 (old) ect= -3.44905 (new) etotrl= 0.00000 + 0.00000 + 0.00000 etot= -10621.24809 -10621.24809 -10624.88354 -10624.88354 -10624.69714 -10624.69714 -10624.69714 ag i d9 5s9f 10 -10624.6971 0 1.8202 2 0.0000 2 0.0172 3 0.0016 3 14.1991 4 0.0006 4 0.0004 4 0.0002 4 0.0062 4 t(run)= 17.88, t(job)=1109.45 seconds 47 1ag i d8 5s2 4f 4d8 5s2 4f ag i d8 5s2 4f nconf= 65 z= 47 ncores=10 nvales= 1 ion= 0 r(i)/x(i)=0.24532669 ca1=0.700 tolstb=1.000 tolk-2=1.00000 tolend= 0.5E-07 thresh= 0.1E-10 kut= 0 exf=1.000 corrf=0.000 ca0= 0.500 rcn mod 32 ihf1= 0 mesh=2601 idb= 481 rdb= 100.461 emx= 0.10 r(mesh)=5426.209 irel= 1 ib=2600 t(run)= 10.80, t(job)=1120.26 seconds nl wnl ee az (r-3) (r-2) (r-1) (r+1) (r+2) (r+3) (r+4) (r+6) 1s 2. -1885.73648 881.501 0.000E+00 5.213E+03 4.936E+01 3.112E-02 1.308E-03 6.934E-05 4.438E-06 2.867E-08 2s 2. -281.04467 295.090 0.000E+00 5.731E+02 1.123E+01 1.350E-01 2.146E-02 3.880E-03 7.892E-04 4.505E-05 2p 6. -254.90947 3360.523 3.659E+03 1.600E+02 1.083E+01 1.175E-01 1.684E-02 2.853E-03 5.593E-04 3.126E-05 3s 2. -53.24479 127.566 0.000E+00 1.088E+02 3.931E+00 3.699E-01 1.565E-01 7.316E-02 3.747E-02 1.276E-02 3p 6. -44.13520 1500.628 6.407E+02 3.005E+01 3.736E+00 3.687E-01 1.577E-01 7.536E-02 3.985E-02 1.483E-02 3d 10. -29.89297 3212.648 9.190E+01 1.571E+01 3.534E+00 3.449E-01 1.415E-01 6.767E-02 3.716E-02 1.610E-02 4s 2. -8.85340 56.361 0.000E+00 2.174E+01 1.526E+00 9.084E-01 9.348E-01 1.058E+00 1.308E+00 2.589E+00 4p 6. -6.09123 627.380 1.097E+02 5.628E+00 1.372E+00 9.918E-01 1.126E+00 1.420E+00 1.979E+00 5.140E+00 4d 8. -2.05678 1110.478 9.598E+00 2.044E+00 1.035E+00 1.295E+00 2.001E+00 3.598E+00 7.470E+00 4.786E+01 5s 2. -1.13051 18.206 0.000E+00 2.382E+00 4.883E-01 2.639E+00 7.910E+00 2.640E+01 9.762E+01 1.782E+03 4f 1. -0.06258 0.212 3.853E-04 4.526E-03 6.280E-02 1.794E+01 3.580E+02 7.860E+03 1.883E+05 1.367E+08 47. 1.318E+04 2.724E+02 4.879E+01 4.012E+02 7.953E+03 1.886E+05 1.367E+08 1. 2.805E+02 5.796E+00 1.038E+00 8.537E+00 1.692E+02 4.012E+03 2.908E+06 --------------------zeta--------------------- nl wnl ----blume-watson---- -----(r*vi)----- i (ryd) eps s evel edar evel+edar erel (ryd) (cm-1) (ryd) (cm-1) 1s 2. 0.00000 0.000 0.00000 0.000-2274.99687 -1877.47264 -398.57702 331.78037 -66.797 -1944.26929 2s 2. 0.00000 0.000 0.00000 0.000 -567.83847 -282.32871 -54.20820 36.23298 -17.975 -300.30393 2p 6. 8.55089 938351.791 8.80341 966063.054 -555.31868 -255.05639 -7.22273 -0.01379 -7.223 -262.27912 3s 2. 0.00000 0.000 0.00000 0.000 -234.95283 -54.85069 -10.56625 6.74805 -3.818 -58.66889 3p 6. 1.49513 164071.820 1.53332 168262.173 -227.35931 -45.69865 -1.64633 -0.00222 -1.646 -47.34498 3d 10. 0.17200 18875.089 0.18440 20235.096 -218.97420 -31.11846 -0.37699 -0.01081 -0.377 -31.49544 4s 2. 0.00000 0.000 0.00000 0.000 -108.63631 -9.60571 -2.08558 1.31655 -0.769 -10.37474 4p 6. 0.25565 28054.463 0.26189 28738.636 -100.15713 -6.80184 -0.29814 -0.00026 -0.298 -7.09997 4d 8. 0.01773 1945.651 0.01884 2067.419 -79.86209 -2.60140 -0.04539 -0.00108 -0.045 -2.64679 5s 2. 0.00000 0.000 0.00000 0.000 -41.34428 -1.29002 -0.21809 0.13737 -0.081 -1.37074 4f 1. 0.00000 0.050 0.00000 0.003 -5.84035 -0.03394 0.00000 0.00000 0.000 -0.03394 ag i d8 5s2 4f nconf= 65 z= 47 ion= 0 kut=-1 exf=0.650 corrf=0.000 ca1=0.700 ca0=0.500 without correlation with correlation ----------------------- ----------------------- nl wnl eps fg eps fgr corr eps fg eps fgr n*r n*rc ect ec----------------- 1s 2. -1886.58483 -1886.58483-0.08290 -1886.66773 -1886.66773 0.0230 0.0230 -0.08267 0.00000-0.08267 2s 2. -285.39622 -285.39622-0.08232 -285.47854 -285.47854 0.0592 0.0592 -0.23110 -0.06744-0.08099 2p 6. -256.02304 -256.02304-0.08242 -256.10546 -256.10546 0.0625 0.0625 -0.72297 -0.08169-0.08186-0.08197-0.08206-0.08218 3s 2. -56.19767 -56.19767-0.08107 -56.27873 -56.27873 0.1334 0.1333 -0.86760 -0.06668-0.07795 3p 6. -46.23645 -46.23645-0.08107 -46.31751 -46.31751 0.1471 0.1469 -1.34527 -0.07880-0.07928-0.07960-0.07983-0.08016 3d 10. -30.43595 -30.43595-0.08120 -30.51715 -30.51715 0.1813 0.1810 -2.15236 -0.08040-0.08049-0.08057-0.08064-0.08095 4s 2. -9.87629 -9.87629-0.07792 -9.95421 -9.95421 0.3182 0.3170 -2.28930 -0.06429-0.07265 4p 6. -6.73518 -6.73518-0.07740 -6.81258 -6.81258 0.3853 0.3831 -2.73609 -0.07253-0.07372-0.07445-0.07498-0.07571 4d 8. -2.21381 -2.21381-0.07512 -2.28893 -2.28893 0.6721 0.6610 -3.32218 -0.07113-0.07225-0.07288-0.07334-0.07450 5s 2. -1.10116 -1.10116-0.06139 -1.16254 -1.16254 0.9530 0.9275 -3.44033 -0.05682-0.06134 4f 1. -0.06255 -0.06255-0.00092 -0.06347 -0.06347 3.9984 3.9694 -3.44125 -0.00092 ecorrt= -3.63036 (old) ect= -3.44125 (new) etotrl= 0.00000 + 0.00000 + 0.00000 etot= -10620.72005 -10620.72005 -10624.35041 -10624.35041 -10624.16131 -10624.16131 -10624.16131 ag i d8 5s2 4f 10 -10624.1613 0 76.4354 1 49.9834 1 1.9457 2 0.0000 2 0.1685 3 0.0085 3 0.0019 4 0.0011 4 0.0007 4 t(run)= 15.73, t(job)=1125.19 seconds 47 1ag i d10 6h 4d10 6h ag i d10 6h nconf= 66 z= 47 ncores= 9 nvales= 1 ion= 0 r(i)/x(i)=0.24532669 ca1=0.700 tolstb=1.000 tolk-2=1.00000 tolend= 0.5E-07 thresh= 0.1E-10 kut= 0 exf=1.000 corrf=0.000 ca0= 0.500 rcn mod 32 ihf1= 0 mesh=2601 idb= 481 rdb= 100.461 emx= 0.10 r(mesh)=5426.209 irel= 1 ib=2600 t(run)= 12.55, t(job)=1137.74 seconds nl wnl ee az (r-3) (r-2) (r-1) (r+1) (r+2) (r+3) (r+4) (r+6) 1s 2. -1885.09110 881.507 0.000E+00 5.213E+03 4.936E+01 3.112E-02 1.308E-03 6.934E-05 4.438E-06 2.867E-08 2s 2. -280.36199 295.095 0.000E+00 5.731E+02 1.123E+01 1.350E-01 2.146E-02 3.880E-03 7.892E-04 4.505E-05 2p 6. -254.22964 3360.692 3.659E+03 1.600E+02 1.083E+01 1.175E-01 1.683E-02 2.853E-03 5.593E-04 3.126E-05 3s 2. -52.57823 127.553 0.000E+00 1.088E+02 3.931E+00 3.700E-01 1.565E-01 7.318E-02 3.748E-02 1.276E-02 3p 6. -43.46844 1500.439 6.406E+02 3.004E+01 3.735E+00 3.687E-01 1.577E-01 7.538E-02 3.987E-02 1.484E-02 3d 10. -29.22127 3211.671 9.185E+01 1.570E+01 3.533E+00 3.450E-01 1.415E-01 6.773E-02 3.720E-02 1.614E-02 4s 2. -8.23564 56.016 0.000E+00 2.149E+01 1.516E+00 9.139E-01 9.475E-01 1.082E+00 1.354E+00 2.767E+00 4p 6. -5.49451 619.965 1.071E+02 5.509E+00 1.356E+00 1.004E+00 1.156E+00 1.486E+00 2.119E+00 5.841E+00 4d 10. -1.53323 1036.575 8.404E+00 1.825E+00 9.716E-01 1.397E+00 2.375E+00 4.802E+00 1.143E+01 1.006E+02 6h 1. -0.02778 0.000 2.806E-05 8.418E-04 2.778E-02 3.900E+01 1.638E+03 7.371E+04 3.538E+06 9.744E+09 47. 1.318E+04 2.727E+02 6.826E+01 1.673E+03 7.377E+04 3.538E+06 9.744E+09 1. 2.804E+02 5.802E+00 1.452E+00 3.560E+01 1.570E+03 7.528E+04 2.073E+08 --------------------zeta--------------------- nl wnl ----blume-watson---- -----(r*vi)----- i (ryd) eps s evel edar evel+edar erel (ryd) (cm-1) (ryd) (cm-1) 1s 2. 0.00000 0.000 0.00000 0.000-2274.99730 -1876.82753 -398.58176 331.78496 -66.797 -1943.62433 2s 2. 0.00000 0.000 0.00000 0.000 -567.83950 -281.64702 -54.21010 36.23414 -17.976 -299.62298 2p 6. 8.55158 938426.774 8.80416 966144.843 -555.32084 -254.37694 -7.22339 -0.01376 -7.223 -261.60033 3s 2. 0.00000 0.000 0.00000 0.000 -234.94456 -54.18336 -10.56400 6.74663 -3.817 -58.00073 3p 6. 1.49473 164028.098 1.53292 168218.910 -227.34854 -45.03118 -1.64589 -0.00221 -1.646 -46.67706 3d 10. 0.17191 18864.973 0.18429 20224.034 -218.95188 -30.44713 -0.37676 -0.01081 -0.377 -30.82389 4s 2. 0.00000 0.000 0.00000 0.000 -108.22126 -8.99776 -2.06002 1.30044 -0.760 -9.75735 4p 6. 0.24966 27397.078 0.25575 28064.979 -99.37775 -6.21346 -0.29109 -0.00026 -0.291 -6.50455 4d 10. 0.01547 1698.153 0.01645 1804.895 -75.87238 -2.05760 -0.03955 -0.00095 -0.040 -2.09715 6h 1. 0.00000 0.007 0.00000 0.000 -2.58333 -0.01485 0.00000 0.00000 0.000 -0.01485 ag i d10 6h nconf= 66 z= 47 ion= 0 kut=-1 exf=0.650 corrf=0.000 ca1=0.700 ca0=0.500 without correlation with correlation ----------------------- ----------------------- nl wnl eps fg eps fgr corr eps fg eps fgr n*r n*rc ect ec----------------- 1s 2. -1885.93673 -1885.93673-0.08290 -1886.01963 -1886.01963 0.0230 0.0230 -0.08267 0.00000-0.08267 2s 2. -284.71027 -284.71027-0.08232 -284.79259 -284.79259 0.0593 0.0593 -0.23110 -0.06744-0.08099 2p 6. -255.34512 -255.34512-0.08242 -255.42754 -255.42754 0.0626 0.0626 -0.72296 -0.08169-0.08186-0.08197-0.08206-0.08218 3s 2. -55.51712 -55.51712-0.08107 -55.59818 -55.59818 0.1342 0.1341 -0.86759 -0.06668-0.07795 3p 6. -45.56487 -45.56487-0.08107 -45.64594 -45.64594 0.1481 0.1480 -1.34526 -0.07880-0.07928-0.07960-0.07983-0.08015 3d 10. -29.77213 -29.77213-0.08120 -29.85332 -29.85332 0.1833 0.1830 -2.15235 -0.08039-0.08049-0.08057-0.08064-0.08095 4s 2. -9.26807 -9.26807-0.07796 -9.34603 -9.34603 0.3285 0.3271 -2.28891 -0.06401-0.07255 4p 6. -6.20428 -6.20428-0.07741 -6.28169 -6.28169 0.4015 0.3990 -2.73478 -0.07233-0.07355-0.07430-0.07484-0.07559 4d 10. -1.67972 -1.67972-0.07408 -1.75379 -1.75379 0.7716 0.7551 -3.45992 -0.06933-0.07096-0.07175-0.07230-0.07408 6h 1. -0.02778 -0.02778 0.00000 -0.02778 -0.02778 6.0000 6.0000 -3.45992 0.00000 ecorrt= -3.64659 (old) ect= -3.45992 (new) etotrl= 0.00000 + 0.00000 + 0.00000 etot= -10621.60505 -10621.60505 -10625.25165 -10625.25165 -10625.06497 -10625.06497 -10625.06497 ag i d10 6h 2 -10625.0650 0 0.0000 2 t(run)= 17.37, t(job)=1142.55 seconds 47 1ag i d10 7h 4d10 7h ag i d10 7h nconf= 67 z= 47 ncores= 9 nvales= 1 ion= 0 r(i)/x(i)=0.24532669 ca1=0.700 tolstb=1.000 tolk-2=1.00000 tolend= 0.5E-07 thresh= 0.1E-10 kut= 0 exf=1.000 corrf=0.000 ca0= 0.500 rcn mod 32 ihf1= 0 mesh=2601 idb= 481 rdb= 100.461 emx= 0.10 r(mesh)=5426.209 irel= 1 ib=2600 t(run)= 12.16, t(job)=1154.72 seconds nl wnl ee az (r-3) (r-2) (r-1) (r+1) (r+2) (r+3) (r+4) (r+6) 1s 2. -1885.10583 881.507 0.000E+00 5.213E+03 4.936E+01 3.112E-02 1.308E-03 6.934E-05 4.438E-06 2.867E-08 2s 2. -280.37673 295.095 0.000E+00 5.731E+02 1.123E+01 1.350E-01 2.146E-02 3.880E-03 7.892E-04 4.505E-05 2p 6. -254.24438 3360.692 3.659E+03 1.600E+02 1.083E+01 1.175E-01 1.683E-02 2.853E-03 5.593E-04 3.126E-05 3s 2. -52.59297 127.553 0.000E+00 1.088E+02 3.931E+00 3.700E-01 1.565E-01 7.318E-02 3.748E-02 1.276E-02 3p 6. -43.48318 1500.439 6.406E+02 3.004E+01 3.735E+00 3.687E-01 1.577E-01 7.538E-02 3.987E-02 1.484E-02 3d 10. -29.23601 3211.671 9.185E+01 1.570E+01 3.533E+00 3.450E-01 1.415E-01 6.773E-02 3.720E-02 1.614E-02 4s 2. -8.25037 56.016 0.000E+00 2.149E+01 1.516E+00 9.139E-01 9.475E-01 1.082E+00 1.354E+00 2.767E+00 4p 6. -5.50925 619.965 1.071E+02 5.509E+00 1.356E+00 1.004E+00 1.156E+00 1.486E+00 2.119E+00 5.841E+00 4d 10. -1.54797 1036.575 8.404E+00 1.825E+00 9.716E-01 1.397E+00 2.375E+00 4.802E+00 1.143E+01 1.006E+02 7h 1. -0.02041 0.000 1.767E-05 5.301E-04 2.041E-02 5.850E+01 3.822E+03 2.675E+05 1.966E+07 1.193E+11 47. 1.318E+04 2.727E+02 8.776E+01 3.857E+03 2.676E+05 1.966E+07 1.193E+11 1. 2.804E+02 5.802E+00 1.867E+00 8.207E+01 5.694E+03 4.184E+05 2.539E+09 --------------------zeta--------------------- nl wnl ----blume-watson---- -----(r*vi)----- i (ryd) eps s evel edar evel+edar erel (ryd) (cm-1) (ryd) (cm-1) 1s 2. 0.00000 0.000 0.00000 0.000-2274.99730 -1876.84227 -398.58176 331.78494 -66.797 -1943.63908 2s 2. 0.00000 0.000 0.00000 0.000 -567.83950 -281.66176 -54.21010 36.23414 -17.976 -299.63772 2p 6. 8.55158 938426.774 8.80416 966144.843 -555.32084 -254.39168 -7.22339 -0.01376 -7.223 -261.61507 3s 2. 0.00000 0.000 0.00000 0.000 -234.94456 -54.19810 -10.56400 6.74662 -3.817 -58.01547 3p 6. 1.49473 164028.098 1.53292 168218.910 -227.34854 -45.04592 -1.64589 -0.00221 -1.646 -46.69180 3d 10. 0.17191 18864.973 0.18429 20224.034 -218.95188 -30.46187 -0.37676 -0.01081 -0.377 -30.83863 4s 2. 0.00000 0.000 0.00000 0.000 -108.22126 -9.01250 -2.06002 1.30044 -0.760 -9.77209 4p 6. 0.24966 27397.079 0.25575 28064.980 -99.37775 -6.22820 -0.29109 -0.00026 -0.291 -6.51929 4d 10. 0.01547 1698.153 0.01645 1804.895 -75.87238 -2.07234 -0.03955 -0.00095 -0.040 -2.11189 7h 1. 0.00000 0.004 0.00000 0.000 -1.89796 -0.01271 0.00000 0.00000 0.000 -0.01271 ag i d10 7h nconf= 67 z= 47 ion= 0 kut=-1 exf=0.650 corrf=0.000 ca1=0.700 ca0=0.500 without correlation with correlation ----------------------- ----------------------- nl wnl eps fg eps fgr corr eps fg eps fgr n*r n*rc ect ec----------------- 1s 2. -1885.95147 -1885.95147-0.08290 -1886.03437 -1886.03437 0.0230 0.0230 -0.08267 0.00000-0.08267 2s 2. -284.72501 -284.72501-0.08232 -284.80733 -284.80733 0.0593 0.0593 -0.23110 -0.06744-0.08099 2p 6. -255.35986 -255.35986-0.08242 -255.44227 -255.44227 0.0626 0.0626 -0.72296 -0.08169-0.08186-0.08197-0.08206-0.08218 3s 2. -55.53186 -55.53186-0.08107 -55.61292 -55.61292 0.1342 0.1341 -0.86759 -0.06668-0.07795 3p 6. -45.57961 -45.57961-0.08107 -45.66067 -45.66067 0.1481 0.1480 -1.34526 -0.07880-0.07928-0.07960-0.07983-0.08015 3d 10. -29.78687 -29.78687-0.08120 -29.86806 -29.86806 0.1832 0.1830 -2.15235 -0.08039-0.08049-0.08057-0.08064-0.08095 4s 2. -9.28281 -9.28281-0.07796 -9.36076 -9.36076 0.3282 0.3268 -2.28891 -0.06401-0.07255 4p 6. -6.21902 -6.21902-0.07741 -6.29643 -6.29643 0.4010 0.3985 -2.73478 -0.07233-0.07355-0.07430-0.07484-0.07559 4d 10. -1.69446 -1.69446-0.07408 -1.76853 -1.76853 0.7682 0.7520 -3.45992 -0.06933-0.07096-0.07175-0.07230-0.07408 7h 1. -0.02041 -0.02041 0.00000 -0.02041 -0.02041 7.0003 7.0003 -3.45992 0.00000 ecorrt= -3.64659 (old) ect= -3.45992 (new) etotrl= 0.00000 + 0.00000 + 0.00000 etot= -10621.59767 -10621.59767 -10625.24427 -10625.24427 -10625.05759 -10625.05759 -10625.05759 ag i d10 7h 2 -10625.0576 0 0.0000 2 t(run)= 17.00, t(job)=1159.55 seconds 47 1ag i d10 8h 4d10 8h ag i d10 8h nconf= 68 z= 47 ncores= 9 nvales= 1 ion= 0 r(i)/x(i)=0.24532669 ca1=0.700 tolstb=1.000 tolk-2=1.00000 tolend= 0.5E-07 thresh= 0.1E-10 kut= 0 exf=1.000 corrf=0.000 ca0= 0.500 rcn mod 32 ihf1= 0 mesh=2601 idb= 481 rdb= 100.461 emx= 0.10 r(mesh)=5426.209 irel= 1 ib=2600 t(run)= 12.73, t(job)=1172.28 seconds nl wnl ee az (r-3) (r-2) (r-1) (r+1) (r+2) (r+3) (r+4) (r+6) 1s 2. -1885.11540 881.507 0.000E+00 5.213E+03 4.936E+01 3.112E-02 1.308E-03 6.934E-05 4.438E-06 2.867E-08 2s 2. -280.38629 295.095 0.000E+00 5.731E+02 1.123E+01 1.350E-01 2.146E-02 3.880E-03 7.892E-04 4.505E-05 2p 6. -254.25395 3360.692 3.659E+03 1.600E+02 1.083E+01 1.175E-01 1.683E-02 2.853E-03 5.593E-04 3.126E-05 3s 2. -52.60253 127.553 0.000E+00 1.088E+02 3.931E+00 3.700E-01 1.565E-01 7.318E-02 3.748E-02 1.276E-02 3p 6. -43.49275 1500.439 6.406E+02 3.004E+01 3.735E+00 3.687E-01 1.577E-01 7.538E-02 3.987E-02 1.484E-02 3d 10. -29.24558 3211.671 9.185E+01 1.570E+01 3.533E+00 3.450E-01 1.415E-01 6.773E-02 3.720E-02 1.614E-02 4s 2. -8.25994 56.016 0.000E+00 2.149E+01 1.516E+00 9.139E-01 9.475E-01 1.082E+00 1.354E+00 2.767E+00 4p 6. -5.51882 619.965 1.071E+02 5.509E+00 1.356E+00 1.004E+00 1.156E+00 1.486E+00 2.119E+00 5.841E+00 4d 10. -1.55754 1036.575 8.404E+00 1.825E+00 9.716E-01 1.397E+00 2.375E+00 4.802E+00 1.143E+01 1.006E+02 8h 1. -0.01562 0.000 1.184E-05 3.551E-04 1.563E-02 8.100E+01 7.392E+03 7.190E+05 7.290E+07 8.223E+11 47. 1.318E+04 2.727E+02 1.103E+02 7.427E+03 7.191E+05 7.290E+07 8.223E+11 1. 2.804E+02 5.802E+00 2.346E+00 1.580E+02 1.530E+04 1.551E+06 1.750E+10 --------------------zeta--------------------- nl wnl ----blume-watson---- -----(r*vi)----- i (ryd) eps s evel edar evel+edar erel (ryd) (cm-1) (ryd) (cm-1) 1s 2. 0.00000 0.000 0.00000 0.000-2274.99730 -1876.85183 -398.58175 331.78492 -66.797 -1943.64866 2s 2. 0.00000 0.000 0.00000 0.000 -567.83950 -281.67133 -54.21010 36.23414 -17.976 -299.64729 2p 6. 8.55158 938426.774 8.80416 966144.843 -555.32084 -254.40124 -7.22339 -0.01376 -7.223 -261.62464 3s 2. 0.00000 0.000 0.00000 0.000 -234.94456 -54.20766 -10.56400 6.74662 -3.817 -58.02504 3p 6. 1.49473 164028.098 1.53292 168218.910 -227.34854 -45.05548 -1.64589 -0.00221 -1.646 -46.70137 3d 10. 0.17191 18864.973 0.18429 20224.034 -218.95188 -30.47143 -0.37676 -0.01081 -0.377 -30.84819 4s 2. 0.00000 0.000 0.00000 0.000 -108.22126 -9.02207 -2.06002 1.30044 -0.760 -9.78165 4p 6. 0.24966 27397.079 0.25575 28064.980 -99.37775 -6.23776 -0.29109 -0.00026 -0.291 -6.52885 4d 10. 0.01547 1698.153 0.01645 1804.895 -75.87238 -2.08190 -0.03955 -0.00095 -0.040 -2.12145 8h 1. 0.00000 0.002 0.00000 0.000 -1.45313 -0.01047 0.00000 0.00000 0.000 -0.01047 ag i d10 8h nconf= 68 z= 47 ion= 0 kut=-1 exf=0.650 corrf=0.000 ca1=0.700 ca0=0.500 without correlation with correlation ----------------------- ----------------------- nl wnl eps fg eps fgr corr eps fg eps fgr n*r n*rc ect ec----------------- 1s 2. -1885.96103 -1885.96103-0.08290 -1886.04393 -1886.04393 0.0230 0.0230 -0.08267 0.00000-0.08267 2s 2. -284.73457 -284.73457-0.08232 -284.81689 -284.81689 0.0593 0.0593 -0.23110 -0.06744-0.08099 2p 6. -255.36942 -255.36942-0.08242 -255.45184 -255.45184 0.0626 0.0626 -0.72296 -0.08169-0.08186-0.08197-0.08206-0.08218 3s 2. -55.54142 -55.54142-0.08107 -55.62249 -55.62249 0.1342 0.1341 -0.86759 -0.06668-0.07795 3p 6. -45.58918 -45.58918-0.08107 -45.67024 -45.67024 0.1481 0.1480 -1.34526 -0.07880-0.07928-0.07960-0.07983-0.08015 3d 10. -29.79643 -29.79643-0.08120 -29.87763 -29.87763 0.1832 0.1829 -2.15235 -0.08039-0.08049-0.08057-0.08064-0.08095 4s 2. -9.29237 -9.29237-0.07796 -9.37033 -9.37033 0.3280 0.3267 -2.28891 -0.06401-0.07255 4p 6. -6.22858 -6.22858-0.07741 -6.30599 -6.30599 0.4007 0.3982 -2.73478 -0.07233-0.07355-0.07430-0.07484-0.07559 4d 10. -1.70402 -1.70402-0.07408 -1.77810 -1.77810 0.7661 0.7499 -3.45992 -0.06933-0.07096-0.07175-0.07230-0.07408 8h 1. -0.01563 -0.01563 0.00000 -0.01563 -0.01563 7.9995 7.9994 -3.45992 0.00000 ecorrt= -3.64659 (old) ect= -3.45992 (new) etotrl= 0.00000 + 0.00000 + 0.00000 etot= -10621.59289 -10621.59289 -10625.23948 -10625.23948 -10625.05281 -10625.05281 -10625.05281 ag i d10 8h 2 -10625.0528 0 0.0000 2 t(run)= 17.59, t(job)=1177.14 seconds 47 1ag i d10 9h 4d10 9h ag i d10 9h nconf= 69 z= 47 ncores= 9 nvales= 1 ion= 0 r(i)/x(i)=0.24532669 ca1=0.700 tolstb=1.000 tolk-2=1.00000 tolend= 0.5E-07 thresh= 0.1E-10 kut= 0 exf=1.000 corrf=0.000 ca0= 0.500 rcn mod 32 ihf1= 0 mesh=2601 idb= 481 rdb= 100.461 emx= 0.10 r(mesh)=5426.209 irel= 1 ib=2600 t(run)= 12.00, t(job)=1189.14 seconds nl wnl ee az (r-3) (r-2) (r-1) (r+1) (r+2) (r+3) (r+4) (r+6) 1s 2. -1885.12196 881.507 0.000E+00 5.213E+03 4.936E+01 3.112E-02 1.308E-03 6.934E-05 4.438E-06 2.867E-08 2s 2. -280.39285 295.095 0.000E+00 5.731E+02 1.123E+01 1.350E-01 2.146E-02 3.880E-03 7.892E-04 4.505E-05 2p 6. -254.26051 3360.692 3.659E+03 1.600E+02 1.083E+01 1.175E-01 1.683E-02 2.853E-03 5.593E-04 3.126E-05 3s 2. -52.60909 127.553 0.000E+00 1.088E+02 3.931E+00 3.700E-01 1.565E-01 7.318E-02 3.748E-02 1.276E-02 3p 6. -43.49931 1500.439 6.406E+02 3.004E+01 3.735E+00 3.687E-01 1.577E-01 7.538E-02 3.987E-02 1.484E-02 3d 10. -29.25214 3211.670 9.185E+01 1.570E+01 3.533E+00 3.450E-01 1.415E-01 6.773E-02 3.720E-02 1.614E-02 4s 2. -8.26650 56.016 0.000E+00 2.149E+01 1.516E+00 9.139E-01 9.475E-01 1.082E+00 1.354E+00 2.767E+00 4p 6. -5.52537 619.965 1.071E+02 5.509E+00 1.356E+00 1.004E+00 1.156E+00 1.486E+00 2.119E+00 5.841E+00 4d 10. -1.56410 1036.575 8.404E+00 1.825E+00 9.716E-01 1.397E+00 2.375E+00 4.802E+00 1.143E+01 1.006E+02 9h 1. -0.01235 0.000 8.314E-06 2.494E-04 1.235E-02 1.065E+02 1.280E+04 1.633E+06 2.163E+08 4.115E+12 47. 1.318E+04 2.727E+02 1.358E+02 1.283E+04 1.633E+06 2.163E+08 4.115E+12 1. 2.804E+02 5.802E+00 2.889E+00 2.731E+02 3.475E+04 4.602E+06 8.756E+10 --------------------zeta--------------------- nl wnl ----blume-watson---- -----(r*vi)----- i (ryd) eps s evel edar evel+edar erel (ryd) (cm-1) (ryd) (cm-1) 1s 2. 0.00000 0.000 0.00000 0.000-2274.99729 -1876.85839 -398.58175 331.78491 -66.797 -1943.65522 2s 2. 0.00000 0.000 0.00000 0.000 -567.83950 -281.67788 -54.21010 36.23414 -17.976 -299.65385 2p 6. 8.55158 938426.774 8.80416 966144.844 -555.32084 -254.40780 -7.22339 -0.01376 -7.223 -261.63119 3s 2. 0.00000 0.000 0.00000 0.000 -234.94456 -54.21422 -10.56400 6.74662 -3.817 -58.03159 3p 6. 1.49473 164028.098 1.53292 168218.910 -227.34854 -45.06204 -1.64589 -0.00221 -1.646 -46.70793 3d 10. 0.17191 18864.973 0.18429 20224.034 -218.95188 -30.47799 -0.37676 -0.01081 -0.377 -30.85475 4s 2. 0.00000 0.000 0.00000 0.000 -108.22126 -9.02863 -2.06002 1.30044 -0.760 -9.78821 4p 6. 0.24966 27397.079 0.25575 28064.980 -99.37775 -6.24432 -0.29109 -0.00026 -0.291 -6.53541 4d 10. 0.01547 1698.153 0.01645 1804.895 -75.87238 -2.08846 -0.03955 -0.00095 -0.040 -2.12801 9h 1. 0.00000 0.002 0.00000 0.000 -1.14815 -0.00864 0.00000 0.00000 0.000 -0.00864 ag i d10 9h nconf= 69 z= 47 ion= 0 kut=-1 exf=0.650 corrf=0.000 ca1=0.700 ca0=0.500 without correlation with correlation ----------------------- ----------------------- nl wnl eps fg eps fgr corr eps fg eps fgr n*r n*rc ect ec----------------- 1s 2. -1885.96759 -1885.96759-0.08290 -1886.05049 -1886.05049 0.0230 0.0230 -0.08267 0.00000-0.08267 2s 2. -284.74113 -284.74113-0.08232 -284.82345 -284.82345 0.0593 0.0593 -0.23110 -0.06744-0.08099 2p 6. -255.37598 -255.37598-0.08242 -255.45840 -255.45840 0.0626 0.0626 -0.72296 -0.08169-0.08186-0.08197-0.08206-0.08218 3s 2. -55.54798 -55.54798-0.08107 -55.62905 -55.62905 0.1342 0.1341 -0.86759 -0.06668-0.07795 3p 6. -45.59573 -45.59573-0.08107 -45.67680 -45.67680 0.1481 0.1480 -1.34526 -0.07880-0.07928-0.07960-0.07983-0.08015 3d 10. -29.80299 -29.80299-0.08120 -29.88419 -29.88419 0.1832 0.1829 -2.15235 -0.08039-0.08049-0.08057-0.08064-0.08095 4s 2. -9.29893 -9.29893-0.07796 -9.37689 -9.37689 0.3279 0.3266 -2.28891 -0.06401-0.07255 4p 6. -6.23514 -6.23514-0.07741 -6.31255 -6.31255 0.4005 0.3980 -2.73478 -0.07233-0.07355-0.07430-0.07484-0.07559 4d 10. -1.71058 -1.71058-0.07408 -1.78466 -1.78466 0.7646 0.7486 -3.45992 -0.06933-0.07096-0.07175-0.07230-0.07408 9h 1. -0.01234 -0.01234 0.00000 -0.01234 -0.01234 9.0007 9.0006 -3.45992 0.00000 ecorrt= -3.64659 (old) ect= -3.45992 (new) etotrl= 0.00000 + 0.00000 + 0.00000 etot= -10621.58960 -10621.58960 -10625.23620 -10625.23620 -10625.04952 -10625.04952 -10625.04952 ag i d10 9h 2 -10625.0495 0 0.0000 2 t(run)= 17.12, t(job)=1194.26 seconds 47 1ag i d9 5s6h 4d9 5s 6h ag i d9 5s6h nconf= 70 z= 47 ncores=10 nvales= 1 ion= 0 r(i)/x(i)=0.24532669 ca1=0.700 tolstb=1.000 tolk-2=1.00000 tolend= 0.5E-07 thresh= 0.1E-10 kut= 0 exf=1.000 corrf=0.000 ca0= 0.500 rcn mod 32 ihf1= 0 mesh=2601 idb= 481 rdb= 100.461 emx= 0.10 r(mesh)=5426.209 irel= 1 ib=2600 t(run)= 10.06, t(job)=1204.32 seconds nl wnl ee az (r-3) (r-2) (r-1) (r+1) (r+2) (r+3) (r+4) (r+6) 1s 2. -1885.42998 881.504 0.000E+00 5.213E+03 4.936E+01 3.112E-02 1.308E-03 6.934E-05 4.438E-06 2.867E-08 2s 2. -280.71756 295.093 0.000E+00 5.731E+02 1.123E+01 1.350E-01 2.146E-02 3.880E-03 7.892E-04 4.505E-05 2p 6. -254.58389 3360.615 3.659E+03 1.600E+02 1.083E+01 1.175E-01 1.684E-02 2.853E-03 5.593E-04 3.126E-05 3s 2. -52.92801 127.558 0.000E+00 1.088E+02 3.931E+00 3.700E-01 1.565E-01 7.317E-02 3.748E-02 1.276E-02 3p 6. -43.81830 1500.501 6.406E+02 3.005E+01 3.735E+00 3.687E-01 1.577E-01 7.538E-02 3.986E-02 1.483E-02 3d 10. -29.57314 3212.018 9.187E+01 1.571E+01 3.533E+00 3.449E-01 1.415E-01 6.771E-02 3.719E-02 1.613E-02 4s 2. -8.56674 56.166 0.000E+00 2.160E+01 1.520E+00 9.114E-01 9.418E-01 1.071E+00 1.333E+00 2.683E+00 4p 6. -5.81624 623.307 1.083E+02 5.563E+00 1.363E+00 9.982E-01 1.142E+00 1.455E+00 2.052E+00 5.497E+00 4d 9. -1.82088 1073.600 8.994E+00 1.934E+00 1.004E+00 1.343E+00 2.170E+00 4.123E+00 9.126E+00 6.781E+01 5s 1. -1.14746 17.119 0.000E+00 2.118E+00 4.675E-01 2.734E+00 8.472E+00 2.923E+01 1.116E+02 2.168E+03 6h 1. -0.02778 0.000 2.806E-05 8.418E-04 2.778E-02 3.900E+01 1.638E+03 7.371E+04 3.538E+06 9.744E+09 47. 1.318E+04 2.725E+02 6.907E+01 1.678E+03 7.379E+04 3.538E+06 9.744E+09 1. 2.805E+02 5.799E+00 1.470E+00 3.569E+01 1.570E+03 7.528E+04 2.073E+08 --------------------zeta--------------------- nl wnl ----blume-watson---- -----(r*vi)----- i (ryd) eps s evel edar evel+edar erel (ryd) (cm-1) (ryd) (cm-1) 1s 2. 0.00000 0.000 0.00000 0.000-2274.99710 -1877.16629 -398.57965 331.78285 -66.797 -1943.96309 2s 2. 0.00000 0.000 0.00000 0.000 -567.83896 -282.00220 -54.20917 36.23356 -17.976 -299.97781 2p 6. 8.55126 938392.336 8.80382 966107.341 -555.31980 -254.73105 -7.22309 -0.01377 -7.223 -261.95414 3s 2. 0.00000 0.000 0.00000 0.000 -234.94724 -54.53353 -10.56476 6.74711 -3.818 -58.35118 3p 6. 1.49487 164042.946 1.53306 168233.436 -227.35202 -45.38140 -1.64604 -0.00221 -1.646 -47.02743 3d 10. 0.17194 18868.611 0.18433 20228.020 -218.95974 -30.79890 -0.37684 -0.01081 -0.377 -31.17574 4s 2. 0.00000 0.000 0.00000 0.000 -108.40485 -9.32442 -2.07114 1.30745 -0.764 -10.08812 4p 6. 0.25235 27692.514 0.25851 28367.729 -99.73441 -6.53131 -0.29425 -0.00026 -0.294 -6.82557 4d 9. 0.01659 1820.207 0.01763 1934.371 -77.91714 -2.35628 -0.04242 -0.00102 -0.042 -2.39871 5s 1. 0.00000 0.000 0.00000 0.000 -39.89827 -1.21498 -0.19280 0.12146 -0.071 -1.28633 6h 1. 0.00000 0.007 0.00000 0.000 -2.58333 -0.01485 0.00000 0.00000 0.000 -0.01485 ag i d9 5s6h nconf= 70 z= 47 ion= 0 kut=-1 exf=0.650 corrf=0.000 ca1=0.700 ca0=0.500 without correlation with correlation ----------------------- ----------------------- nl wnl eps fg eps fgr corr eps fg eps fgr n*r n*rc ect ec----------------- 1s 2. -1886.27680 -1886.27680-0.08290 -1886.35971 -1886.35971 0.0230 0.0230 -0.08267 0.00000-0.08267 2s 2. -285.06735 -285.06735-0.08232 -285.14967 -285.14967 0.0592 0.0592 -0.23110 -0.06744-0.08099 2p 6. -255.69860 -255.69860-0.08242 -255.78102 -255.78102 0.0625 0.0625 -0.72296 -0.08169-0.08186-0.08197-0.08206-0.08218 3s 2. -55.87316 -55.87316-0.08107 -55.95422 -55.95422 0.1338 0.1337 -0.86760 -0.06668-0.07795 3p 6. -45.91693 -45.91693-0.08107 -45.99800 -45.99800 0.1476 0.1474 -1.34526 -0.07880-0.07928-0.07960-0.07983-0.08015 3d 10. -30.12065 -30.12065-0.08120 -30.20185 -30.20185 0.1822 0.1820 -2.15235 -0.08039-0.08049-0.08057-0.08064-0.08095 4s 2. -9.59501 -9.59501-0.07794 -9.67295 -9.67295 0.3228 0.3215 -2.28909 -0.06414-0.07260 4p 6. -6.49545 -6.49545-0.07740 -6.57285 -6.57285 0.3924 0.3901 -2.73538 -0.07242-0.07363-0.07437-0.07491-0.07565 4d 9. -1.97301 -1.97301-0.07469 -2.04770 -2.04770 0.7119 0.6988 -3.39164 -0.07030-0.07165-0.07235-0.07285-0.07431 5s 1. -1.09817 -1.09817-0.05730 -1.15547 -1.15547 0.9543 0.9303 -3.44894 -0.05730 6h 1. -0.02778 -0.02778 0.00000 -0.02778 -0.02778 6.0000 5.9999 -3.44894 0.00000 ecorrt= -3.63526 (old) ect= -3.44894 (new) etotrl= 0.00000 + 0.00000 + 0.00000 etot= -10621.26353 -10621.26353 -10624.89879 -10624.89879 -10624.71246 -10624.71246 -10624.71246 ag i d9 5s6h 10 -10624.7125 0 1.8202 2 0.0000 2 0.0134 3 0.0001 3 14.1995 4 0.0000 4 0.0000 4 0.0000 4 0.0000 4 t(run)= 15.48, t(job)=1209.74 seconds 47 1ag i d9 5s7h 4d9 5s 7h ag i d9 5s7h nconf= 71 z= 47 ncores=10 nvales= 1 ion= 0 r(i)/x(i)=0.24532669 ca1=0.700 tolstb=1.000 tolk-2=1.00000 tolend= 0.5E-07 thresh= 0.1E-10 kut= 0 exf=1.000 corrf=0.000 ca0= 0.500 rcn mod 32 ihf1= 0 mesh=2601 idb= 481 rdb= 100.461 emx= 0.10 r(mesh)=5426.209 irel= 1 ib=2600 t(run)= 12.61, t(job)=1222.35 seconds nl wnl ee az (r-3) (r-2) (r-1) (r+1) (r+2) (r+3) (r+4) (r+6) 1s 2. -1885.44472 881.504 0.000E+00 5.213E+03 4.936E+01 3.112E-02 1.308E-03 6.934E-05 4.438E-06 2.867E-08 2s 2. -280.73230 295.093 0.000E+00 5.731E+02 1.123E+01 1.350E-01 2.146E-02 3.880E-03 7.892E-04 4.505E-05 2p 6. -254.59863 3360.615 3.659E+03 1.600E+02 1.083E+01 1.175E-01 1.684E-02 2.853E-03 5.593E-04 3.126E-05 3s 2. -52.94275 127.558 0.000E+00 1.088E+02 3.931E+00 3.700E-01 1.565E-01 7.317E-02 3.748E-02 1.276E-02 3p 6. -43.83304 1500.501 6.406E+02 3.005E+01 3.735E+00 3.687E-01 1.577E-01 7.538E-02 3.986E-02 1.483E-02 3d 10. -29.58788 3212.018 9.187E+01 1.571E+01 3.533E+00 3.449E-01 1.415E-01 6.771E-02 3.719E-02 1.613E-02 4s 2. -8.58148 56.166 0.000E+00 2.160E+01 1.520E+00 9.114E-01 9.418E-01 1.071E+00 1.333E+00 2.683E+00 4p 6. -5.83098 623.307 1.083E+02 5.563E+00 1.363E+00 9.982E-01 1.142E+00 1.455E+00 2.052E+00 5.497E+00 4d 9. -1.83562 1073.600 8.994E+00 1.934E+00 1.004E+00 1.343E+00 2.170E+00 4.123E+00 9.126E+00 6.781E+01 5s 1. -1.16220 17.119 0.000E+00 2.118E+00 4.675E-01 2.734E+00 8.472E+00 2.923E+01 1.116E+02 2.168E+03 7h 1. -0.02041 0.000 1.767E-05 5.301E-04 2.041E-02 5.850E+01 3.822E+03 2.675E+05 1.966E+07 1.193E+11 47. 1.318E+04 2.725E+02 8.857E+01 3.862E+03 2.676E+05 1.966E+07 1.193E+11 1. 2.805E+02 5.798E+00 1.884E+00 8.216E+01 5.694E+03 4.184E+05 2.539E+09 --------------------zeta--------------------- nl wnl ----blume-watson---- -----(r*vi)----- i (ryd) eps s evel edar evel+edar erel (ryd) (cm-1) (ryd) (cm-1) 1s 2. 0.00000 0.000 0.00000 0.000-2274.99709 -1877.18103 -398.57964 331.78282 -66.797 -1943.97784 2s 2. 0.00000 0.000 0.00000 0.000 -567.83896 -282.01694 -54.20917 36.23356 -17.976 -299.99255 2p 6. 8.55126 938392.336 8.80382 966107.341 -555.31980 -254.74579 -7.22309 -0.01377 -7.223 -261.96888 3s 2. 0.00000 0.000 0.00000 0.000 -234.94724 -54.54827 -10.56476 6.74711 -3.818 -58.36592 3p 6. 1.49487 164042.946 1.53306 168233.437 -227.35202 -45.39614 -1.64604 -0.00221 -1.646 -47.04217 3d 10. 0.17194 18868.611 0.18433 20228.020 -218.95974 -30.81364 -0.37684 -0.01081 -0.377 -31.19048 4s 2. 0.00000 0.000 0.00000 0.000 -108.40485 -9.33916 -2.07114 1.30745 -0.764 -10.10285 4p 6. 0.25235 27692.514 0.25851 28367.729 -99.73441 -6.54605 -0.29425 -0.00026 -0.294 -6.84030 4d 9. 0.01659 1820.207 0.01763 1934.371 -77.91714 -2.37102 -0.04242 -0.00102 -0.042 -2.41344 5s 1. 0.00000 0.000 0.00000 0.000 -39.89827 -1.22972 -0.19280 0.12146 -0.071 -1.30106 7h 1. 0.00000 0.004 0.00000 0.000 -1.89796 -0.01271 0.00000 0.00000 0.000 -0.01271 ag i d9 5s7h nconf= 71 z= 47 ion= 0 kut=-1 exf=0.650 corrf=0.000 ca1=0.700 ca0=0.500 without correlation with correlation ----------------------- ----------------------- nl wnl eps fg eps fgr corr eps fg eps fgr n*r n*rc ect ec----------------- 1s 2. -1886.29154 -1886.29154-0.08290 -1886.37444 -1886.37444 0.0230 0.0230 -0.08267 0.00000-0.08267 2s 2. -285.08209 -285.08209-0.08232 -285.16441 -285.16441 0.0592 0.0592 -0.23110 -0.06744-0.08099 2p 6. -255.71334 -255.71334-0.08242 -255.79576 -255.79576 0.0625 0.0625 -0.72296 -0.08169-0.08186-0.08197-0.08206-0.08218 3s 2. -55.88790 -55.88790-0.08107 -55.96896 -55.96896 0.1338 0.1337 -0.86760 -0.06668-0.07795 3p 6. -45.93167 -45.93167-0.08107 -46.01274 -46.01274 0.1476 0.1474 -1.34526 -0.07880-0.07928-0.07960-0.07983-0.08015 3d 10. -30.13539 -30.13539-0.08120 -30.21659 -30.21659 0.1822 0.1819 -2.15235 -0.08039-0.08049-0.08057-0.08064-0.08095 4s 2. -9.60975 -9.60975-0.07794 -9.68769 -9.68769 0.3226 0.3213 -2.28909 -0.06414-0.07260 4p 6. -6.51019 -6.51019-0.07740 -6.58759 -6.58759 0.3919 0.3896 -2.73538 -0.07242-0.07363-0.07437-0.07491-0.07565 4d 9. -1.98775 -1.98775-0.07469 -2.06243 -2.06243 0.7093 0.6963 -3.39164 -0.07030-0.07165-0.07235-0.07285-0.07431 5s 1. -1.11291 -1.11291-0.05730 -1.17021 -1.17021 0.9479 0.9244 -3.44894 -0.05730 7h 1. -0.02041 -0.02041 0.00000 -0.02041 -0.02041 7.0003 7.0000 -3.44894 0.00000 ecorrt= -3.63526 (old) ect= -3.44894 (new) etotrl= 0.00000 + 0.00000 + 0.00000 etot= -10621.25615 -10621.25615 -10624.89141 -10624.89141 -10624.70509 -10624.70509 -10624.70509 ag i d9 5s7h 10 -10624.7051 0 1.8202 2 0.0000 2 0.0084 3 0.0001 3 14.1995 4 0.0000 4 0.0000 4 0.0000 4 0.0000 4 t(run)= 18.04, t(job)=1227.78 seconds 47 1ag i d9 5s8h 4d9 5s 8h ag i d9 5s8h nconf= 72 z= 47 ncores=10 nvales= 1 ion= 0 r(i)/x(i)=0.24532669 ca1=0.700 tolstb=1.000 tolk-2=1.00000 tolend= 0.5E-07 thresh= 0.1E-10 kut= 0 exf=1.000 corrf=0.000 ca0= 0.500 rcn mod 32 ihf1= 0 mesh=2601 idb= 481 rdb= 100.461 emx= 0.10 r(mesh)=5426.209 irel= 1 ib=2600 t(run)= 12.62, t(job)=1240.40 seconds nl wnl ee az (r-3) (r-2) (r-1) (r+1) (r+2) (r+3) (r+4) (r+6) 1s 2. -1885.45428 881.504 0.000E+00 5.213E+03 4.936E+01 3.112E-02 1.308E-03 6.934E-05 4.438E-06 2.867E-08 2s 2. -280.74187 295.093 0.000E+00 5.731E+02 1.123E+01 1.350E-01 2.146E-02 3.880E-03 7.892E-04 4.505E-05 2p 6. -254.60819 3360.615 3.659E+03 1.600E+02 1.083E+01 1.175E-01 1.684E-02 2.853E-03 5.593E-04 3.126E-05 3s 2. -52.95232 127.558 0.000E+00 1.088E+02 3.931E+00 3.700E-01 1.565E-01 7.317E-02 3.748E-02 1.276E-02 3p 6. -43.84261 1500.501 6.406E+02 3.005E+01 3.735E+00 3.687E-01 1.577E-01 7.538E-02 3.986E-02 1.483E-02 3d 10. -29.59744 3212.018 9.187E+01 1.571E+01 3.533E+00 3.449E-01 1.415E-01 6.771E-02 3.719E-02 1.613E-02 4s 2. -8.59105 56.166 0.000E+00 2.160E+01 1.520E+00 9.114E-01 9.418E-01 1.071E+00 1.333E+00 2.683E+00 4p 6. -5.84054 623.307 1.083E+02 5.563E+00 1.363E+00 9.982E-01 1.142E+00 1.455E+00 2.052E+00 5.497E+00 4d 9. -1.84518 1073.600 8.994E+00 1.934E+00 1.004E+00 1.343E+00 2.170E+00 4.123E+00 9.126E+00 6.781E+01 5s 1. -1.17177 17.119 0.000E+00 2.118E+00 4.675E-01 2.734E+00 8.472E+00 2.923E+01 1.116E+02 2.168E+03 8h 1. -0.01562 0.000 1.184E-05 3.551E-04 1.563E-02 8.100E+01 7.392E+03 7.190E+05 7.290E+07 8.223E+11 47. 1.318E+04 2.725E+02 1.111E+02 7.432E+03 7.191E+05 7.290E+07 8.223E+11 1. 2.805E+02 5.798E+00 2.363E+00 1.581E+02 1.530E+04 1.551E+06 1.749E+10 --------------------zeta--------------------- nl wnl ----blume-watson---- -----(r*vi)----- i (ryd) eps s evel edar evel+edar erel (ryd) (cm-1) (ryd) (cm-1) 1s 2. 0.00000 0.000 0.00000 0.000-2274.99709 -1877.19059 -398.57963 331.78281 -66.797 -1943.98742 2s 2. 0.00000 0.000 0.00000 0.000 -567.83896 -282.02651 -54.20917 36.23356 -17.976 -300.00212 2p 6. 8.55126 938392.336 8.80382 966107.342 -555.31980 -254.75536 -7.22309 -0.01377 -7.223 -261.97845 3s 2. 0.00000 0.000 0.00000 0.000 -234.94724 -54.55783 -10.56476 6.74711 -3.818 -58.37548 3p 6. 1.49487 164042.946 1.53306 168233.437 -227.35202 -45.40570 -1.64604 -0.00221 -1.646 -47.05174 3d 10. 0.17194 18868.611 0.18433 20228.020 -218.95974 -30.82321 -0.37684 -0.01081 -0.377 -31.20005 4s 2. 0.00000 0.000 0.00000 0.000 -108.40485 -9.34873 -2.07114 1.30745 -0.764 -10.11242 4p 6. 0.25235 27692.514 0.25851 28367.729 -99.73441 -6.55562 -0.29425 -0.00026 -0.294 -6.84987 4d 9. 0.01659 1820.207 0.01763 1934.371 -77.91714 -2.38059 -0.04242 -0.00102 -0.042 -2.42301 5s 1. 0.00000 0.000 0.00000 0.000 -39.89827 -1.23929 -0.19280 0.12146 -0.071 -1.31063 8h 1. 0.00000 0.002 0.00000 0.000 -1.45313 -0.01047 0.00000 0.00000 0.000 -0.01047 ag i d9 5s8h nconf= 72 z= 47 ion= 0 kut=-1 exf=0.650 corrf=0.000 ca1=0.700 ca0=0.500 without correlation with correlation ----------------------- ----------------------- nl wnl eps fg eps fgr corr eps fg eps fgr n*r n*rc ect ec----------------- 1s 2. -1886.30111 -1886.30111-0.08290 -1886.38401 -1886.38401 0.0230 0.0230 -0.08267 0.00000-0.08267 2s 2. -285.09165 -285.09165-0.08232 -285.17398 -285.17398 0.0592 0.0592 -0.23110 -0.06744-0.08099 2p 6. -255.72291 -255.72291-0.08242 -255.80533 -255.80533 0.0625 0.0625 -0.72296 -0.08169-0.08186-0.08197-0.08206-0.08218 3s 2. -55.89746 -55.89746-0.08107 -55.97853 -55.97853 0.1338 0.1337 -0.86760 -0.06668-0.07795 3p 6. -45.94124 -45.94124-0.08107 -46.02230 -46.02230 0.1475 0.1474 -1.34526 -0.07880-0.07928-0.07960-0.07983-0.08015 3d 10. -30.14496 -30.14496-0.08120 -30.22616 -30.22616 0.1821 0.1819 -2.15235 -0.08039-0.08049-0.08057-0.08064-0.08095 4s 2. -9.61932 -9.61932-0.07794 -9.69726 -9.69726 0.3224 0.3211 -2.28909 -0.06414-0.07260 4p 6. -6.51975 -6.51975-0.07740 -6.59716 -6.59716 0.3916 0.3893 -2.73538 -0.07242-0.07363-0.07437-0.07491-0.07565 4d 9. -1.99731 -1.99731-0.07469 -2.07200 -2.07200 0.7076 0.6947 -3.39164 -0.07030-0.07165-0.07235-0.07285-0.07431 5s 1. -1.12247 -1.12247-0.05730 -1.17977 -1.17977 0.9439 0.9207 -3.44894 -0.05730 8h 1. -0.01563 -0.01563 0.00000 -0.01563 -0.01563 7.9995 7.9991 -3.44894 0.00000 ecorrt= -3.63526 (old) ect= -3.44894 (new) etotrl= 0.00000 + 0.00000 + 0.00000 etot= -10621.25136 -10621.25136 -10624.88662 -10624.88662 -10624.70030 -10624.70030 -10624.70030 ag i d9 5s8h 10 -10624.7003 0 1.8202 2 0.0000 2 0.0056 3 0.0001 3 14.1995 4 0.0000 4 0.0000 4 0.0000 4 0.0000 4 t(run)= 18.11, t(job)=1245.89 seconds 47 1ag i d9 5s9h 4d9 5s 9h ag i d9 5s9h nconf= 73 z= 47 ncores=10 nvales= 1 ion= 0 r(i)/x(i)=0.24532669 ca1=0.700 tolstb=1.000 tolk-2=1.00000 tolend= 0.5E-07 thresh= 0.1E-10 kut= 0 exf=1.000 corrf=0.000 ca0= 0.500 rcn mod 32 ihf1= 0 mesh=2601 idb= 481 rdb= 100.461 emx= 0.10 r(mesh)=5426.209 irel= 1 ib=2600 t(run)= 12.88, t(job)=1258.77 seconds nl wnl ee az (r-3) (r-2) (r-1) (r+1) (r+2) (r+3) (r+4) (r+6) 1s 2. -1885.46084 881.504 0.000E+00 5.213E+03 4.936E+01 3.112E-02 1.308E-03 6.934E-05 4.438E-06 2.867E-08 2s 2. -280.74843 295.093 0.000E+00 5.731E+02 1.123E+01 1.350E-01 2.146E-02 3.880E-03 7.892E-04 4.505E-05 2p 6. -254.61475 3360.615 3.659E+03 1.600E+02 1.083E+01 1.175E-01 1.684E-02 2.853E-03 5.593E-04 3.126E-05 3s 2. -52.95888 127.558 0.000E+00 1.088E+02 3.931E+00 3.700E-01 1.565E-01 7.317E-02 3.748E-02 1.276E-02 3p 6. -43.84917 1500.501 6.406E+02 3.005E+01 3.735E+00 3.687E-01 1.577E-01 7.538E-02 3.986E-02 1.483E-02 3d 10. -29.60400 3212.018 9.187E+01 1.571E+01 3.533E+00 3.449E-01 1.415E-01 6.771E-02 3.719E-02 1.613E-02 4s 2. -8.59761 56.166 0.000E+00 2.160E+01 1.520E+00 9.114E-01 9.418E-01 1.071E+00 1.333E+00 2.683E+00 4p 6. -5.84710 623.307 1.083E+02 5.563E+00 1.363E+00 9.982E-01 1.142E+00 1.455E+00 2.052E+00 5.497E+00 4d 9. -1.85174 1073.600 8.994E+00 1.934E+00 1.004E+00 1.343E+00 2.170E+00 4.123E+00 9.126E+00 6.781E+01 5s 1. -1.17833 17.119 0.000E+00 2.118E+00 4.675E-01 2.734E+00 8.472E+00 2.923E+01 1.116E+02 2.168E+03 9h 1. -0.01235 0.000 8.314E-06 2.494E-04 1.235E-02 1.065E+02 1.280E+04 1.633E+06 2.163E+08 4.115E+12 47. 1.318E+04 2.725E+02 1.366E+02 1.284E+04 1.633E+06 2.163E+08 4.115E+12 1. 2.805E+02 5.798E+00 2.906E+00 2.731E+02 3.475E+04 4.602E+06 8.756E+10 --------------------zeta--------------------- nl wnl ----blume-watson---- -----(r*vi)----- i (ryd) eps s evel edar evel+edar erel (ryd) (cm-1) (ryd) (cm-1) 1s 2. 0.00000 0.000 0.00000 0.000-2274.99709 -1877.19715 -398.57963 331.78280 -66.797 -1943.99398 2s 2. 0.00000 0.000 0.00000 0.000 -567.83896 -282.03306 -54.20917 36.23356 -17.976 -300.00868 2p 6. 8.55126 938392.336 8.80382 966107.342 -555.31980 -254.76192 -7.22309 -0.01377 -7.223 -261.98500 3s 2. 0.00000 0.000 0.00000 0.000 -234.94724 -54.56439 -10.56476 6.74711 -3.818 -58.38204 3p 6. 1.49487 164042.946 1.53306 168233.437 -227.35202 -45.41226 -1.64604 -0.00221 -1.646 -47.05830 3d 10. 0.17194 18868.611 0.18433 20228.020 -218.95974 -30.82977 -0.37684 -0.01081 -0.377 -31.20661 4s 2. 0.00000 0.000 0.00000 0.000 -108.40485 -9.35529 -2.07114 1.30745 -0.764 -10.11898 4p 6. 0.25235 27692.514 0.25851 28367.729 -99.73441 -6.56218 -0.29425 -0.00026 -0.294 -6.85643 4d 9. 0.01659 1820.207 0.01763 1934.371 -77.91714 -2.38714 -0.04242 -0.00102 -0.042 -2.42957 5s 1. 0.00000 0.000 0.00000 0.000 -39.89827 -1.24585 -0.19280 0.12146 -0.071 -1.31719 9h 1. 0.00000 0.002 0.00000 0.000 -1.14815 -0.00864 0.00000 0.00000 0.000 -0.00864 ag i d9 5s9h nconf= 73 z= 47 ion= 0 kut=-1 exf=0.650 corrf=0.000 ca1=0.700 ca0=0.500 without correlation with correlation ----------------------- ----------------------- nl wnl eps fg eps fgr corr eps fg eps fgr n*r n*rc ect ec----------------- 1s 2. -1886.30766 -1886.30766-0.08290 -1886.39057 -1886.39057 0.0230 0.0230 -0.08267 0.00000-0.08267 2s 2. -285.09821 -285.09821-0.08232 -285.18053 -285.18053 0.0592 0.0592 -0.23110 -0.06744-0.08099 2p 6. -255.72947 -255.72947-0.08242 -255.81189 -255.81189 0.0625 0.0625 -0.72296 -0.08169-0.08186-0.08197-0.08206-0.08218 3s 2. -55.90402 -55.90402-0.08107 -55.98509 -55.98509 0.1337 0.1336 -0.86760 -0.06668-0.07795 3p 6. -45.94780 -45.94780-0.08107 -46.02886 -46.02886 0.1475 0.1474 -1.34526 -0.07880-0.07928-0.07960-0.07983-0.08015 3d 10. -30.15152 -30.15152-0.08120 -30.23271 -30.23271 0.1821 0.1819 -2.15235 -0.08039-0.08049-0.08057-0.08064-0.08095 4s 2. -9.62587 -9.62587-0.07794 -9.70382 -9.70382 0.3223 0.3210 -2.28909 -0.06414-0.07260 4p 6. -6.52631 -6.52631-0.07740 -6.60371 -6.60371 0.3914 0.3891 -2.73538 -0.07242-0.07363-0.07437-0.07491-0.07565 4d 9. -2.00387 -2.00387-0.07469 -2.07856 -2.07856 0.7064 0.6936 -3.39164 -0.07030-0.07165-0.07235-0.07285-0.07431 5s 1. -1.12903 -1.12903-0.05730 -1.18633 -1.18633 0.9411 0.9181 -3.44894 -0.05730 9h 1. -0.01234 -0.01234 0.00000 -0.01235 -0.01235 9.0007 9.0002 -3.44894 0.00000 ecorrt= -3.63526 (old) ect= -3.44894 (new) etotrl= 0.00000 + 0.00000 + 0.00000 etot= -10621.24808 -10621.24808 -10624.88334 -10624.88334 -10624.69701 -10624.69701 -10624.69701 ag i d9 5s9h 10 -10624.6970 0 1.8202 2 0.0000 2 0.0040 3 0.0000 3 14.1995 4 0.0000 4 0.0000 4 0.0000 4 0.0000 4 t(run)= 18.32, t(job)=1264.21 seconds 47 1ag i d10 8k 4d10 8k ag i d10 8k nconf= 74 z= 47 ncores= 9 nvales= 1 ion= 0 r(i)/x(i)=0.24532669 ca1=0.700 tolstb=1.000 tolk-2=1.00000 tolend= 0.5E-07 thresh= 0.1E-10 kut= 0 exf=1.000 corrf=0.000 ca0= 0.500 rcn mod 32 ihf1= 0 mesh=2601 idb= 481 rdb= 100.461 emx= 0.10 r(mesh)=5426.209 irel= 1 ib=2600 t(run)= 11.88, t(job)=1276.09 seconds nl wnl ee az (r-3) (r-2) (r-1) (r+1) (r+2) (r+3) (r+4) (r+6) 1s 2. -1885.11540 881.507 0.000E+00 5.213E+03 4.936E+01 3.112E-02 1.308E-03 6.934E-05 4.438E-06 2.867E-08 2s 2. -280.38629 295.095 0.000E+00 5.731E+02 1.123E+01 1.350E-01 2.146E-02 3.880E-03 7.892E-04 4.505E-05 2p 6. -254.25395 3360.692 3.659E+03 1.600E+02 1.083E+01 1.175E-01 1.683E-02 2.853E-03 5.593E-04 3.126E-05 3s 2. -52.60253 127.553 0.000E+00 1.088E+02 3.931E+00 3.700E-01 1.565E-01 7.318E-02 3.748E-02 1.276E-02 3p 6. -43.49275 1500.439 6.406E+02 3.004E+01 3.735E+00 3.687E-01 1.577E-01 7.538E-02 3.987E-02 1.484E-02 3d 10. -29.24558 3211.671 9.185E+01 1.570E+01 3.533E+00 3.450E-01 1.415E-01 6.773E-02 3.720E-02 1.614E-02 4s 2. -8.25994 56.016 0.000E+00 2.149E+01 1.516E+00 9.139E-01 9.475E-01 1.082E+00 1.354E+00 2.767E+00 4p 6. -5.51882 619.965 1.071E+02 5.509E+00 1.356E+00 1.004E+00 1.156E+00 1.486E+00 2.119E+00 5.841E+00 4d 10. -1.55754 1036.575 8.404E+00 1.825E+00 9.716E-01 1.397E+00 2.375E+00 4.802E+00 1.143E+01 1.006E+02 8k 1. -0.01562 0.000 4.650E-06 2.604E-04 1.562E-02 6.800E+01 4.896E+03 3.721E+05 2.977E+07 2.200E+11 47. 1.318E+04 2.727E+02 9.726E+01 4.931E+03 3.722E+05 2.977E+07 2.200E+11 1. 2.804E+02 5.802E+00 2.069E+00 1.049E+02 7.918E+03 6.334E+05 4.682E+09 --------------------zeta--------------------- nl wnl ----blume-watson---- -----(r*vi)----- i (ryd) eps s evel edar evel+edar erel (ryd) (cm-1) (ryd) (cm-1) 1s 2. 0.00000 0.000 0.00000 0.000-2274.99730 -1876.85183 -398.58175 331.78492 -66.797 -1943.64866 2s 2. 0.00000 0.000 0.00000 0.000 -567.83950 -281.67133 -54.21010 36.23414 -17.976 -299.64729 2p 6. 8.55158 938426.774 8.80416 966144.843 -555.32084 -254.40124 -7.22339 -0.01376 -7.223 -261.62464 3s 2. 0.00000 0.000 0.00000 0.000 -234.94456 -54.20766 -10.56400 6.74662 -3.817 -58.02504 3p 6. 1.49473 164028.098 1.53292 168218.910 -227.34854 -45.05548 -1.64589 -0.00221 -1.646 -46.70137 3d 10. 0.17191 18864.973 0.18429 20224.034 -218.95188 -30.47143 -0.37676 -0.01081 -0.377 -30.84819 4s 2. 0.00000 0.000 0.00000 0.000 -108.22126 -9.02207 -2.06002 1.30044 -0.760 -9.78165 4p 6. 0.24966 27397.078 0.25575 28064.979 -99.37775 -6.23776 -0.29109 -0.00026 -0.291 -6.52885 4d 10. 0.01547 1698.153 0.01645 1804.895 -75.87238 -2.08190 -0.03955 -0.00095 -0.040 -2.12145 8k 1. 0.00000 0.001 0.00000 0.000 -1.45312 -0.00868 0.00000 0.00000 0.000 -0.00868 ag i d10 8k nconf= 74 z= 47 ion= 0 kut=-1 exf=0.650 corrf=0.000 ca1=0.700 ca0=0.500 without correlation with correlation ----------------------- ----------------------- nl wnl eps fg eps fgr corr eps fg eps fgr n*r n*rc ect ec----------------- 1s 2. -1885.96103 -1885.96103-0.08290 -1886.04393 -1886.04393 0.0230 0.0230 -0.08267 0.00000-0.08267 2s 2. -284.73457 -284.73457-0.08232 -284.81689 -284.81689 0.0593 0.0593 -0.23110 -0.06744-0.08099 2p 6. -255.36942 -255.36942-0.08242 -255.45184 -255.45184 0.0626 0.0626 -0.72296 -0.08169-0.08186-0.08197-0.08206-0.08218 3s 2. -55.54142 -55.54142-0.08107 -55.62249 -55.62249 0.1342 0.1341 -0.86759 -0.06668-0.07795 3p 6. -45.58918 -45.58918-0.08107 -45.67024 -45.67024 0.1481 0.1480 -1.34526 -0.07880-0.07928-0.07960-0.07983-0.08015 3d 10. -29.79643 -29.79643-0.08120 -29.87763 -29.87763 0.1832 0.1829 -2.15235 -0.08039-0.08049-0.08057-0.08064-0.08095 4s 2. -9.29237 -9.29237-0.07796 -9.37033 -9.37033 0.3280 0.3267 -2.28891 -0.06401-0.07255 4p 6. -6.22858 -6.22858-0.07741 -6.30599 -6.30599 0.4007 0.3982 -2.73478 -0.07233-0.07355-0.07430-0.07484-0.07559 4d 10. -1.70402 -1.70402-0.07408 -1.77810 -1.77810 0.7661 0.7499 -3.45992 -0.06933-0.07096-0.07175-0.07230-0.07408 8k 1. -0.01562 -0.01562 0.00000 -0.01562 -0.01562 8.0002 8.0002 -3.45992 0.00000 ecorrt= -3.64659 (old) ect= -3.45992 (new) etotrl= 0.00000 + 0.00000 + 0.00000 etot= -10621.59289 -10621.59289 -10625.23948 -10625.23948 -10625.05281 -10625.05281 -10625.05281 ag i d10 8k 2 -10625.0528 0 0.0000 2 t(run)= 16.53, t(job)=1280.74 seconds 47 1ag i d10 9k 4d10 9k ag i d10 9k nconf= 75 z= 47 ncores= 9 nvales= 1 ion= 0 r(i)/x(i)=0.24532669 ca1=0.700 tolstb=1.000 tolk-2=1.00000 tolend= 0.5E-07 thresh= 0.1E-10 kut= 0 exf=1.000 corrf=0.000 ca0= 0.500 rcn mod 32 ihf1= 0 mesh=2601 idb= 481 rdb= 100.461 emx= 0.10 r(mesh)=5426.209 irel= 1 ib=2600 t(run)= 12.28, t(job)=1293.02 seconds nl wnl ee az (r-3) (r-2) (r-1) (r+1) (r+2) (r+3) (r+4) (r+6) 1s 2. -1885.12196 881.507 0.000E+00 5.213E+03 4.936E+01 3.112E-02 1.308E-03 6.934E-05 4.438E-06 2.867E-08 2s 2. -280.39285 295.095 0.000E+00 5.731E+02 1.123E+01 1.350E-01 2.146E-02 3.880E-03 7.892E-04 4.505E-05 2p 6. -254.26051 3360.692 3.659E+03 1.600E+02 1.083E+01 1.175E-01 1.683E-02 2.853E-03 5.593E-04 3.126E-05 3s 2. -52.60909 127.553 0.000E+00 1.088E+02 3.931E+00 3.700E-01 1.565E-01 7.318E-02 3.748E-02 1.276E-02 3p 6. -43.49931 1500.439 6.406E+02 3.004E+01 3.735E+00 3.687E-01 1.577E-01 7.538E-02 3.987E-02 1.484E-02 3d 10. -29.25214 3211.670 9.185E+01 1.570E+01 3.533E+00 3.450E-01 1.415E-01 6.773E-02 3.720E-02 1.614E-02 4s 2. -8.26650 56.016 0.000E+00 2.149E+01 1.516E+00 9.139E-01 9.475E-01 1.082E+00 1.354E+00 2.767E+00 4p 6. -5.52537 619.965 1.071E+02 5.509E+00 1.356E+00 1.004E+00 1.156E+00 1.486E+00 2.119E+00 5.841E+00 4d 10. -1.56410 1036.575 8.404E+00 1.825E+00 9.716E-01 1.397E+00 2.375E+00 4.802E+00 1.143E+01 1.006E+02 9k 1. -0.01235 0.000 3.266E-06 1.829E-04 1.235E-02 9.350E+01 9.639E+03 1.060E+06 1.219E+08 1.784E+12 47. 1.318E+04 2.727E+02 1.228E+02 9.674E+03 1.060E+06 1.219E+08 1.784E+12 1. 2.804E+02 5.802E+00 2.612E+00 2.058E+02 2.255E+04 2.593E+06 3.797E+10 --------------------zeta--------------------- nl wnl ----blume-watson---- -----(r*vi)----- i (ryd) eps s evel edar evel+edar erel (ryd) (cm-1) (ryd) (cm-1) 1s 2. 0.00000 0.000 0.00000 0.000-2274.99729 -1876.85839 -398.58175 331.78491 -66.797 -1943.65523 2s 2. 0.00000 0.000 0.00000 0.000 -567.83950 -281.67788 -54.21010 36.23414 -17.976 -299.65385 2p 6. 8.55158 938426.774 8.80416 966144.844 -555.32084 -254.40780 -7.22339 -0.01376 -7.223 -261.63119 3s 2. 0.00000 0.000 0.00000 0.000 -234.94456 -54.21422 -10.56400 6.74662 -3.817 -58.03159 3p 6. 1.49473 164028.098 1.53292 168218.910 -227.34854 -45.06204 -1.64589 -0.00221 -1.646 -46.70793 3d 10. 0.17191 18864.973 0.18429 20224.034 -218.95188 -30.47799 -0.37676 -0.01081 -0.377 -30.85475 4s 2. 0.00000 0.000 0.00000 0.000 -108.22126 -9.02863 -2.06002 1.30044 -0.760 -9.78821 4p 6. 0.24966 27397.079 0.25575 28064.980 -99.37775 -6.24432 -0.29109 -0.00026 -0.291 -6.53541 4d 10. 0.01547 1698.153 0.01645 1804.895 -75.87238 -2.08846 -0.03955 -0.00095 -0.040 -2.12801 9k 1. 0.00000 0.001 0.00000 0.000 -1.14815 -0.00768 0.00000 0.00000 0.000 -0.00768 ag i d10 9k nconf= 75 z= 47 ion= 0 kut=-1 exf=0.650 corrf=0.000 ca1=0.700 ca0=0.500 without correlation with correlation ----------------------- ----------------------- nl wnl eps fg eps fgr corr eps fg eps fgr n*r n*rc ect ec----------------- 1s 2. -1885.96759 -1885.96759-0.08290 -1886.05049 -1886.05049 0.0230 0.0230 -0.08267 0.00000-0.08267 2s 2. -284.74113 -284.74113-0.08232 -284.82345 -284.82345 0.0593 0.0593 -0.23110 -0.06744-0.08099 2p 6. -255.37598 -255.37598-0.08242 -255.45840 -255.45840 0.0626 0.0626 -0.72296 -0.08169-0.08186-0.08197-0.08206-0.08218 3s 2. -55.54798 -55.54798-0.08107 -55.62905 -55.62905 0.1342 0.1341 -0.86759 -0.06668-0.07795 3p 6. -45.59573 -45.59573-0.08107 -45.67680 -45.67680 0.1481 0.1480 -1.34526 -0.07880-0.07928-0.07960-0.07983-0.08015 3d 10. -29.80299 -29.80299-0.08120 -29.88419 -29.88419 0.1832 0.1829 -2.15235 -0.08039-0.08049-0.08057-0.08064-0.08095 4s 2. -9.29893 -9.29893-0.07796 -9.37689 -9.37689 0.3279 0.3266 -2.28891 -0.06401-0.07255 4p 6. -6.23514 -6.23514-0.07741 -6.31255 -6.31255 0.4005 0.3980 -2.73478 -0.07233-0.07355-0.07430-0.07484-0.07559 4d 10. -1.71058 -1.71058-0.07408 -1.78466 -1.78466 0.7646 0.7486 -3.45992 -0.06933-0.07096-0.07175-0.07230-0.07408 9k 1. -0.01235 -0.01235 0.00000 -0.01235 -0.01235 8.9996 8.9996 -3.45992 0.00000 ecorrt= -3.64659 (old) ect= -3.45992 (new) etotrl= 0.00000 + 0.00000 + 0.00000 etot= -10621.58961 -10621.58961 -10625.23620 -10625.23620 -10625.04952 -10625.04952 -10625.04952 ag i d10 9k 2 -10625.0495 0 0.0000 2 t(run)= 16.94, t(job)=1297.68 seconds 47 1ag i d9 5s8k 4d9 5s 8k ag i d9 5s8k nconf= 76 z= 47 ncores=10 nvales= 1 ion= 0 r(i)/x(i)=0.24532669 ca1=0.700 tolstb=1.000 tolk-2=1.00000 tolend= 0.5E-07 thresh= 0.1E-10 kut= 0 exf=1.000 corrf=0.000 ca0= 0.500 rcn mod 32 ihf1= 0 mesh=2601 idb= 481 rdb= 100.461 emx= 0.10 r(mesh)=5426.209 irel= 1 ib=2600 t(run)= 11.97, t(job)=1309.65 seconds nl wnl ee az (r-3) (r-2) (r-1) (r+1) (r+2) (r+3) (r+4) (r+6) 1s 2. -1885.45428 881.504 0.000E+00 5.213E+03 4.936E+01 3.112E-02 1.308E-03 6.934E-05 4.438E-06 2.867E-08 2s 2. -280.74187 295.093 0.000E+00 5.731E+02 1.123E+01 1.350E-01 2.146E-02 3.880E-03 7.892E-04 4.505E-05 2p 6. -254.60819 3360.615 3.659E+03 1.600E+02 1.083E+01 1.175E-01 1.684E-02 2.853E-03 5.593E-04 3.126E-05 3s 2. -52.95232 127.558 0.000E+00 1.088E+02 3.931E+00 3.700E-01 1.565E-01 7.317E-02 3.748E-02 1.276E-02 3p 6. -43.84261 1500.501 6.406E+02 3.005E+01 3.735E+00 3.687E-01 1.577E-01 7.538E-02 3.986E-02 1.483E-02 3d 10. -29.59744 3212.018 9.187E+01 1.571E+01 3.533E+00 3.449E-01 1.415E-01 6.771E-02 3.719E-02 1.613E-02 4s 2. -8.59105 56.166 0.000E+00 2.160E+01 1.520E+00 9.114E-01 9.418E-01 1.071E+00 1.333E+00 2.683E+00 4p 6. -5.84054 623.307 1.083E+02 5.563E+00 1.363E+00 9.982E-01 1.142E+00 1.455E+00 2.052E+00 5.497E+00 4d 9. -1.84518 1073.600 8.994E+00 1.934E+00 1.004E+00 1.343E+00 2.170E+00 4.123E+00 9.126E+00 6.781E+01 5s 1. -1.17177 17.119 0.000E+00 2.118E+00 4.675E-01 2.734E+00 8.472E+00 2.923E+01 1.116E+02 2.168E+03 8k 1. -0.01562 0.000 4.650E-06 2.604E-04 1.562E-02 6.800E+01 4.896E+03 3.721E+05 2.977E+07 2.200E+11 47. 1.318E+04 2.725E+02 9.807E+01 4.936E+03 3.722E+05 2.977E+07 2.200E+11 1. 2.805E+02 5.798E+00 2.087E+00 1.050E+02 7.919E+03 6.334E+05 4.682E+09 --------------------zeta--------------------- nl wnl ----blume-watson---- -----(r*vi)----- i (ryd) eps s evel edar evel+edar erel (ryd) (cm-1) (ryd) (cm-1) 1s 2. 0.00000 0.000 0.00000 0.000-2274.99709 -1877.19059 -398.57963 331.78281 -66.797 -1943.98742 2s 2. 0.00000 0.000 0.00000 0.000 -567.83896 -282.02651 -54.20917 36.23356 -17.976 -300.00212 2p 6. 8.55126 938392.336 8.80382 966107.342 -555.31980 -254.75536 -7.22309 -0.01377 -7.223 -261.97845 3s 2. 0.00000 0.000 0.00000 0.000 -234.94724 -54.55783 -10.56476 6.74711 -3.818 -58.37548 3p 6. 1.49487 164042.946 1.53306 168233.437 -227.35202 -45.40570 -1.64604 -0.00221 -1.646 -47.05174 3d 10. 0.17194 18868.611 0.18433 20228.020 -218.95974 -30.82321 -0.37684 -0.01081 -0.377 -31.20005 4s 2. 0.00000 0.000 0.00000 0.000 -108.40485 -9.34873 -2.07114 1.30745 -0.764 -10.11242 4p 6. 0.25235 27692.514 0.25851 28367.729 -99.73441 -6.55562 -0.29425 -0.00026 -0.294 -6.84987 4d 9. 0.01659 1820.207 0.01763 1934.371 -77.91714 -2.38059 -0.04242 -0.00102 -0.042 -2.42301 5s 1. 0.00000 0.000 0.00000 0.000 -39.89827 -1.23929 -0.19280 0.12146 -0.071 -1.31063 8k 1. 0.00000 0.001 0.00000 0.000 -1.45312 -0.00868 0.00000 0.00000 0.000 -0.00868 ag i d9 5s8k nconf= 76 z= 47 ion= 0 kut=-1 exf=0.650 corrf=0.000 ca1=0.700 ca0=0.500 without correlation with correlation ----------------------- ----------------------- nl wnl eps fg eps fgr corr eps fg eps fgr n*r n*rc ect ec----------------- 1s 2. -1886.30111 -1886.30111-0.08290 -1886.38401 -1886.38401 0.0230 0.0230 -0.08267 0.00000-0.08267 2s 2. -285.09165 -285.09165-0.08232 -285.17398 -285.17398 0.0592 0.0592 -0.23110 -0.06744-0.08099 2p 6. -255.72291 -255.72291-0.08242 -255.80533 -255.80533 0.0625 0.0625 -0.72296 -0.08169-0.08186-0.08197-0.08206-0.08218 3s 2. -55.89746 -55.89746-0.08107 -55.97853 -55.97853 0.1338 0.1337 -0.86760 -0.06668-0.07795 3p 6. -45.94124 -45.94124-0.08107 -46.02230 -46.02230 0.1475 0.1474 -1.34526 -0.07880-0.07928-0.07960-0.07983-0.08015 3d 10. -30.14496 -30.14496-0.08120 -30.22616 -30.22616 0.1821 0.1819 -2.15235 -0.08039-0.08049-0.08057-0.08064-0.08095 4s 2. -9.61932 -9.61932-0.07794 -9.69726 -9.69726 0.3224 0.3211 -2.28909 -0.06414-0.07260 4p 6. -6.51975 -6.51975-0.07740 -6.59716 -6.59716 0.3916 0.3893 -2.73538 -0.07242-0.07363-0.07437-0.07491-0.07565 4d 9. -1.99731 -1.99731-0.07469 -2.07200 -2.07200 0.7076 0.6947 -3.39164 -0.07030-0.07165-0.07235-0.07285-0.07431 5s 1. -1.12247 -1.12247-0.05730 -1.17977 -1.17977 0.9439 0.9207 -3.44894 -0.05730 8k 1. -0.01562 -0.01562 0.00000 -0.01562 -0.01562 8.0002 8.0002 -3.44894 0.00000 ecorrt= -3.63526 (old) ect= -3.44894 (new) etotrl= 0.00000 + 0.00000 + 0.00000 etot= -10621.25136 -10621.25136 -10624.88662 -10624.88662 -10624.70030 -10624.70030 -10624.70030 ag i d9 5s8k 10 -10624.7003 0 1.8202 2 0.0000 2 0.0022 3 0.0000 3 14.1995 4 0.0000 4 0.0000 4 0.0000 4 0.0000 4 t(run)= 17.35, t(job)=1315.03 seconds 47 1ag i d9 5s9k 4d9 5s 9k ag i d9 5s9k nconf= 77 z= 47 ncores=10 nvales= 1 ion= 0 r(i)/x(i)=0.24532669 ca1=0.700 tolstb=1.000 tolk-2=1.00000 tolend= 0.5E-07 thresh= 0.1E-10 kut= 0 exf=1.000 corrf=0.000 ca0= 0.500 rcn mod 32 ihf1= 0 mesh=2601 idb= 481 rdb= 100.461 emx= 0.10 r(mesh)=5426.209 irel= 1 ib=2600 t(run)= 13.28, t(job)=1328.31 seconds nl wnl ee az (r-3) (r-2) (r-1) (r+1) (r+2) (r+3) (r+4) (r+6) 1s 2. -1885.46084 881.504 0.000E+00 5.213E+03 4.936E+01 3.112E-02 1.308E-03 6.934E-05 4.438E-06 2.867E-08 2s 2. -280.74843 295.093 0.000E+00 5.731E+02 1.123E+01 1.350E-01 2.146E-02 3.880E-03 7.892E-04 4.505E-05 2p 6. -254.61475 3360.615 3.659E+03 1.600E+02 1.083E+01 1.175E-01 1.684E-02 2.853E-03 5.593E-04 3.126E-05 3s 2. -52.95888 127.558 0.000E+00 1.088E+02 3.931E+00 3.700E-01 1.565E-01 7.317E-02 3.748E-02 1.276E-02 3p 6. -43.84917 1500.501 6.406E+02 3.005E+01 3.735E+00 3.687E-01 1.577E-01 7.538E-02 3.986E-02 1.483E-02 3d 10. -29.60400 3212.018 9.187E+01 1.571E+01 3.533E+00 3.449E-01 1.415E-01 6.771E-02 3.719E-02 1.613E-02 4s 2. -8.59761 56.166 0.000E+00 2.160E+01 1.520E+00 9.114E-01 9.418E-01 1.071E+00 1.333E+00 2.683E+00 4p 6. -5.84710 623.307 1.083E+02 5.563E+00 1.363E+00 9.982E-01 1.142E+00 1.455E+00 2.052E+00 5.497E+00 4d 9. -1.85174 1073.600 8.994E+00 1.934E+00 1.004E+00 1.343E+00 2.170E+00 4.123E+00 9.126E+00 6.781E+01 5s 1. -1.17833 17.119 0.000E+00 2.118E+00 4.675E-01 2.734E+00 8.472E+00 2.923E+01 1.116E+02 2.168E+03 9k 1. -0.01235 0.000 3.266E-06 1.829E-04 1.235E-02 9.350E+01 9.639E+03 1.060E+06 1.219E+08 1.784E+12 47. 1.318E+04 2.725E+02 1.236E+02 9.679E+03 1.060E+06 1.219E+08 1.784E+12 1. 2.805E+02 5.798E+00 2.629E+00 2.059E+02 2.255E+04 2.593E+06 3.797E+10 --------------------zeta--------------------- nl wnl ----blume-watson---- -----(r*vi)----- i (ryd) eps s evel edar evel+edar erel (ryd) (cm-1) (ryd) (cm-1) 1s 2. 0.00000 0.000 0.00000 0.000-2274.99709 -1877.19715 -398.57963 331.78280 -66.797 -1943.99398 2s 2. 0.00000 0.000 0.00000 0.000 -567.83896 -282.03306 -54.20917 36.23356 -17.976 -300.00868 2p 6. 8.55126 938392.336 8.80382 966107.342 -555.31980 -254.76192 -7.22309 -0.01377 -7.223 -261.98501 3s 2. 0.00000 0.000 0.00000 0.000 -234.94724 -54.56439 -10.56476 6.74711 -3.818 -58.38204 3p 6. 1.49487 164042.946 1.53306 168233.437 -227.35202 -45.41226 -1.64604 -0.00221 -1.646 -47.05830 3d 10. 0.17194 18868.611 0.18433 20228.020 -218.95974 -30.82977 -0.37684 -0.01081 -0.377 -31.20661 4s 2. 0.00000 0.000 0.00000 0.000 -108.40485 -9.35529 -2.07114 1.30745 -0.764 -10.11898 4p 6. 0.25235 27692.514 0.25851 28367.729 -99.73441 -6.56218 -0.29425 -0.00026 -0.294 -6.85643 4d 9. 0.01659 1820.207 0.01763 1934.371 -77.91714 -2.38714 -0.04242 -0.00102 -0.042 -2.42957 5s 1. 0.00000 0.000 0.00000 0.000 -39.89827 -1.24585 -0.19280 0.12146 -0.071 -1.31719 9k 1. 0.00000 0.001 0.00000 0.000 -1.14815 -0.00768 0.00000 0.00000 0.000 -0.00768 ag i d9 5s9k nconf= 77 z= 47 ion= 0 kut=-1 exf=0.650 corrf=0.000 ca1=0.700 ca0=0.500 without correlation with correlation ----------------------- ----------------------- nl wnl eps fg eps fgr corr eps fg eps fgr n*r n*rc ect ec----------------- 1s 2. -1886.30766 -1886.30766-0.08290 -1886.39057 -1886.39057 0.0230 0.0230 -0.08267 0.00000-0.08267 2s 2. -285.09821 -285.09821-0.08232 -285.18053 -285.18053 0.0592 0.0592 -0.23110 -0.06744-0.08099 2p 6. -255.72947 -255.72947-0.08242 -255.81189 -255.81189 0.0625 0.0625 -0.72296 -0.08169-0.08186-0.08197-0.08206-0.08218 3s 2. -55.90402 -55.90402-0.08107 -55.98509 -55.98509 0.1337 0.1336 -0.86760 -0.06668-0.07795 3p 6. -45.94780 -45.94780-0.08107 -46.02886 -46.02886 0.1475 0.1474 -1.34526 -0.07880-0.07928-0.07960-0.07983-0.08015 3d 10. -30.15152 -30.15152-0.08120 -30.23271 -30.23271 0.1821 0.1819 -2.15235 -0.08039-0.08049-0.08057-0.08064-0.08095 4s 2. -9.62587 -9.62587-0.07794 -9.70382 -9.70382 0.3223 0.3210 -2.28909 -0.06414-0.07260 4p 6. -6.52631 -6.52631-0.07740 -6.60371 -6.60371 0.3914 0.3891 -2.73538 -0.07242-0.07363-0.07437-0.07491-0.07565 4d 9. -2.00387 -2.00387-0.07469 -2.07856 -2.07856 0.7064 0.6936 -3.39164 -0.07030-0.07165-0.07235-0.07285-0.07431 5s 1. -1.12903 -1.12903-0.05730 -1.18633 -1.18633 0.9411 0.9181 -3.44894 -0.05730 9k 1. -0.01235 -0.01235 0.00000 -0.01235 -0.01235 8.9996 8.9996 -3.44894 0.00000 ecorrt= -3.63526 (old) ect= -3.44894 (new) etotrl= 0.00000 + 0.00000 + 0.00000 etot= -10621.24808 -10621.24808 -10624.88334 -10624.88334 -10624.69702 -10624.69702 -10624.69702 ag i d9 5s9k 10 -10624.6970 0 1.8202 2 0.0000 2 0.0016 3 0.0000 3 14.1995 4 0.0000 4 0.0000 4 0.0000 4 0.0000 4 t(run)= 19.04, t(job)=1334.07 seconds -1 $run cray:rcn2c rcn2---input for rcg mod 9 1 84141836360 1 3 1000.0000 7 8 0 9 0 0 1 d10 s 1 p 0 s 0 d 0 g 0 i 0 l 0 ag i d10 5s eav= -1166019.096 kk d10 s 0 p 0 s 1 d 0 g 0 i 0 l 0 ag i d10 6s eav= -1165980.976 kk d10 s 0 p 0 s 1 d 0 g 0 i 0 l 0 ag i d10 7s eav= -1165972.009 kk d10 s 0 p 0 s 1 d 0 g 0 i 0 l 0 ag i d10 8s eav= -1165968.426 kk d10 s 0 p 0 s 1 d 0 g 0 i 0 l 0 ag i d10 9s eav= -1165966.627 kk d 9 s 2 p 0 s 0 d 0 g 0 i 0 l 0 ag i d9 5s2 eav= -1165987.901 kk d 9 s 1 p 0 s 1 d 0 g 0 i 0 l 0 ag i d9 5s6s eav= -1165944.616 kk d 9 s 1 p 0 s 1 d 0 g 0 i 0 l 0 ag i d9 5s7s eav= -1165934.001 kk d 9 s 1 p 0 s 1 d 0 g 0 i 0 l 0 ag i d9 5s8s eav= -1165930.039 kk d 9 s 1 p 0 s 1 d 0 g 0 i 0 l 0 ag i d9 5s9s eav= -1165928.101 kk d 8 s 2 p 0 s 1 d 0 g 0 i 0 l 0 ag i d8 5s2 6s eav= -1165881.916 kk d10 s 0 p 0 s 0 d 1 g 0 i 0 l 0 ag i d10 5d eav= -1165975.465 kk d10 s 0 p 0 s 0 d 1 g 0 i 0 l 0 ag i d10 6d eav= -1165969.934 kk d10 s 0 p 0 s 0 d 1 g 0 i 0 l 0 ag i d10 7d eav= -1165967.426 kk d10 s 0 p 0 s 0 d 1 g 0 i 0 l 0 ag i d10 8d eav= -1165966.060 kk d10 s 0 p 0 s 0 d 1 g 0 i 0 l 0 ag i d10 9d eav= -1165965.245 kk d 9 s 1 p 0 s 0 d 1 g 0 i 0 l 0 ag i d9 5s5d eav= -1165937.471 kk d 9 s 1 p 0 s 0 d 1 g 0 i 0 l 0 ag i d9 5s6d eav= -1165931.492 kk d 9 s 1 p 0 s 0 d 1 g 0 i 0 l 0 ag i d9 5s7d eav= -1165928.847 kk d 9 s 1 p 0 s 0 d 1 g 0 i 0 l 0 ag i d9 5s8d eav= -1165927.439 kk d 9 s 1 p 0 s 0 d 1 g 0 i 0 l 0 ag i d9 5s9d eav= -1165926.599 kk d 8 s 2 p 0 s 0 d 1 g 0 i 0 l 0 ag i d8 5s2 5d eav= -1165873.622 kk d10 s 0 p 0 s 0 d 0 g 1 i 0 l 0 ag i d10 5g eav= -1165967.393 kk d10 s 0 p 0 s 0 d 0 g 1 i 0 l 0 ag i d10 6g eav= -1165966.050 kk d10 s 0 p 0 s 0 d 0 g 1 i 0 l 0 ag i d10 7g eav= -1165965.240 kk d10 s 0 p 0 s 0 d 0 g 1 i 0 l 0 ag i d10 8g eav= -1165964.714 kk d10 s 0 p 0 s 0 d 0 g 1 i 0 l 0 ag i d10 9g eav= -1165964.353 kk d 9 s 1 p 0 s 0 d 0 g 1 i 0 l 0 ag i d9 5s5g eav= -1165928.712 kk d 9 s 1 p 0 s 0 d 0 g 1 i 0 l 0 ag i d9 5s6g eav= -1165927.370 kk d 9 s 1 p 0 s 0 d 0 g 1 i 0 l 0 ag i d9 5s7g eav= -1165926.559 kk d 9 s 1 p 0 s 0 d 0 g 1 i 0 l 0 ag i d9 5s8g eav= -1165926.033 kk d 9 s 1 p 0 s 0 d 0 g 1 i 0 l 0 ag i d9 5s9g eav= -1165925.672 kk d10 s 0 p 0 s 0 d 0 g 0 i 1 l 0 ag i d10 7i eav= -1165965.239 kk d10 s 0 p 0 s 0 d 0 g 0 i 1 l 0 ag i d10 8i eav= -1165964.713 kk d10 s 0 p 0 s 0 d 0 g 0 i 1 l 0 ag i d10 9i eav= -1165964.353 kk d 9 s 1 p 0 s 0 d 0 g 0 i 1 l 0 ag i d9 5s7i eav= -1165926.556 kk d 9 s 1 p 0 s 0 d 0 g 0 i 1 l 0 ag i d9 5s8i eav= -1165926.030 kk d 9 s 1 p 0 s 0 d 0 g 0 i 1 l 0 ag i d9 5s9i eav= -1165925.670 kk d10 s 0 p 0 s 0 d 0 g 0 i 0 l 1 ag i d10 9l eav= -1165964.095 kk d 9 s 1 p 0 s 0 d 0 g 0 i 0 l 1 ag i d9 5s9l eav= -1165925.412 kk d 9 s 0 p 2 s 0 d 0 g 0 i 0 l 0 ag i d9 5p2 eav= -1165922.692 kk d10 s 0 p 1 p 0 f 0 h 0 k 0 s 0 ag i d10 5p eav= -1165992.673 kk d10 s 0 p 0 p 1 f 0 h 0 k 0 s 0 ag i d10 6p eav= -1165975.215 kk d10 s 0 p 0 p 1 f 0 h 0 k 0 s 0 ag i d10 7p eav= -1165969.823 kk d10 s 0 p 0 p 1 f 0 h 0 k 0 s 0 ag i d10 8p eav= -1165967.362 kk d10 s 0 p 0 p 1 f 0 h 0 k 0 s 0 ag i d10 9p eav= -1165966.029 kk d 9 s 1 p 1 p 0 f 0 h 0 k 0 s 0 ag i d9 5s5p eav= -1165961.858 kk d 9 s 1 p 0 p 1 f 0 h 0 k 0 s 0 ag i d9 5s6p eav= -1165937.761 kk d 9 s 1 p 0 p 1 f 0 h 0 k 0 s 0 ag i d9 5s7p eav= -1165931.587 kk d 9 s 1 p 0 p 1 f 0 h 0 k 0 s 0 ag i d9 5s8p eav= -1165928.894 kk d 9 s 1 p 0 p 1 f 0 h 0 k 0 s 0 ag i d9 5s9p eav= -1165927.466 kk d 8 s 2 p 1 p 0 f 0 h 0 k 0 s 0 ag i d8 5s2 5p eav= -1165905.975 kk d10 s 0 p 0 p 0 f 1 h 0 k 0 s 0 ag i d10 4f eav= -1165969.903 kk d10 s 0 p 0 p 0 f 1 h 0 k 0 s 0 ag i d10 5f eav= -1165967.419 kk d10 s 0 p 0 p 0 f 1 h 0 k 0 s 0 ag i d10 6f eav= -1165966.067 kk d10 s 0 p 0 p 0 f 1 h 0 k 0 s 0 ag i d10 7f eav= -1165965.252 kk d10 s 0 p 0 p 0 f 1 h 0 k 0 s 0 ag i d10 8f eav= -1165964.722 kk d10 s 0 p 0 p 0 f 1 h 0 k 0 s 0 ag i d10 9f eav= -1165964.360 kk d 9 s 1 p 0 p 0 f 1 h 0 k 0 s 0 ag i d9 5s4f eav= -1165931.277 kk d 9 s 1 p 0 p 0 f 1 h 0 k 0 s 0 ag i d9 5s5f eav= -1165928.772 kk d 9 s 1 p 0 p 0 f 1 h 0 k 0 s 0 ag i d9 5s6f eav= -1165927.407 kk d 9 s 1 p 0 p 0 f 1 h 0 k 0 s 0 ag i d9 5s7f eav= -1165926.583 kk d 9 s 1 p 0 p 0 f 1 h 0 k 0 s 0 ag i d9 5s8f eav= -1165926.049 kk d 9 s 1 p 0 p 0 f 1 h 0 k 0 s 0 ag i d9 5s9f eav= -1165925.684 kk d 8 s 2 p 0 p 0 f 1 h 0 k 0 s 0 ag i d8 5s2 4f eav= -1165866.883 kk d10 s 0 p 0 p 0 f 0 h 1 k 0 s 0 ag i d10 6h eav= -1165966.049 kk d10 s 0 p 0 p 0 f 0 h 1 k 0 s 0 ag i d10 7h eav= -1165965.239 kk d10 s 0 p 0 p 0 f 0 h 1 k 0 s 0 ag i d10 8h eav= -1165964.714 kk d10 s 0 p 0 p 0 f 0 h 1 k 0 s 0 ag i d10 9h eav= -1165964.353 kk d 9 s 1 p 0 p 0 f 0 h 1 k 0 s 0 ag i d9 5s6h eav= -1165927.365 kk d 9 s 1 p 0 p 0 f 0 h 1 k 0 s 0 ag i d9 5s7h eav= -1165926.556 kk d 9 s 1 p 0 p 0 f 0 h 1 k 0 s 0 ag i d9 5s8h eav= -1165926.031 kk d 9 s 1 p 0 p 0 f 0 h 1 k 0 s 0 ag i d9 5s9h eav= -1165925.670 kk d10 s 0 p 0 p 0 f 0 h 0 k 1 s 0 ag i d10 8k eav= -1165964.714 kk d10 s 0 p 0 p 0 f 0 h 0 k 1 s 0 ag i d10 9k eav= -1165964.353 kk d 9 s 1 p 0 p 0 f 0 h 0 k 1 s 0 ag i d9 5s8k eav= -1165926.030 kk d 9 s 1 p 0 p 0 f 0 h 0 k 1 s 0 ag i d9 5s9k eav= -1165925.670 kk ag i d10 5s 0.00000 0.00000 0.00000 0.00000 0.00000 xr fact= 1.00 1.00 1.00 1.00 1.00 ag i d10 6s 38.12069 0.00000 0.00000 0.00000 0.00000 xr fact= 1.00 1.00 1.00 1.00 1.00 ag i d10 7s 47.08788 0.00000 0.00000 0.00000 0.00000 xr fact= 1.00 1.00 1.00 1.00 1.00 ag i d10 8s 50.67036 0.00000 0.00000 0.00000 0.00000 xr fact= 1.00 1.00 1.00 1.00 1.00 ag i d10 9s 52.46923 0.00000 0.00000 0.00000 0.00000 xr fact= 1.00 1.00 1.00 1.00 1.00 ag i d9 5s2 31.19566 1.79631 0.00000 0.00000 0.00000 xr fact= 1.00 1.00 1.00 1.00 1.00 ag i d9 5s6s 74.48043 1.81780 14.04234 1.04041 1.99212 xr fact= 1.00 1.00 1.00 1.00 1.00 ag i d9 5s7s 85.09579 1.81937 14.14939 0.35043 0.61292 xr fact= 1.00 1.00 1.00 1.00 1.00 ag i d9 5s8s 89.05724 1.81981 14.17836 0.16057 0.27074 xr fact= 1.00 1.00 1.00 1.00 1.00 ag i d9 5s9s 90.99523 1.81999 14.18875 0.08683 0.14366 xr fact= 1.00 1.00 1.00 1.00 1.00 ag i d8 5s2 6s 137.18065 76.36552 49.93219 1.94361 1.00403 xr fact= 1.00 1.00 1.00 1.00 1.00 ag i d10 5d 43.63166 0.00997 0.00000 0.00000 0.00000 xr fact= 1.00 1.00 1.00 1.00 1.00 ag i d10 6d 49.16286 0.00534 0.00000 0.00000 0.00000 xr fact= 1.00 1.00 1.00 1.00 1.00 ag i d10 7d 51.67025 0.00304 0.00000 0.00000 0.00000 xr fact= 1.00 1.00 1.00 1.00 1.00 ag i d10 8d 53.03627 0.00187 0.00000 0.00000 0.00000 xr fact= 1.00 1.00 1.00 1.00 1.00 ag i d10 9d 53.85164 0.00122 0.00000 0.00000 0.00000 xr fact= 1.00 1.00 1.00 1.00 1.00 ag i d9 5s5d 81.62560 1.81963 0.01106 1.45946 0.37851 xr fact= 1.00 1.00 1.00 1.00 1.00 14.07455 0.28390 0.27107 0.20292 1.30428 ag i d9 5s6d 87.60499 1.81985 0.00619 0.64573 0.19732 xr fact= 1.00 1.00 1.00 1.00 1.00 14.14350 0.15602 0.15043 0.11305 0.66177 ag i d9 5s7d 90.24934 1.81999 0.00352 0.33680 0.10951 xr fact= 1.00 1.00 1.00 1.00 1.00 14.17210 0.08758 0.08508 0.06408 0.36166 ag i d9 5s8d 91.65789 1.82007 0.00215 0.19655 0.06598 xr fact= 1.00 1.00 1.00 1.00 1.00 14.18435 0.05304 0.05173 0.03902 0.21578 ag i d9 5s9d 92.49710 1.82012 0.00140 0.12427 0.04252 xr fact= 1.00 1.00 1.00 1.00 1.00 14.19026 0.03429 0.03352 0.02530 0.13815 ag i d8 5s2 5d 145.47408 76.41595 49.96936 1.94494 0.01488 xr fact= 1.00 1.00 1.00 1.00 1.00 1.52913 0.45537 0.57980 0.41881 0.30192 ag i d10 5g 51.70390 0.00002 0.00000 0.00000 0.00000 xr fact= 1.00 1.00 1.00 1.00 1.00 ag i d10 6g 53.04650 0.00001 0.00000 0.00000 0.00000 xr fact= 1.00 1.00 1.00 1.00 1.00 ag i d10 7g 53.85671 0.00001 0.00000 0.00000 0.00000 xr fact= 1.00 1.00 1.00 1.00 1.00 ag i d10 8g 54.38221 0.00000 0.00000 0.00000 0.00000 xr fact= 1.00 1.00 1.00 1.00 1.00 ag i d10 9g 54.74339 0.00000 0.00000 0.00000 0.00000 xr fact= 1.00 1.00 1.00 1.00 1.00 ag i d9 5s5g 90.38400 1.82021 0.00002 0.04234 0.00068 xr fact= 1.00 1.00 1.00 1.00 1.00 14.19951 0.00000 0.00000 0.00000 0.00019 ag i d9 5s6g 91.72657 1.82021 0.00001 0.02452 0.00050 xr fact= 1.00 1.00 1.00 1.00 1.00 14.19951 0.00000 0.00000 0.00000 0.00020 ag i d9 5s7g 92.53751 1.82021 0.00001 0.01545 0.00036 xr fact= 1.00 1.00 1.00 1.00 1.00 14.19951 0.00000 0.00000 0.00000 0.00017 ag i d9 5s8g 93.06363 1.82021 0.00000 0.01035 0.00026 xr fact= 1.00 1.00 1.00 1.00 1.00 14.19951 0.00000 0.00000 0.00000 0.00014 ag i d9 5s9g 93.42468 1.82021 0.00000 0.00728 0.00019 xr fact= 1.00 1.00 1.00 1.00 1.00 14.19952 0.00000 0.00000 0.00000 0.00011 ag i d10 7i 53.85736 0.00000 0.00000 0.00000 0.00000 xr fact= 1.00 1.00 1.00 1.00 1.00 ag i d10 8i 54.38300 0.00000 0.00000 0.00000 0.00000 xr fact= 1.00 1.00 1.00 1.00 1.00 ag i d10 9i 54.74353 0.00000 0.00000 0.00000 0.00000 xr fact= 1.00 1.00 1.00 1.00 1.00 ag i d9 5s7i 92.54099 1.82021 0.00000 0.00509 0.00002 xr fact= 1.00 1.00 1.00 1.00 1.00 14.19953 0.00000 0.00000 0.00000 0.00000 ag i d9 5s8i 93.06620 1.82021 0.00000 0.00341 0.00001 xr fact= 1.00 1.00 1.00 1.00 1.00 14.19952 0.00000 0.00000 0.00000 0.00000 ag i d9 5s9i 93.42673 1.82021 0.00000 0.00239 0.00001 xr fact= 1.00 1.00 1.00 1.00 1.00 14.19952 0.00000 0.00000 0.00000 0.00000 ag i d10 9l 55.00128 0.00000 0.00000 0.00000 0.00000 xr fact= 1.00 1.00 1.00 1.00 1.00 ag i d9 5s9l 93.68404 1.82021 0.00000 0.00078 0.00000 xr fact= 1.00 1.00 1.00 1.00 1.00 14.19952 0.00000 0.00000 0.00000 0.00000 ag i d9 5p2 96.40476 24.85399 1.82705 1.23677 14.38049 xr fact= 1.00 1.00 1.00 1.00 1.00 5.36256 4.38519 rcn mod 32 ee,eee= -1.18713 -0.59357 ee,eee= -0.62159 -0.90436 slater integrals for ag i d10 5s nconf= 1 z= 47 ion= 0 exf=0.650 irel= 1 ag i d9 5s2 nconf= 6 kut=-1 corrf=0.000 class 0 k rdk( 4d, 4d, 4d, 5s) frac k rek( 4d, 4d, 4d, 5s) frac - ------------------------------------- ----- - ------------------------------------- ----- 2 -0.12873921 ryd = -14127.4951 cm-1 -0.490 2 -0.12873945 ryd = -14127.5209 cm-1 -0.490 ag i d10 5s -d9 5s2 1 -14.1275 5 1 6 6 1.289 0.039 96.063 sec sqrtdel= 1.0000 1.0000 -14.1275 rcn mod 32 ee,eee= -0.18687 -0.68700 slater integrals for ag i d10 5s nconf= 1 z= 47 ion= 0 exf=0.650 irel= 1 ag i d9 5s6s nconf= 7 kut=-1 corrf=0.000 class 0 k rdk( 4d, 4d, 4d, 6s) frac k rek( 4d, 4d, 4d, 6s) frac - ------------------------------------- ----- - ------------------------------------- ----- 2 -0.03748627 ryd = -4113.6423 cm-1 -0.452 2 -0.03748634 ryd = -4113.6504 cm-1 -0.452 ag i d10 5s -d9 5s6s 1 -4.1136 5 1 7 1 0.180 0.031 96.273 sec sqrtdel= 1.0000 1.0000 -4.1136 rcn mod 32 ee,eee= -0.08885 -0.63799 slater integrals for ag i d10 5s nconf= 1 z= 47 ion= 0 exf=0.650 irel= 1 ag i d9 5s7s nconf= 8 kut=-1 corrf=0.000 class 0 k rdk( 4d, 4d, 4d, 7s) frac k rek( 4d, 4d, 4d, 7s) frac - ------------------------------------- ----- - ------------------------------------- ----- 2 -0.02175359 ryd = -2387.1805 cm-1 -0.446 2 -0.02175363 ryd = -2387.1852 cm-1 -0.446 ag i d10 5s -d9 5s7s 1 -2.3872 5 1 8 1 0.148 0.039 96.492 sec sqrtdel= 1.0000 1.0000 -2.3872 rcn mod 32 ee,eee= -0.05243 -0.61978 slater integrals for ag i d10 5s nconf= 1 z= 47 ion= 0 exf=0.650 irel= 1 ag i d9 5s8s nconf= 9 kut=-1 corrf=0.000 class 0 k rdk( 4d, 4d, 4d, 8s) frac k rek( 4d, 4d, 4d, 8s) frac - ------------------------------------- ----- - ------------------------------------- ----- 2 -0.01472453 ryd = -1615.8304 cm-1 -0.444 2 -0.01472456 ryd = -1615.8337 cm-1 -0.444 ag i d10 5s -d9 5s8s 1 -1.6158 5 1 9 1 0.188 0.047 96.727 sec sqrtdel= 1.0000 1.0000 -1.6158 rcn mod 32 ee,eee= -0.03465 -0.61089 slater integrals for ag i d10 5s nconf= 1 z= 47 ion= 0 exf=0.650 irel= 1 ag i d9 5s9s nconf=10 kut=-1 corrf=0.000 class 0 k rdk( 4d, 4d, 4d, 9s) frac k rek( 4d, 4d, 4d, 9s) frac - ------------------------------------- ----- - ------------------------------------- ----- 2 -0.01082786 ryd = -1188.2199 cm-1 -0.443 2 -0.01082788 ryd = -1188.2223 cm-1 -0.443 ag i d10 5s -d9 5s9s 1 -1.1882 5 1 10 1 0.195 0.055 96.984 sec sqrtdel= 1.0000 1.0000 -1.1882 rcn mod 32 ee,eee= -0.20180 -0.69447 slater integrals for ag i d10 5s nconf= 1 z= 47 ion= 0 exf=0.650 irel= 1 ag i d8 5s2 6s nconf=11 kut=-1 corrf=0.000 class 0 k rdk( 4d, 4d, 5s, 6s) frac k rek( 4d, 4d, 5s, 6s) frac - ------------------------------------- ----- - ------------------------------------- ----- 2 0.03910560 ryd = 4291.3436 cm-1 0.715 2 0.03910559 ryd = 4291.3425 cm-1 0.715 ag i d10 5s -d8 5s2 6s 1 4.2913 5 1 11 1 0.156 0.039 97.180 sec sqrtdel= 1.0000 1.0000 4.2913 rcn mod 32 ee,eee= -0.12010 -0.65362 slater integrals for ag i d10 5s nconf= 1 z= 47 ion= 0 exf=0.650 irel= 1 ag i d9 5s5d nconf=17 kut=-1 corrf=0.000 class 1 k rdk( 4d, 4d, 4d, 5d) frac k rek( 4d, 4d, 4d, 5d) frac - ------------------------------------- ----- - ------------------------------------- ----- 0 0.03621356 ryd = 3973.9786 cm-1 0.341 0 0.03621356 ryd = 3973.9782 cm-1 0.341 2 0.02779370 ryd = 3050.0060 cm-1 0.646 2 0.02779368 ryd = 3050.0042 cm-1 0.646 4 0.02006684 ryd = 2202.0816 cm-1 0.758 4 0.02006681 ryd = 2202.0782 cm-1 0.758 - ------------------------------------- ----- - ------------------------------------- ----- 0 0.03521292 ryd = 3864.1709 cm-1 0.334 0 0.03521291 ryd = 3864.1705 cm-1 0.334 2 0.02664842 ryd = 2924.3258 cm-1 0.626 2 0.02664840 ryd = 2924.3238 cm-1 0.626 4 0.01919283 ryd = 2106.1698 cm-1 0.734 4 0.01919280 ryd = 2106.1663 cm-1 0.734 - ------------------------------------- ----- - ------------------------------------- ----- 0 0.03724992 ryd = 4087.7065 cm-1 0.346 0 0.04771103 ryd = 5235.6805 cm-1 0.480 2 0.02891678 ryd = 3173.2499 cm-1 0.663 2 0.03034490 ryd = 3329.9682 cm-1 0.711 4 0.02091945 ryd = 2295.6440 cm-1 0.778 4 0.02128695 ryd = 2335.9721 cm-1 0.797 - ------------------------------------- ----- - ------------------------------------- ----- 0 0.03623142 ryd = 3975.9387 cm-1 0.346 0 0.04146197 ryd = 4549.9255 cm-1 0.480 2 0.02778260 ryd = 3048.7878 cm-1 0.663 2 0.02849665 ryd = 3127.1460 cm-1 0.711 4 0.02005614 ryd = 2200.9069 cm-1 0.778 4 0.02023987 ryd = 2221.0692 cm-1 0.797 9.00000 0.21470 2.00000 0.00000 2.00000 0.02147 -0.65362 0.00000 9.00000 0.26979 2.00000 2.00000 2.00000 0.02918 -0.65362 0.00000 9.00000 0.19176 2.00000 4.00000 2.00000 0.03466 -0.65362 0.00000 ag i d10 5s -d9 5s5d 3 0.4226 5 3.0500 5 2.2021 5 1 17 6 1.289 0.203 98.695 sec rcn mod 32 ee,eee= -1.18713 -0.59357 ee,eee= -0.12010 -0.65362 slater integrals for ag i d10 5s nconf= 1 z= 47 ion= 0 exf=0.650 irel= 1 ag i d9 5s5d nconf=17 kut=-1 corrf=0.000 class 7 k rdk( 5s, 4d, 5s, 5d) frac k rek( 5s, 4d, 5s, 5d) frac - ------------------------------------- ----- - ------------------------------------- ----- 0 0.00507709 ryd = 557.1460 cm-1 0.074 2 -0.02541358 ryd = -2788.8174 cm-1 -0.803 - ------------------------------------- ----- - ------------------------------------- ----- 0 0.00355800 ryd = 390.4456 cm-1 0.054 2 -0.02423210 ryd = -2659.1654 cm-1 -0.822 - ------------------------------------- ----- - ------------------------------------- ----- 0 0.00671093 ryd = 736.4393 cm-1 0.093 2 -0.02179400 ryd = -2391.6147 cm-1 -0.748 - ------------------------------------- ----- - ------------------------------------- ----- 0 0.00513447 ryd = 563.4424 cm-1 0.093 2 -0.02301305 ryd = -2525.3901 cm-1 -0.748 1.00000 -0.02301 0.00000 2.00000 2.00000 -0.00230 -0.65362 0.00000 ag i d10 5s -d9 5s5d 2 -2.7888 5 -0.2525 5 1 17 17 0.719 0.188 99.602 sec sqrtdel= 1.0000 1.0000 0.4226 3.0500 2.2021 -2.7888 -0.2525 rcn mod 32 ee,eee= -1.18713 -0.59357 ee,eee= -0.06554 -0.62634 slater integrals for ag i d10 5s nconf= 1 z= 47 ion= 0 exf=0.650 irel= 1 ag i d9 5s6d nconf=18 kut=-1 corrf=0.000 class 1 k rdk( 4d, 4d, 4d, 6d) frac k rek( 4d, 4d, 4d, 6d) frac - ------------------------------------- ----- - ------------------------------------- ----- 0 0.02689963 ryd = 2951.8931 cm-1 0.340 0 0.02689963 ryd = 2951.8928 cm-1 0.340 2 0.02045454 ryd = 2244.6265 cm-1 0.636 2 0.02045453 ryd = 2244.6250 cm-1 0.636 4 0.01478875 ryd = 1622.8777 cm-1 0.747 4 0.01478873 ryd = 1622.8750 cm-1 0.747 - ------------------------------------- ----- - ------------------------------------- ----- 0 0.02615484 ryd = 2870.1623 cm-1 0.334 0 0.02615484 ryd = 2870.1620 cm-1 0.334 2 0.01959607 ryd = 2150.4196 cm-1 0.616 2 0.01959605 ryd = 2150.4181 cm-1 0.616 4 0.01413131 ryd = 1550.7319 cm-1 0.723 4 0.01413128 ryd = 1550.7292 cm-1 0.723 - ------------------------------------- ----- - ------------------------------------- ----- 0 0.02767145 ryd = 3036.5909 cm-1 0.346 0 0.03516304 ryd = 3858.6977 cm-1 0.474 2 0.02129599 ryd = 2336.9644 cm-1 0.654 2 0.02235623 ryd = 2453.3129 cm-1 0.700 4 0.01542982 ryd = 1693.2266 cm-1 0.768 4 0.01570687 ryd = 1723.6301 cm-1 0.787 - ------------------------------------- ----- - ------------------------------------- ----- 0 0.02691315 ryd = 2953.3766 cm-1 0.346 0 0.03065894 ryd = 3364.4299 cm-1 0.474 2 0.02044603 ryd = 2243.6920 cm-1 0.654 2 0.02097614 ryd = 2301.8655 cm-1 0.700 4 0.01478056 ryd = 1621.9792 cm-1 0.768 4 0.01491908 ryd = 1637.1796 cm-1 0.787 9.00000 0.15823 2.00000 0.00000 2.00000 0.01582 -0.62634 0.00000 9.00000 0.19858 2.00000 2.00000 2.00000 0.02150 -0.62634 0.00000 9.00000 0.14134 2.00000 4.00000 2.00000 0.02554 -0.62634 0.00000 ag i d10 5s -d9 5s6d 3 0.3114 5 2.2446 5 1.6229 5 1 18 18 1.203 0.148 100.953 sec rcn mod 32 ee,eee= -1.18713 -0.59357 ee,eee= -0.06554 -0.62634 slater integrals for ag i d10 5s nconf= 1 z= 47 ion= 0 exf=0.650 irel= 1 ag i d9 5s6d nconf=18 kut=-1 corrf=0.000 class 7 k rdk( 5s, 4d, 5s, 6d) frac k rek( 5s, 4d, 5s, 6d) frac - ------------------------------------- ----- - ------------------------------------- ----- 0 0.00384803 ryd = 422.2723 cm-1 0.076 2 -0.01857706 ryd = -2038.5967 cm-1 -0.802 - ------------------------------------- ----- - ------------------------------------- ----- 0 0.00272255 ryd = 298.7651 cm-1 0.055 2 -0.01763749 ryd = -1935.4909 cm-1 -0.822 - ------------------------------------- ----- - ------------------------------------- ----- 0 0.00506670 ryd = 556.0063 cm-1 0.094 2 -0.01621419 ryd = -1779.3021 cm-1 -0.749 - ------------------------------------- ----- - ------------------------------------- ----- 0 0.00389463 ryd = 427.3857 cm-1 0.094 2 -0.01692584 ryd = -1857.3965 cm-1 -0.749 1.00000 -0.01693 0.00000 2.00000 2.00000 -0.00169 -0.62634 0.00000 ag i d10 5s -d9 5s6d 2 -2.0386 5 -0.1857 5 1 18 18 0.500 0.078 101.531 sec sqrtdel= 1.0000 1.0000 0.3114 2.2446 1.6229 -2.0386 -0.1857 rcn mod 32 ee,eee= -1.18713 -0.59357 ee,eee= -0.04139 -0.61426 slater integrals for ag i d10 5s nconf= 1 z= 47 ion= 0 exf=0.650 irel= 1 ag i d9 5s7d nconf=19 kut=-1 corrf=0.000 class 1 k rdk( 4d, 4d, 4d, 7d) frac k rek( 4d, 4d, 4d, 7d) frac - ------------------------------------- ----- - ------------------------------------- ----- 0 0.02009598 ryd = 2205.2786 cm-1 0.338 0 0.02009598 ryd = 2205.2784 cm-1 0.338 2 0.01525168 ryd = 1673.6786 cm-1 0.630 2 0.01525167 ryd = 1673.6775 cm-1 0.630 4 0.01104020 ryd = 1211.5222 cm-1 0.741 4 0.01104019 ryd = 1211.5202 cm-1 0.741 - ------------------------------------- ----- - ------------------------------------- ----- 0 0.01953630 ryd = 2143.8614 cm-1 0.332 0 0.01953630 ryd = 2143.8611 cm-1 0.332 2 0.01460351 ryd = 1602.5499 cm-1 0.609 2 0.01460350 ryd = 1602.5487 cm-1 0.609 4 0.01054291 ryd = 1156.9501 cm-1 0.716 4 0.01054289 ryd = 1156.9480 cm-1 0.717 - ------------------------------------- ----- - ------------------------------------- ----- 0 0.02067579 ryd = 2268.9056 cm-1 0.344 0 0.02621440 ryd = 2876.6979 cm-1 0.469 2 0.01588671 ryd = 1743.3647 cm-1 0.647 2 0.01668460 ryd = 1830.9229 cm-1 0.694 4 0.01152494 ryd = 1264.7154 cm-1 0.762 4 0.01173504 ryd = 1287.7716 cm-1 0.781 - ------------------------------------- ----- - ------------------------------------- ----- 0 0.02010605 ryd = 2206.3835 cm-1 0.344 0 0.02287535 ryd = 2510.2795 cm-1 0.469 2 0.01524511 ryd = 1672.9573 cm-1 0.647 2 0.01564405 ryd = 1716.7358 cm-1 0.694 4 0.01103392 ryd = 1210.8327 cm-1 0.762 4 0.01113896 ryd = 1222.3598 cm-1 0.781 9.00000 0.11796 2.00000 0.00000 2.00000 0.01180 -0.61426 0.00000 9.00000 0.14810 2.00000 2.00000 2.00000 0.01603 -0.61426 0.00000 9.00000 0.10552 2.00000 4.00000 2.00000 0.01904 -0.61426 0.00000 ag i d10 5s -d9 5s7d 3 0.2322 5 1.6737 5 1.2115 5 1 19 19 0.609 0.172 102.313 sec rcn mod 32 ee,eee= -1.18713 -0.59357 ee,eee= -0.04139 -0.61426 slater integrals for ag i d10 5s nconf= 1 z= 47 ion= 0 exf=0.650 irel= 1 ag i d9 5s7d nconf=19 kut=-1 corrf=0.000 class 7 k rdk( 5s, 4d, 5s, 7d) frac k rek( 5s, 4d, 5s, 7d) frac - ------------------------------------- ----- - ------------------------------------- ----- 0 0.00283552 ryd = 311.1627 cm-1 0.075 2 -0.01389141 ryd = -1524.4062 cm-1 -0.803 - ------------------------------------- ----- - ------------------------------------- ----- 0 0.00199478 ryd = 218.9023 cm-1 0.054 2 -0.01315970 ryd = -1444.1097 cm-1 -0.822 - ------------------------------------- ----- - ------------------------------------- ----- 0 0.00374676 ryd = 411.1592 cm-1 0.093 2 -0.01223869 ryd = -1343.0406 cm-1 -0.751 - ------------------------------------- ----- - ------------------------------------- ----- 0 0.00287077 ryd = 315.0307 cm-1 0.093 2 -0.01269919 ryd = -1393.5751 cm-1 -0.751 1.00000 -0.01270 0.00000 2.00000 2.00000 -0.00127 -0.61426 0.00000 ag i d10 5s -d9 5s7d 2 -1.5244 5 -0.1394 5 1 19 19 0.961 0.070 103.344 sec sqrtdel= 1.0000 1.0000 0.2322 1.6737 1.2115 -1.5244 -0.1394 rcn mod 32 ee,eee= -1.18713 -0.59357 ee,eee= -0.02853 -0.60783 slater integrals for ag i d10 5s nconf= 1 z= 47 ion= 0 exf=0.650 irel= 1 ag i d9 5s8d nconf=20 kut=-1 corrf=0.000 class 1 k rdk( 4d, 4d, 4d, 8d) frac k rek( 4d, 4d, 4d, 8d) frac - ------------------------------------- ----- - ------------------------------------- ----- 0 0.01561931 ryd = 1714.0208 cm-1 0.337 0 0.01561931 ryd = 1714.0207 cm-1 0.337 2 0.01183708 ryd = 1298.9693 cm-1 0.626 2 0.01183707 ryd = 1298.9685 cm-1 0.626 4 0.00857383 ryd = 940.8695 cm-1 0.737 4 0.00857382 ryd = 940.8680 cm-1 0.737 - ------------------------------------- ----- - ------------------------------------- ----- 0 0.01518307 ryd = 1666.1494 cm-1 0.331 0 0.01518307 ryd = 1666.1492 cm-1 0.331 2 0.01133058 ryd = 1243.3870 cm-1 0.606 2 0.01133057 ryd = 1243.3861 cm-1 0.606 4 0.00818482 ryd = 898.1804 cm-1 0.713 4 0.00818481 ryd = 898.1788 cm-1 0.713 - ------------------------------------- ----- - ------------------------------------- ----- 0 0.01607119 ryd = 1763.6093 cm-1 0.343 0 0.02034570 ryd = 2232.6821 cm-1 0.466 2 0.01233320 ryd = 1353.4125 cm-1 0.644 2 0.01295531 ryd = 1421.6807 cm-1 0.690 4 0.00895295 ryd = 982.4725 cm-1 0.758 4 0.00911749 ryd = 1000.5287 cm-1 0.778 - ------------------------------------- ----- - ------------------------------------- ----- 0 0.01562713 ryd = 1714.8793 cm-1 0.343 0 0.01776438 ryd = 1949.4157 cm-1 0.466 2 0.01183189 ryd = 1298.3998 cm-1 0.644 2 0.01214294 ryd = 1332.5334 cm-1 0.690 4 0.00856889 ryd = 940.3265 cm-1 0.758 4 0.00865115 ryd = 949.3538 cm-1 0.778 9.00000 0.09156 2.00000 0.00000 2.00000 0.00916 -0.60783 0.00000 9.00000 0.11495 2.00000 2.00000 2.00000 0.01244 -0.60783 0.00000 9.00000 0.08195 2.00000 4.00000 2.00000 0.01478 -0.60783 0.00000 ag i d10 5s -d9 5s8d 3 0.1802 5 1.2990 5 0.9409 5 1 20 20 0.852 0.109 104.305 sec rcn mod 32 ee,eee= -1.18713 -0.59357 ee,eee= -0.02853 -0.60783 slater integrals for ag i d10 5s nconf= 1 z= 47 ion= 0 exf=0.650 irel= 1 ag i d9 5s8d nconf=20 kut=-1 corrf=0.000 class 7 k rdk( 5s, 4d, 5s, 8d) frac k rek( 5s, 4d, 5s, 8d) frac - ------------------------------------- ----- - ------------------------------------- ----- 0 0.00219126 ryd = 240.4633 cm-1 0.074 2 -0.01079201 ryd = -1184.2858 cm-1 -0.803 - ------------------------------------- ----- - ------------------------------------- ----- 0 0.00153891 ryd = 168.8760 cm-1 0.054 2 -0.01021101 ryd = -1120.5293 cm-1 -0.822 - ------------------------------------- ----- - ------------------------------------- ----- 0 0.00289901 ryd = 318.1292 cm-1 0.092 2 -0.00956068 ryd = -1049.1635 cm-1 -0.753 - ------------------------------------- ----- - ------------------------------------- ----- 0 0.00221896 ryd = 243.5026 cm-1 0.092 2 -0.00988585 ryd = -1084.8464 cm-1 -0.753 1.00000 -0.00989 0.00000 2.00000 2.00000 -0.00099 -0.60783 0.00000 ag i d10 5s -d9 5s8d 2 -1.1843 5 -0.1085 5 1 20 20 0.789 0.141 105.234 sec sqrtdel= 1.0000 1.0000 0.1802 1.2990 0.9409 -1.1843 -0.1085 rcn mod 32 ee,eee= -1.18713 -0.59357 ee,eee= -0.02086 -0.60400 slater integrals for ag i d10 5s nconf= 1 z= 47 ion= 0 exf=0.650 irel= 1 ag i d9 5s9d nconf=21 kut=-1 corrf=0.000 class 1 k rdk( 4d, 4d, 4d, 9d) frac k rek( 4d, 4d, 4d, 9d) frac - ------------------------------------- ----- - ------------------------------------- ----- 0 0.01255042 ryd = 1377.2498 cm-1 0.337 0 0.01255042 ryd = 1377.2496 cm-1 0.337 2 0.00950081 ryd = 1042.5937 cm-1 0.624 2 0.00950081 ryd = 1042.5930 cm-1 0.624 4 0.00688414 ryd = 755.4465 cm-1 0.735 4 0.00688412 ryd = 755.4453 cm-1 0.735 - ------------------------------------- ----- - ------------------------------------- ----- 0 0.01219938 ryd = 1338.7271 cm-1 0.330 0 0.01219938 ryd = 1338.7269 cm-1 0.330 2 0.00909260 ryd = 997.7974 cm-1 0.603 2 0.00909259 ryd = 997.7967 cm-1 0.604 4 0.00657041 ryd = 721.0188 cm-1 0.710 4 0.00657039 ryd = 721.0174 cm-1 0.710 - ------------------------------------- ----- - ------------------------------------- ----- 0 0.01291405 ryd = 1417.1531 cm-1 0.342 0 0.01633112 ryd = 1792.1336 cm-1 0.465 2 0.00990061 ryd = 1086.4668 cm-1 0.642 2 0.01040119 ryd = 1141.3990 cm-1 0.688 4 0.00718985 ryd = 788.9952 cm-1 0.756 4 0.00732263 ryd = 803.5654 cm-1 0.776 - ------------------------------------- ----- - ------------------------------------- ----- 0 0.01255671 ryd = 1377.9401 cm-1 0.342 0 0.01426525 ryd = 1565.4303 cm-1 0.465 2 0.00949661 ryd = 1042.1321 cm-1 0.642 2 0.00974689 ryd = 1069.5978 cm-1 0.688 4 0.00688013 ryd = 755.0070 cm-1 0.756 4 0.00694651 ryd = 762.2914 cm-1 0.776 9.00000 0.07349 2.00000 0.00000 2.00000 0.00735 -0.60400 0.00000 9.00000 0.09227 2.00000 2.00000 2.00000 0.00999 -0.60400 0.00000 9.00000 0.06580 2.00000 4.00000 2.00000 0.01187 -0.60400 0.00000 ag i d10 5s -d9 5s9d 3 0.1447 5 1.0426 5 0.7554 5 1 21 21 0.719 0.102 106.063 sec rcn mod 32 ee,eee= -1.18713 -0.59357 ee,eee= -0.02086 -0.60400 slater integrals for ag i d10 5s nconf= 1 z= 47 ion= 0 exf=0.650 irel= 1 ag i d9 5s9d nconf=21 kut=-1 corrf=0.000 class 7 k rdk( 5s, 4d, 5s, 9d) frac k rek( 5s, 4d, 5s, 9d) frac - ------------------------------------- ----- - ------------------------------------- ----- 0 0.00175663 ryd = 192.7677 cm-1 0.074 2 -0.00866411 ryd = -950.7767 cm-1 -0.803 - ------------------------------------- ----- - ------------------------------------- ----- 0 0.00123342 ryd = 135.3523 cm-1 0.053 2 -0.00819144 ryd = -898.9071 cm-1 -0.821 - ------------------------------------- ----- - ------------------------------------- ----- 0 0.00232474 ryd = 255.1108 cm-1 0.092 2 -0.00770308 ryd = -845.3149 cm-1 -0.753 - ------------------------------------- ----- - ------------------------------------- ----- 0 0.00177908 ryd = 195.2316 cm-1 0.092 2 -0.00794726 ryd = -872.1110 cm-1 -0.753 1.00000 -0.00795 0.00000 2.00000 2.00000 -0.00079 -0.60400 0.00000 ag i d10 5s -d9 5s9d 2 -0.9508 5 -0.0872 5 1 21 21 0.703 0.070 106.836 sec sqrtdel= 1.0000 1.0000 0.1447 1.0426 0.7554 -0.9508 -0.0872 rcn mod 32 ee,eee= -1.18713 -0.59357 ee,eee= -0.12522 -0.65618 slater integrals for ag i d10 5s nconf= 1 z= 47 ion= 0 exf=0.650 irel= 1 ag i d8 5s2 5d nconf=22 kut=-1 corrf=0.000 class 0 k rdk( 4d, 4d, 5s, 5d) frac k rek( 4d, 4d, 5s, 5d) frac - ------------------------------------- ----- - ------------------------------------- ----- 2 0.00105315 ryd = 115.5696 cm-1 0.039 2 0.00105318 ryd = 115.5730 cm-1 0.039 ag i d10 5s -d8 5s2 5d 1 0.1156 5 1 22 22 1.617 0.031 108.492 sec sqrtdel= 1.0000 1.0000 0.1156 rcn mod 32 ee,eee= -0.04004 -0.61359 slater integrals for ag i d10 5s nconf= 1 z= 47 ion= 0 exf=0.650 irel= 1 ag i d9 5s5g nconf=28 kut=-1 corrf=0.000 class 0 k rdk( 4d, 4d, 4d, 5g) frac k rek( 4d, 4d, 4d, 5g) frac - ------------------------------------- ----- - ------------------------------------- ----- 2 -0.00006664 ryd = -7.3132 cm-1 -1.000 2 -0.00006664 ryd = -7.3133 cm-1 -1.000 4 -0.00002822 ryd = -3.0962 cm-1 -1.000 4 -0.00002822 ryd = -3.0962 cm-1 -1.000 ag i d10 5s -d9 5s5g 2 -0.0073 5 -0.0031 5 1 28 6 0.969 0.047 109.531 sec sqrtdel= 1.0000 1.0000 -0.0073 -0.0031 rcn mod 32 ee,eee= -0.02782 -0.60748 slater integrals for ag i d10 5s nconf= 1 z= 47 ion= 0 exf=0.650 irel= 1 ag i d9 5s6g nconf=29 kut=-1 corrf=0.000 class 0 k rdk( 4d, 4d, 4d, 6g) frac k rek( 4d, 4d, 4d, 6g) frac - ------------------------------------- ----- - ------------------------------------- ----- 2 -0.00007197 ryd = -7.8974 cm-1 -1.000 2 -0.00007197 ryd = -7.8974 cm-1 -1.000 4 -0.00003071 ryd = -3.3704 cm-1 -1.000 4 -0.00003071 ryd = -3.3704 cm-1 -1.000 ag i d10 5s -d9 5s6g 2 -0.0079 5 -0.0034 5 1 29 1 0.344 0.039 109.930 sec sqrtdel= 1.0000 1.0000 -0.0079 -0.0034 rcn mod 32 ee,eee= -0.02044 -0.60379 slater integrals for ag i d10 5s nconf= 1 z= 47 ion= 0 exf=0.650 irel= 1 ag i d9 5s7g nconf=30 kut=-1 corrf=0.000 class 0 k rdk( 4d, 4d, 4d, 7g) frac k rek( 4d, 4d, 4d, 7g) frac - ------------------------------------- ----- - ------------------------------------- ----- 2 -0.00006772 ryd = -7.4318 cm-1 -1.000 2 -0.00006772 ryd = -7.4318 cm-1 -1.000 4 -0.00002902 ryd = -3.1850 cm-1 -1.000 4 -0.00002902 ryd = -3.1850 cm-1 -1.000 ag i d10 5s -d9 5s7g 2 -0.0074 5 -0.0032 5 1 30 1 0.148 0.086 110.180 sec sqrtdel= 1.0000 1.0000 -0.0074 -0.0032 rcn mod 32 ee,eee= -0.01565 -0.60139 slater integrals for ag i d10 5s nconf= 1 z= 47 ion= 0 exf=0.650 irel= 1 ag i d9 5s8g nconf=31 kut=-1 corrf=0.000 class 0 k rdk( 4d, 4d, 4d, 8g) frac k rek( 4d, 4d, 4d, 8g) frac - ------------------------------------- ----- - ------------------------------------- ----- 2 -0.00006131 ryd = -6.7284 cm-1 -1.000 2 -0.00006131 ryd = -6.7284 cm-1 -1.000 4 -0.00002635 ryd = -2.8912 cm-1 -1.000 4 -0.00002635 ryd = -2.8912 cm-1 -1.000 ag i d10 5s -d9 5s8g 2 -0.0067 5 -0.0029 5 1 31 1 0.188 0.031 110.414 sec sqrtdel= 1.0000 1.0000 -0.0067 -0.0029 rcn mod 32 ee,eee= -0.01236 -0.59975 slater integrals for ag i d10 5s nconf= 1 z= 47 ion= 0 exf=0.650 irel= 1 ag i d9 5s9g nconf=32 kut=-1 corrf=0.000 class 0 k rdk( 4d, 4d, 4d, 9g) frac k rek( 4d, 4d, 4d, 9g) frac - ------------------------------------- ----- - ------------------------------------- ----- 2 -0.00005490 ryd = -6.0243 cm-1 -1.000 2 -0.00005490 ryd = -6.0243 cm-1 -1.000 4 -0.00002363 ryd = -2.5933 cm-1 -1.000 4 -0.00002363 ryd = -2.5933 cm-1 -1.000 ag i d10 5s -d9 5s9g 2 -0.0060 5 -0.0026 5 1 32 1 0.156 0.031 110.602 sec sqrtdel= 1.0000 1.0000 -0.0060 -0.0026 rcn mod 32 ee,eee= -0.02041 -0.60377 slater integrals for ag i d10 5s nconf= 1 z= 47 ion= 0 exf=0.650 irel= 1 ag i d9 5s7i nconf=36 kut=-1 corrf=0.000 class 0 k rdk( 4d, 4d, 4d, 7i) frac k rek( 4d, 4d, 4d, 7i) frac - ------------------------------------- ----- - ------------------------------------- ----- 4 -0.00000002 ryd = -0.0023 cm-1 -1.000 4 -0.00000002 ryd = -0.0023 cm-1 -1.000 ag i d10 5s -d9 5s7i 1 0.0000 5 1 36 4 0.742 0.039 111.406 sec sqrtdel= 1.0000 1.0000 0.0000 rcn mod 32 ee,eee= -0.01563 -0.60138 slater integrals for ag i d10 5s nconf= 1 z= 47 ion= 0 exf=0.650 irel= 1 ag i d9 5s8i nconf=37 kut=-1 corrf=0.000 class 0 k rdk( 4d, 4d, 4d, 8i) frac k rek( 4d, 4d, 4d, 8i) frac - ------------------------------------- ----- - ------------------------------------- ----- 4 -0.00000003 ryd = -0.0030 cm-1 -1.000 4 -0.00000003 ryd = -0.0030 cm-1 -1.000 ag i d10 5s -d9 5s8i 1 0.0000 5 1 37 1 0.141 0.039 111.586 sec sqrtdel= 1.0000 1.0000 0.0000 rcn mod 32 ee,eee= -0.01234 -0.59974 slater integrals for ag i d10 5s nconf= 1 z= 47 ion= 0 exf=0.650 irel= 1 ag i d9 5s9i nconf=38 kut=-1 corrf=0.000 class 0 k rdk( 4d, 4d, 4d, 9i) frac k rek( 4d, 4d, 4d, 9i) frac - ------------------------------------- ----- - ------------------------------------- ----- 4 -0.00000003 ryd = -0.0033 cm-1 -1.000 4 -0.00000003 ryd = -0.0033 cm-1 -1.000 ag i d10 5s -d9 5s9i 1 0.0000 5 1 38 1 0.148 0.031 111.766 sec sqrtdel= 1.0000 1.0000 0.0000 rcn mod 32 ee,eee= -0.55417 -0.27709 ee,eee= -0.38785 -0.47101 slater integrals for ag i d10 5s nconf= 1 z= 47 ion= 0 exf=0.650 irel= 1 ag i d9 5p2 nconf=41 kut=-1 corrf=0.000 class 0 k rdk( 4d, 5s, 5p, 5p) frac k rek( 4d, 5s, 5p, 5p) frac - ------------------------------------- ----- - ------------------------------------- ----- 1 -0.12055170 ryd = -13229.0195 cm-1 -0.764 1 -0.12055170 ryd = -13229.0195 cm-1 -0.764 ag i d10 5s -d9 5p2 1 -13.2290 5 1 41 41 1.828 0.023 113.625 sec sqrtdel= 1.0000 1.0000 -13.2290 rcn mod 32 ee,eee= -1.55511 -0.77755 ee,eee= -0.96169 -1.25840 slater integrals for ag i d10 6s nconf= 2 z= 47 ion= 0 exf=0.650 irel= 1 ag i d9 5s6s nconf= 7 kut=-1 corrf=0.000 class 0 k rdk( 4d, 4d, 4d, 5s) frac k rek( 4d, 4d, 4d, 5s) frac - ------------------------------------- ----- - ------------------------------------- ----- 2 -0.13700704 ryd = -15034.7839 cm-1 -0.476 2 -0.13700730 ryd = -15034.8127 cm-1 -0.477 ag i d10 6s -d9 5s6s 1 -15.0348 5 2 7 7 0.234 0.031 113.906 sec sqrtdel= 1.0000 1.0000 -15.0348 rcn mod 32 ee,eee= -1.07331 -1.31421 slater integrals for ag i d10 6s nconf= 2 z= 47 ion= 0 exf=0.650 irel= 1 ag i d9 5s7s nconf= 8 kut=-1 corrf=0.000 class 0 k rdk( 4d, 4d, 4d, 5s) frac k rek( 4d, 4d, 4d, 5s) frac - ------------------------------------- ----- - ------------------------------------- ----- 2 0.00000000 ryd = 0.0000 cm-1 0.000 2 0.00000000 ryd = 0.0000 cm-1 0.000 ag i d10 6s -d9 5s7s 1 0.0000 5 2 8 1 0.031 0.078 114.023 sec sqrtdel= 1.0000 1.0000 0.0000 rcn mod 32 ee,eee= -1.12425 -1.33968 slater integrals for ag i d10 6s nconf= 2 z= 47 ion= 0 exf=0.650 irel= 1 ag i d9 5s8s nconf= 9 kut=-1 corrf=0.000 class 0 k rdk( 4d, 4d, 4d, 5s) frac k rek( 4d, 4d, 4d, 5s) frac - ------------------------------------- ----- - ------------------------------------- ----- 2 0.00000000 ryd = 0.0000 cm-1 0.000 2 0.00000000 ryd = 0.0000 cm-1 0.000 ag i d10 6s -d9 5s8s 1 0.0000 5 2 9 1 0.031 0.008 114.070 sec sqrtdel= 1.0000 1.0000 0.0000 rcn mod 32 ee,eee= -1.15148 -1.35329 slater integrals for ag i d10 6s nconf= 2 z= 47 ion= 0 exf=0.650 irel= 1 ag i d9 5s9s nconf=10 kut=-1 corrf=0.000 class 0 k rdk( 4d, 4d, 4d, 5s) frac k rek( 4d, 4d, 4d, 5s) frac - ------------------------------------- ----- - ------------------------------------- ----- 2 0.00000000 ryd = 0.0000 cm-1 0.000 2 0.00000000 ryd = 0.0000 cm-1 0.000 ag i d10 6s -d9 5s9s 1 0.0000 5 2 10 1 0.031 0.125 114.242 sec sqrtdel= 1.0000 1.0000 0.0000 rcn mod 32 ee,eee= -1.02769 -1.29140 slater integrals for ag i d10 6s nconf= 2 z= 47 ion= 0 exf=0.650 irel= 1 ag i d8 5s2 6s nconf=11 kut=-1 corrf=0.000 class 0 k rdk( 4d, 4d, 5s, 5s) frac k rek( 4d, 4d, 5s, 5s) frac - ------------------------------------- ----- - ------------------------------------- ----- 2 0.15420623 ryd = 16922.1764 cm-1 0.782 2 0.15420623 ryd = 16922.1764 cm-1 0.782 ag i d10 6s -d8 5s2 6s 1 16.9222 5 2 11 1 0.039 0.023 114.305 sec sqrtdel= 1.0000 1.0000 16.9222 rcn mod 32 ee,eee= -0.16693 -0.08346 ee,eee= -0.12010 -0.14352 slater integrals for ag i d10 6s nconf= 2 z= 47 ion= 0 exf=0.650 irel= 1 ag i d9 5s5d nconf=17 kut=-1 corrf=0.000 class 0 k rdk( 4d, 6s, 5s, 5d) frac k rek( 4d, 6s, 5s, 5d) frac - ------------------------------------- ----- - ------------------------------------- ----- 2 0.00802936 ryd = 881.1200 cm-1 0.499 0 0.00318708 ryd = 349.7410 cm-1 0.164 ag i d10 6s -d9 5s5d 2 0.8811 5 0.3497 5 2 17 17 0.953 0.023 115.320 sec sqrtdel= 1.0000 1.0000 0.8811 0.3497 rcn mod 32 ee,eee= -0.06554 -0.11624 slater integrals for ag i d10 6s nconf= 2 z= 47 ion= 0 exf=0.650 irel= 1 ag i d9 5s6d nconf=18 kut=-1 corrf=0.000 class 0 k rdk( 4d, 6s, 5s, 6d) frac k rek( 4d, 6s, 5s, 6d) frac - ------------------------------------- ----- - ------------------------------------- ----- 2 0.00287827 ryd = 315.8534 cm-1 0.301 0 0.00231638 ryd = 254.1931 cm-1 0.161 ag i d10 6s -d9 5s6d 2 0.3159 5 0.2542 5 2 18 1 0.031 0.031 115.383 sec sqrtdel= 1.0000 1.0000 0.3159 0.2542 rcn mod 32 ee,eee= -0.04139 -0.10416 slater integrals for ag i d10 6s nconf= 2 z= 47 ion= 0 exf=0.650 irel= 1 ag i d9 5s7d nconf=19 kut=-1 corrf=0.000 class 0 k rdk( 4d, 6s, 5s, 7d) frac k rek( 4d, 6s, 5s, 7d) frac - ------------------------------------- ----- - ------------------------------------- ----- 2 0.00136178 ryd = 149.4379 cm-1 0.204 0 0.00170644 ryd = 187.2604 cm-1 0.158 ag i d10 6s -d9 5s7d 2 0.1494 5 0.1873 5 2 19 1 0.055 0.031 115.477 sec sqrtdel= 1.0000 1.0000 0.1494 0.1873 rcn mod 32 ee,eee= -0.02853 -0.09773 slater integrals for ag i d10 6s nconf= 2 z= 47 ion= 0 exf=0.650 irel= 1 ag i d9 5s8d nconf=20 kut=-1 corrf=0.000 class 0 k rdk( 4d, 6s, 5s, 8d) frac k rek( 4d, 6s, 5s, 8d) frac - ------------------------------------- ----- - ------------------------------------- ----- 2 0.00075118 ryd = 82.4321 cm-1 0.150 0 0.00131594 ryd = 144.4080 cm-1 0.156 ag i d10 6s -d9 5s8d 2 0.0824 5 0.1444 5 2 20 1 0.031 0.031 115.586 sec sqrtdel= 1.0000 1.0000 0.0824 0.1444 rcn mod 32 ee,eee= -0.02086 -0.09389 slater integrals for ag i d10 6s nconf= 2 z= 47 ion= 0 exf=0.650 irel= 1 ag i d9 5s9d nconf=21 kut=-1 corrf=0.000 class 0 k rdk( 4d, 6s, 5s, 9d) frac k rek( 4d, 6s, 5s, 9d) frac - ------------------------------------- ----- - ------------------------------------- ----- 2 0.00045694 ryd = 50.1428 cm-1 0.116 0 0.00105226 ryd = 115.4725 cm-1 0.155 ag i d10 6s -d9 5s9d 2 0.0501 5 0.1155 5 2 21 1 0.039 0.047 115.672 sec sqrtdel= 1.0000 1.0000 0.0501 0.1155 rcn mod 32 ee,eee= -0.38785 -0.27739 slater integrals for ag i d10 6s nconf= 2 z= 47 ion= 0 exf=0.650 irel= 1 ag i d9 5p2 nconf=41 kut=-1 corrf=0.000 class 0 k rdk( 4d, 6s, 5p, 5p) frac k rek( 4d, 6s, 5p, 5p) frac - ------------------------------------- ----- - ------------------------------------- ----- 1 -0.00683149 ryd = -749.6694 cm-1 -0.136 1 -0.00683149 ryd = -749.6694 cm-1 -0.136 ag i d10 6s -d9 5p2 1 -0.7497 5 2 41 20 0.711 0.031 116.625 sec sqrtdel= 1.0000 1.0000 -0.7497 rcn mod 32 ee,eee= -1.67090 -0.83545 ee,eee= -0.96169 -1.31629 slater integrals for ag i d10 7s nconf= 3 z= 47 ion= 0 exf=0.650 irel= 1 ag i d9 5s6s nconf= 7 kut=-1 corrf=0.000 class 0 k rdk( 4d, 4d, 4d, 5s) frac k rek( 4d, 4d, 4d, 5s) frac - ------------------------------------- ----- - ------------------------------------- ----- 2 0.00000000 ryd = 0.0000 cm-1 0.000 2 0.00000000 ryd = 0.0000 cm-1 0.000 ag i d10 7s -d9 5s6s 1 0.0000 5 3 7 7 0.461 0.016 117.117 sec sqrtdel= 1.0000 1.0000 0.0000 rcn mod 32 ee,eee= -1.07331 -1.37211 slater integrals for ag i d10 7s nconf= 3 z= 47 ion= 0 exf=0.650 irel= 1 ag i d9 5s7s nconf= 8 kut=-1 corrf=0.000 class 0 k rdk( 4d, 4d, 4d, 5s) frac k rek( 4d, 4d, 4d, 5s) frac - ------------------------------------- ----- - ------------------------------------- ----- 2 -0.13749022 ryd = -15087.8070 cm-1 -0.476 2 -0.13749049 ryd = -15087.8360 cm-1 -0.476 ag i d10 7s -d9 5s7s 1 -15.0878 5 3 8 1 0.039 0.016 117.172 sec sqrtdel= 1.0000 1.0000 -15.0878 rcn mod 32 ee,eee= -1.12425 -1.39758 slater integrals for ag i d10 7s nconf= 3 z= 47 ion= 0 exf=0.650 irel= 1 ag i d9 5s8s nconf= 9 kut=-1 corrf=0.000 class 0 k rdk( 4d, 4d, 4d, 5s) frac k rek( 4d, 4d, 4d, 5s) frac - ------------------------------------- ----- - ------------------------------------- ----- 2 0.00000000 ryd = 0.0000 cm-1 0.000 2 0.00000000 ryd = 0.0000 cm-1 0.000 ag i d10 7s -d9 5s8s 1 0.0000 5 3 9 1 0.039 0.016 117.227 sec sqrtdel= 1.0000 1.0000 0.0000 rcn mod 32 ee,eee= -1.15148 -1.41119 slater integrals for ag i d10 7s nconf= 3 z= 47 ion= 0 exf=0.650 irel= 1 ag i d9 5s9s nconf=10 kut=-1 corrf=0.000 class 0 k rdk( 4d, 4d, 4d, 5s) frac k rek( 4d, 4d, 4d, 5s) frac - ------------------------------------- ----- - ------------------------------------- ----- 2 0.00000000 ryd = 0.0000 cm-1 0.000 2 0.00000000 ryd = 0.0000 cm-1 0.000 ag i d10 7s -d9 5s9s 1 0.0000 5 3 10 1 0.039 0.109 117.375 sec sqrtdel= 1.0000 1.0000 0.0000 rcn mod 32 ee,eee= -1.02769 -1.34929 slater integrals for ag i d10 7s nconf= 3 z= 47 ion= 0 exf=0.650 irel= 1 ag i d8 5s2 6s nconf=11 kut=-1 corrf=0.000 class 0 k rdk( 4d, 4d, 5s, 5s) frac k rek( 4d, 4d, 5s, 5s) frac - ------------------------------------- ----- - ------------------------------------- ----- 2 0.00000000 ryd = 0.0000 cm-1 0.000 2 0.00000000 ryd = 0.0000 cm-1 0.000 ag i d10 7s -d8 5s2 6s 1 0.0000 5 3 11 1 0.031 0.023 117.430 sec sqrtdel= 1.0000 1.0000 0.0000 rcn mod 32 ee,eee= -0.08312 -0.04156 ee,eee= -0.12010 -0.10161 slater integrals for ag i d10 7s nconf= 3 z= 47 ion= 0 exf=0.650 irel= 1 ag i d9 5s5d nconf=17 kut=-1 corrf=0.000 class 0 k rdk( 4d, 7s, 5s, 5d) frac k rek( 4d, 7s, 5s, 5d) frac - ------------------------------------- ----- - ------------------------------------- ----- 2 0.00301024 ryd = 330.3354 cm-1 0.351 0 0.00188482 ryd = 206.8351 cm-1 0.169 ag i d10 7s -d9 5s5d 2 0.3303 5 0.2068 5 3 17 17 0.602 0.023 118.086 sec sqrtdel= 1.0000 1.0000 0.3303 0.2068 rcn mod 32 ee,eee= -0.06554 -0.07433 slater integrals for ag i d10 7s nconf= 3 z= 47 ion= 0 exf=0.650 irel= 1 ag i d9 5s6d nconf=18 kut=-1 corrf=0.000 class 0 k rdk( 4d, 7s, 5s, 6d) frac k rek( 4d, 7s, 5s, 6d) frac - ------------------------------------- ----- - ------------------------------------- ----- 2 0.00261615 ryd = 287.0889 cm-1 0.447 0 0.00137073 ryd = 150.4200 cm-1 0.165 ag i d10 7s -d9 5s6d 2 0.2871 5 0.1504 5 3 18 1 0.031 0.039 118.156 sec sqrtdel= 1.0000 1.0000 0.2871 0.1504 rcn mod 32 ee,eee= -0.04139 -0.06225 slater integrals for ag i d10 7s nconf= 3 z= 47 ion= 0 exf=0.650 irel= 1 ag i d9 5s7d nconf=19 kut=-1 corrf=0.000 class 0 k rdk( 4d, 7s, 5s, 7d) frac k rek( 4d, 7s, 5s, 7d) frac - ------------------------------------- ----- - ------------------------------------- ----- 2 0.00152352 ryd = 167.1875 cm-1 0.373 0 0.00101091 ryd = 110.9349 cm-1 0.162 ag i d10 7s -d9 5s7d 2 0.1672 5 0.1109 5 3 19 1 0.039 0.008 118.203 sec sqrtdel= 1.0000 1.0000 0.1672 0.1109 rcn mod 32 ee,eee= -0.02853 -0.05582 slater integrals for ag i d10 7s nconf= 3 z= 47 ion= 0 exf=0.650 irel= 1 ag i d9 5s8d nconf=20 kut=-1 corrf=0.000 class 0 k rdk( 4d, 7s, 5s, 8d) frac k rek( 4d, 7s, 5s, 8d) frac - ------------------------------------- ----- - ------------------------------------- ----- 2 0.00100320 ryd = 110.0887 cm-1 0.329 0 0.00077998 ryd = 85.5928 cm-1 0.160 ag i d10 7s -d9 5s8d 2 0.1101 5 0.0856 5 3 20 1 0.031 0.031 118.273 sec sqrtdel= 1.0000 1.0000 0.1101 0.0856 rcn mod 32 ee,eee= -0.02086 -0.05199 slater integrals for ag i d10 7s nconf= 3 z= 47 ion= 0 exf=0.650 irel= 1 ag i d9 5s9d nconf=21 kut=-1 corrf=0.000 class 0 k rdk( 4d, 7s, 5s, 9d) frac k rek( 4d, 7s, 5s, 9d) frac - ------------------------------------- ----- - ------------------------------------- ----- 2 0.00071737 ryd = 78.7224 cm-1 0.300 0 0.00062385 ryd = 68.4601 cm-1 0.159 ag i d10 7s -d9 5s9d 2 0.0787 5 0.0685 5 3 21 1 0.031 0.031 118.336 sec sqrtdel= 1.0000 1.0000 0.0787 0.0685 rcn mod 32 ee,eee= -0.38785 -0.23548 slater integrals for ag i d10 7s nconf= 3 z= 47 ion= 0 exf=0.650 irel= 1 ag i d9 5p2 nconf=41 kut=-1 corrf=0.000 class 0 k rdk( 4d, 7s, 5p, 5p) frac k rek( 4d, 7s, 5p, 5p) frac - ------------------------------------- ----- - ------------------------------------- ----- 1 -0.00317735 ryd = -348.6744 cm-1 -0.112 1 -0.00317735 ryd = -348.6744 cm-1 -0.112 ag i d10 7s -d9 5p2 1 -0.3487 5 3 41 20 0.492 0.008 118.891 sec sqrtdel= 1.0000 1.0000 -0.3487 rcn mod 32 ee,eee= -1.72241 -0.86120 ee,eee= -0.96169 -1.34205 slater integrals for ag i d10 8s nconf= 4 z= 47 ion= 0 exf=0.650 irel= 1 ag i d9 5s6s nconf= 7 kut=-1 corrf=0.000 class 0 k rdk( 4d, 4d, 4d, 5s) frac k rek( 4d, 4d, 4d, 5s) frac - ------------------------------------- ----- - ------------------------------------- ----- 2 0.00000000 ryd = 0.0000 cm-1 0.000 2 0.00000000 ryd = 0.0000 cm-1 0.000 ag i d10 8s -d9 5s6s 1 0.0000 5 4 7 7 0.641 0.008 119.563 sec sqrtdel= 1.0000 1.0000 0.0000 rcn mod 32 ee,eee= -1.07331 -1.39786 slater integrals for ag i d10 8s nconf= 4 z= 47 ion= 0 exf=0.650 irel= 1 ag i d9 5s7s nconf= 8 kut=-1 corrf=0.000 class 0 k rdk( 4d, 4d, 4d, 5s) frac k rek( 4d, 4d, 4d, 5s) frac - ------------------------------------- ----- - ------------------------------------- ----- 2 0.00000000 ryd = 0.0000 cm-1 0.000 2 0.00000000 ryd = 0.0000 cm-1 0.000 ag i d10 8s -d9 5s7s 1 0.0000 5 4 8 1 0.031 0.055 119.656 sec sqrtdel= 1.0000 1.0000 0.0000 rcn mod 32 ee,eee= -1.12425 -1.42333 slater integrals for ag i d10 8s nconf= 4 z= 47 ion= 0 exf=0.650 irel= 1 ag i d9 5s8s nconf= 9 kut=-1 corrf=0.000 class 0 k rdk( 4d, 4d, 4d, 5s) frac k rek( 4d, 4d, 4d, 5s) frac - ------------------------------------- ----- - ------------------------------------- ----- 2 -0.13762028 ryd = -15102.0792 cm-1 -0.475 2 -0.13762054 ryd = -15102.1083 cm-1 -0.475 ag i d10 8s -d9 5s8s 1 -15.1021 5 4 9 1 0.031 0.086 119.781 sec sqrtdel= 1.0000 1.0000 -15.1021 rcn mod 32 ee,eee= -1.15148 -1.43694 slater integrals for ag i d10 8s nconf= 4 z= 47 ion= 0 exf=0.650 irel= 1 ag i d9 5s9s nconf=10 kut=-1 corrf=0.000 class 0 k rdk( 4d, 4d, 4d, 5s) frac k rek( 4d, 4d, 4d, 5s) frac - ------------------------------------- ----- - ------------------------------------- ----- 2 0.00000000 ryd = 0.0000 cm-1 0.000 2 0.00000000 ryd = 0.0000 cm-1 0.000 ag i d10 8s -d9 5s9s 1 0.0000 5 4 10 1 0.039 0.023 119.867 sec sqrtdel= 1.0000 1.0000 0.0000 rcn mod 32 ee,eee= -1.02769 -1.37505 slater integrals for ag i d10 8s nconf= 4 z= 47 ion= 0 exf=0.650 irel= 1 ag i d8 5s2 6s nconf=11 kut=-1 corrf=0.000 class 0 k rdk( 4d, 4d, 5s, 5s) frac k rek( 4d, 4d, 5s, 5s) frac - ------------------------------------- ----- - ------------------------------------- ----- 2 0.00000000 ryd = 0.0000 cm-1 0.000 2 0.00000000 ryd = 0.0000 cm-1 0.000 ag i d10 8s -d8 5s2 6s 1 0.0000 5 4 11 1 0.031 0.016 119.922 sec sqrtdel= 1.0000 1.0000 0.0000 rcn mod 32 ee,eee= -0.04992 -0.02496 ee,eee= -0.12010 -0.08501 slater integrals for ag i d10 8s nconf= 4 z= 47 ion= 0 exf=0.650 irel= 1 ag i d9 5s5d nconf=17 kut=-1 corrf=0.000 class 0 k rdk( 4d, 8s, 5s, 5d) frac k rek( 4d, 8s, 5s, 5d) frac - ------------------------------------- ----- - ------------------------------------- ----- 2 0.00189978 ryd = 208.4770 cm-1 0.335 0 0.00128311 ryd = 140.8048 cm-1 0.170 ag i d10 8s -d9 5s5d 2 0.2085 5 0.1408 5 4 17 17 0.547 0.078 120.570 sec sqrtdel= 1.0000 1.0000 0.2085 0.1408 rcn mod 32 ee,eee= -0.06554 -0.05773 slater integrals for ag i d10 8s nconf= 4 z= 47 ion= 0 exf=0.650 irel= 1 ag i d9 5s6d nconf=18 kut=-1 corrf=0.000 class 0 k rdk( 4d, 8s, 5s, 6d) frac k rek( 4d, 8s, 5s, 6d) frac - ------------------------------------- ----- - ------------------------------------- ----- 2 0.00141278 ryd = 155.0346 cm-1 0.372 0 0.00093345 ryd = 102.4338 cm-1 0.166 ag i d10 8s -d9 5s6d 2 0.1550 5 0.1024 5 4 18 1 0.039 0.016 120.680 sec sqrtdel= 1.0000 1.0000 0.1550 0.1024 rcn mod 32 ee,eee= -0.04139 -0.04565 slater integrals for ag i d10 8s nconf= 4 z= 47 ion= 0 exf=0.650 irel= 1 ag i d9 5s7d nconf=19 kut=-1 corrf=0.000 class 0 k rdk( 4d, 8s, 5s, 7d) frac k rek( 4d, 8s, 5s, 7d) frac - ------------------------------------- ----- - ------------------------------------- ----- 2 0.00115678 ryd = 126.9419 cm-1 0.416 0 0.00068872 ryd = 75.5781 cm-1 0.163 ag i d10 8s -d9 5s7d 2 0.1269 5 0.0756 5 4 19 1 0.031 0.023 120.750 sec sqrtdel= 1.0000 1.0000 0.1269 0.0756 rcn mod 32 ee,eee= -0.02853 -0.03922 slater integrals for ag i d10 8s nconf= 4 z= 47 ion= 0 exf=0.650 irel= 1 ag i d9 5s8d nconf=20 kut=-1 corrf=0.000 class 0 k rdk( 4d, 8s, 5s, 8d) frac k rek( 4d, 8s, 5s, 8d) frac - ------------------------------------- ----- - ------------------------------------- ----- 2 0.00079972 ryd = 87.7594 cm-1 0.382 0 0.00053150 ryd = 58.3252 cm-1 0.162 ag i d10 8s -d9 5s8d 2 0.0878 5 0.0583 5 4 20 1 0.031 0.039 120.820 sec sqrtdel= 1.0000 1.0000 0.0878 0.0583 rcn mod 32 ee,eee= -0.02086 -0.03539 slater integrals for ag i d10 8s nconf= 4 z= 47 ion= 0 exf=0.650 irel= 1 ag i d9 5s9d nconf=21 kut=-1 corrf=0.000 class 0 k rdk( 4d, 8s, 5s, 9d) frac k rek( 4d, 8s, 5s, 9d) frac - ------------------------------------- ----- - ------------------------------------- ----- 2 0.00058939 ryd = 64.6780 cm-1 0.358 0 0.00042516 ryd = 46.6557 cm-1 0.161 ag i d10 8s -d9 5s9d 2 0.0647 5 0.0467 5 4 21 1 0.031 0.016 120.883 sec sqrtdel= 1.0000 1.0000 0.0647 0.0467 rcn mod 32 ee,eee= -0.38785 -0.21888 slater integrals for ag i d10 8s nconf= 4 z= 47 ion= 0 exf=0.650 irel= 1 ag i d9 5p2 nconf=41 kut=-1 corrf=0.000 class 0 k rdk( 4d, 8s, 5p, 5p) frac k rek( 4d, 8s, 5p, 5p) frac - ------------------------------------- ----- - ------------------------------------- ----- 1 -0.00194718 ryd = -213.6788 cm-1 -0.102 1 -0.00194718 ryd = -213.6788 cm-1 -0.102 ag i d10 8s -d9 5p2 1 -0.2137 5 4 41 20 0.922 0.023 121.891 sec sqrtdel= 1.0000 1.0000 -0.2137 rcn mod 32 ee,eee= -1.74974 -0.87487 ee,eee= -0.96169 -1.35571 slater integrals for ag i d10 9s nconf= 5 z= 47 ion= 0 exf=0.650 irel= 1 ag i d9 5s6s nconf= 7 kut=-1 corrf=0.000 class 0 k rdk( 4d, 4d, 4d, 5s) frac k rek( 4d, 4d, 4d, 5s) frac - ------------------------------------- ----- - ------------------------------------- ----- 2 0.00000000 ryd = 0.0000 cm-1 0.000 2 0.00000000 ryd = 0.0000 cm-1 0.000 ag i d10 9s -d9 5s6s 1 0.0000 5 5 7 7 0.203 0.047 122.141 sec sqrtdel= 1.0000 1.0000 0.0000 rcn mod 32 ee,eee= -1.07331 -1.41153 slater integrals for ag i d10 9s nconf= 5 z= 47 ion= 0 exf=0.650 irel= 1 ag i d9 5s7s nconf= 8 kut=-1 corrf=0.000 class 0 k rdk( 4d, 4d, 4d, 5s) frac k rek( 4d, 4d, 4d, 5s) frac - ------------------------------------- ----- - ------------------------------------- ----- 2 0.00000000 ryd = 0.0000 cm-1 0.000 2 0.00000000 ryd = 0.0000 cm-1 0.000 ag i d10 9s -d9 5s7s 1 0.0000 5 5 8 1 0.023 0.055 122.234 sec sqrtdel= 1.0000 1.0000 0.0000 rcn mod 32 ee,eee= -1.12425 -1.43700 slater integrals for ag i d10 9s nconf= 5 z= 47 ion= 0 exf=0.650 irel= 1 ag i d9 5s8s nconf= 9 kut=-1 corrf=0.000 class 0 k rdk( 4d, 4d, 4d, 5s) frac k rek( 4d, 4d, 4d, 5s) frac - ------------------------------------- ----- - ------------------------------------- ----- 2 0.00000000 ryd = 0.0000 cm-1 0.000 2 0.00000000 ryd = 0.0000 cm-1 0.000 ag i d10 9s -d9 5s8s 1 0.0000 5 5 9 1 0.031 0.039 122.305 sec sqrtdel= 1.0000 1.0000 0.0000 rcn mod 32 ee,eee= -1.15148 -1.45061 slater integrals for ag i d10 9s nconf= 5 z= 47 ion= 0 exf=0.650 irel= 1 ag i d9 5s9s nconf=10 kut=-1 corrf=0.000 class 0 k rdk( 4d, 4d, 4d, 5s) frac k rek( 4d, 4d, 4d, 5s) frac - ------------------------------------- ----- - ------------------------------------- ----- 2 -0.13766638 ryd = -15107.1378 cm-1 -0.475 2 -0.13766664 ryd = -15107.1668 cm-1 -0.475 ag i d10 9s -d9 5s9s 1 -15.1071 5 5 10 1 0.031 0.016 122.352 sec sqrtdel= 1.0000 1.0000 -15.1071 rcn mod 32 ee,eee= -1.02769 -1.38871 slater integrals for ag i d10 9s nconf= 5 z= 47 ion= 0 exf=0.650 irel= 1 ag i d8 5s2 6s nconf=11 kut=-1 corrf=0.000 class 0 k rdk( 4d, 4d, 5s, 5s) frac k rek( 4d, 4d, 5s, 5s) frac - ------------------------------------- ----- - ------------------------------------- ----- 2 0.00000000 ryd = 0.0000 cm-1 0.000 2 0.00000000 ryd = 0.0000 cm-1 0.000 ag i d10 9s -d8 5s2 6s 1 0.0000 5 5 11 1 0.031 0.023 122.406 sec sqrtdel= 1.0000 1.0000 0.0000 rcn mod 32 ee,eee= -0.03331 -0.01666 ee,eee= -0.12010 -0.07671 slater integrals for ag i d10 9s nconf= 5 z= 47 ion= 0 exf=0.650 irel= 1 ag i d9 5s5d nconf=17 kut=-1 corrf=0.000 class 0 k rdk( 4d, 9s, 5s, 5d) frac k rek( 4d, 9s, 5s, 5d) frac - ------------------------------------- ----- - ------------------------------------- ----- 2 0.00135880 ryd = 149.1106 cm-1 0.329 0 0.00094634 ryd = 103.8487 cm-1 0.170 ag i d10 9s -d9 5s5d 2 0.1491 5 0.1038 5 5 17 17 0.477 0.039 122.945 sec sqrtdel= 1.0000 1.0000 0.1491 0.1038 rcn mod 32 ee,eee= -0.06554 -0.04943 slater integrals for ag i d10 9s nconf= 5 z= 47 ion= 0 exf=0.650 irel= 1 ag i d9 5s6d nconf=18 kut=-1 corrf=0.000 class 0 k rdk( 4d, 9s, 5s, 6d) frac k rek( 4d, 9s, 5s, 6d) frac - ------------------------------------- ----- - ------------------------------------- ----- 2 0.00099383 ryd = 109.0601 cm-1 0.361 0 0.00068858 ryd = 75.5625 cm-1 0.167 ag i d10 9s -d9 5s6d 2 0.1091 5 0.0756 5 5 18 1 0.031 0.008 122.992 sec sqrtdel= 1.0000 1.0000 0.1091 0.0756 rcn mod 32 ee,eee= -0.04139 -0.03735 slater integrals for ag i d10 9s nconf= 5 z= 47 ion= 0 exf=0.650 irel= 1 ag i d9 5s7d nconf=19 kut=-1 corrf=0.000 class 0 k rdk( 4d, 9s, 5s, 7d) frac k rek( 4d, 9s, 5s, 7d) frac - ------------------------------------- ----- - ------------------------------------- ----- 2 0.00074419 ryd = 81.6657 cm-1 0.373 0 0.00050816 ryd = 55.7641 cm-1 0.164 ag i d10 9s -d9 5s7d 2 0.0817 5 0.0558 5 5 19 1 0.031 0.055 123.086 sec sqrtdel= 1.0000 1.0000 0.0817 0.0558 rcn mod 32 ee,eee= -0.02853 -0.03092 slater integrals for ag i d10 9s nconf= 5 z= 47 ion= 0 exf=0.650 irel= 1 ag i d9 5s8d nconf=20 kut=-1 corrf=0.000 class 0 k rdk( 4d, 9s, 5s, 8d) frac k rek( 4d, 9s, 5s, 8d) frac - ------------------------------------- ----- - ------------------------------------- ----- 2 0.00061148 ryd = 67.1020 cm-1 0.398 0 0.00039220 ryd = 43.0390 cm-1 0.162 ag i d10 9s -d9 5s8d 2 0.0671 5 0.0430 5 5 20 1 0.031 0.078 123.195 sec sqrtdel= 1.0000 1.0000 0.0671 0.0430 rcn mod 32 ee,eee= -0.02086 -0.02709 slater integrals for ag i d10 9s nconf= 5 z= 47 ion= 0 exf=0.650 irel= 1 ag i d9 5s9d nconf=21 kut=-1 corrf=0.000 class 0 k rdk( 4d, 9s, 5s, 9d) frac k rek( 4d, 9s, 5s, 9d) frac - ------------------------------------- ----- - ------------------------------------- ----- 2 0.00046095 ryd = 50.5832 cm-1 0.380 0 0.00031375 ryd = 34.4299 cm-1 0.161 ag i d10 9s -d9 5s9d 2 0.0506 5 0.0344 5 5 21 1 0.031 0.016 123.250 sec sqrtdel= 1.0000 1.0000 0.0506 0.0344 rcn mod 32 ee,eee= -0.38785 -0.21058 slater integrals for ag i d10 9s nconf= 5 z= 47 ion= 0 exf=0.650 irel= 1 ag i d9 5p2 nconf=41 kut=-1 corrf=0.000 class 0 k rdk( 4d, 9s, 5p, 5p) frac k rek( 4d, 9s, 5p, 5p) frac - ------------------------------------- ----- - ------------------------------------- ----- 1 -0.00135726 ryd = -148.9425 cm-1 -0.097 1 -0.00135726 ryd = -148.9425 cm-1 -0.097 ag i d10 9s -d9 5p2 1 -0.1489 5 5 41 20 1.156 0.008 124.500 sec sqrtdel= 1.0000 1.0000 -0.1489 rcn mod 32 ee,eee= -0.62159 -0.31080 ee,eee= -0.18687 -0.40423 slater integrals for ag i d9 5s2 nconf= 6 z= 47 ion= 0 exf=0.650 irel= 1 ag i d9 5s6s nconf= 7 kut=-1 corrf=0.000 class 6 k rdk( 4d, 5s, 4d, 6s) frac k rek( 4d, 5s, 4d, 6s) frac - ------------------------------------- ----- - ------------------------------------- ----- 0 0.10103854 ryd = 11087.6975 cm-1 0.430 2 0.03177136 ryd = 3486.5039 cm-1 0.731 - ------------------------------------- ----- - ------------------------------------- ----- 0 0.10084460 ryd = 11066.4150 cm-1 0.429 2 0.03214110 ryd = 3527.0777 cm-1 0.732 - ------------------------------------- ----- - ------------------------------------- ----- 0 0.10124316 ryd = 11110.1518 cm-1 0.430 2 0.03163446 ryd = 3471.4802 cm-1 0.734 - ------------------------------------- ----- - ------------------------------------- ----- 0 0.10104388 ryd = 11088.2834 cm-1 0.430 2 0.03188778 ryd = 3499.2789 cm-1 0.734 9.00000 0.28699 2.00000 2.00000 0.00000 0.02870 -0.40423 0.00000 ag i d9 5s2 -d9 5s6s 2 0.3499 5 3.4865 5 6 7 7 0.320 0.195 125.016 sec rcn mod 32 ee,eee= -0.62159 -0.31080 ee,eee= -0.18687 -0.40423 slater integrals for ag i d9 5s2 nconf= 6 z= 47 ion= 0 exf=0.650 irel= 1 ag i d9 5s6s nconf= 7 kut=-1 corrf=0.000 class 1 k rdk( 5s, 5s, 5s, 6s) frac k rek( 5s, 5s, 5s, 6s) frac - ------------------------------------- ----- - ------------------------------------- ----- 0 0.06042707 ryd = 6631.1046 cm-1 0.313 0 0.06042706 ryd = 6631.1034 cm-1 0.313 - ------------------------------------- ----- - ------------------------------------- ----- 0 0.05735290 ryd = 6293.7525 cm-1 0.301 0 0.05735288 ryd = 6293.7512 cm-1 0.301 - ------------------------------------- ----- - ------------------------------------- ----- 0 0.06392010 ryd = 7014.4203 cm-1 0.323 0 0.09228896 ryd = 10127.5418 cm-1 0.513 - ------------------------------------- ----- - ------------------------------------- ----- 0 0.06063650 ryd = 6654.0864 cm-1 0.323 0 0.07482092 ryd = 8210.6465 cm-1 0.513 1.00000 0.04614 0.00000 0.00000 0.00000 0.02307 -0.40423 0.00000 ag i d9 5s2 -d9 5s6s 1 2.5319 5 6 7 7 0.203 0.047 125.273 sec sqrtdel= 1.0000 1.0000 0.3499 3.4865 2.5319 rcn mod 32 ee,eee= -0.62159 -0.31080 ee,eee= -0.08885 -0.35522 slater integrals for ag i d9 5s2 nconf= 6 z= 47 ion= 0 exf=0.650 irel= 1 ag i d9 5s7s nconf= 8 kut=-1 corrf=0.000 class 6 k rdk( 4d, 5s, 4d, 7s) frac k rek( 4d, 5s, 4d, 7s) frac - ------------------------------------- ----- - ------------------------------------- ----- 0 0.05564121 ryd = 6105.9163 cm-1 0.413 2 0.01830212 ryd = 2008.4259 cm-1 0.722 - ------------------------------------- ----- - ------------------------------------- ----- 0 0.05552099 ryd = 6092.7243 cm-1 0.412 2 0.01851909 ryd = 2032.2346 cm-1 0.723 - ------------------------------------- ----- - ------------------------------------- ----- 0 0.05576765 ryd = 6119.7919 cm-1 0.414 2 0.01824360 ryd = 2002.0038 cm-1 0.726 - ------------------------------------- ----- - ------------------------------------- ----- 0 0.05564432 ryd = 6106.2581 cm-1 0.414 2 0.01838134 ryd = 2017.1192 cm-1 0.726 9.00000 0.16543 2.00000 2.00000 0.00000 0.01654 -0.35522 0.00000 ag i d9 5s2 -d9 5s7s 2 0.2017 5 2.0084 5 6 8 8 0.227 0.070 125.570 sec rcn mod 32 ee,eee= -0.62159 -0.31080 ee,eee= -0.08885 -0.35522 slater integrals for ag i d9 5s2 nconf= 6 z= 47 ion= 0 exf=0.650 irel= 1 ag i d9 5s7s nconf= 8 kut=-1 corrf=0.000 class 1 k rdk( 5s, 5s, 5s, 7s) frac k rek( 5s, 5s, 5s, 7s) frac - ------------------------------------- ----- - ------------------------------------- ----- 0 0.03221865 ryd = 3535.5882 cm-1 0.293 0 0.03221865 ryd = 3535.5875 cm-1 0.293 - ------------------------------------- ----- - ------------------------------------- ----- 0 0.03038950 ryd = 3334.8615 cm-1 0.280 0 0.03038949 ryd = 3334.8607 cm-1 0.280 - ------------------------------------- ----- - ------------------------------------- ----- 0 0.03429198 ryd = 3763.1095 cm-1 0.303 0 0.05008206 ryd = 5495.8707 cm-1 0.485 - ------------------------------------- ----- - ------------------------------------- ----- 0 0.03234074 ryd = 3548.9855 cm-1 0.303 0 0.04023577 ryd = 4415.3657 cm-1 0.485 1.00000 0.02504 0.00000 0.00000 0.00000 0.01252 -0.35522 0.00000 ag i d9 5s2 -d9 5s7s 1 1.3740 5 6 8 8 0.234 0.063 125.867 sec sqrtdel= 1.0000 1.0000 0.2017 2.0084 1.3740 rcn mod 32 ee,eee= -0.62159 -0.31080 ee,eee= -0.05243 -0.33701 slater integrals for ag i d9 5s2 nconf= 6 z= 47 ion= 0 exf=0.650 irel= 1 ag i d9 5s8s nconf= 9 kut=-1 corrf=0.000 class 6 k rdk( 4d, 5s, 4d, 8s) frac k rek( 4d, 5s, 4d, 8s) frac - ------------------------------------- ----- - ------------------------------------- ----- 0 0.03695624 ryd = 4055.4785 cm-1 0.407 2 0.01235073 ryd = 1355.3364 cm-1 0.718 - ------------------------------------- ----- - ------------------------------------- ----- 0 0.03687336 ryd = 4046.3831 cm-1 0.406 2 0.01249695 ryd = 1371.3812 cm-1 0.719 - ------------------------------------- ----- - ------------------------------------- ----- 0 0.03704330 ryd = 4065.0322 cm-1 0.408 2 0.01231720 ryd = 1351.6569 cm-1 0.722 - ------------------------------------- ----- - ------------------------------------- ----- 0 0.03695833 ryd = 4055.7076 cm-1 0.408 2 0.01240708 ryd = 1361.5191 cm-1 0.722 9.00000 0.11166 2.00000 2.00000 0.00000 0.01117 -0.33701 0.00000 ag i d9 5s2 -d9 5s8s 2 0.1362 5 1.3553 5 6 9 9 0.633 0.063 126.586 sec rcn mod 32 ee,eee= -0.62159 -0.31080 ee,eee= -0.05243 -0.33701 slater integrals for ag i d9 5s2 nconf= 6 z= 47 ion= 0 exf=0.650 irel= 1 ag i d9 5s8s nconf= 9 kut=-1 corrf=0.000 class 1 k rdk( 5s, 5s, 5s, 8s) frac k rek( 5s, 5s, 5s, 8s) frac - ------------------------------------- ----- - ------------------------------------- ----- 0 0.02113615 ryd = 2319.4244 cm-1 0.285 0 0.02113615 ryd = 2319.4238 cm-1 0.285 - ------------------------------------- ----- - ------------------------------------- ----- 0 0.01989606 ryd = 2183.3398 cm-1 0.272 0 0.01989605 ryd = 2183.3392 cm-1 0.272 - ------------------------------------- ----- - ------------------------------------- ----- 0 0.02254043 ryd = 2473.5256 cm-1 0.296 0 0.03293773 ryd = 3614.4976 cm-1 0.472 - ------------------------------------- ----- - ------------------------------------- ----- 0 0.02121824 ryd = 2328.4327 cm-1 0.296 0 0.02641689 ryd = 2898.9184 cm-1 0.472 1.00000 0.01647 0.00000 0.00000 0.00000 0.00823 -0.33701 0.00000 ag i d9 5s2 -d9 5s8s 1 0.9036 5 6 9 9 0.258 0.133 126.977 sec sqrtdel= 1.0000 1.0000 0.1362 1.3553 0.9036 rcn mod 32 ee,eee= -0.62159 -0.31080 ee,eee= -0.03465 -0.32812 slater integrals for ag i d9 5s2 nconf= 6 z= 47 ion= 0 exf=0.650 irel= 1 ag i d9 5s9s nconf=10 kut=-1 corrf=0.000 class 6 k rdk( 4d, 5s, 4d, 9s) frac k rek( 4d, 5s, 4d, 9s) frac - ------------------------------------- ----- - ------------------------------------- ----- 0 0.02693100 ryd = 2955.3352 cm-1 0.404 2 0.00906808 ryd = 995.1062 cm-1 0.716 - ------------------------------------- ----- - ------------------------------------- ----- 0 0.02686959 ryd = 2948.5969 cm-1 0.403 2 0.00917512 ryd = 1006.8531 cm-1 0.716 - ------------------------------------- ----- - ------------------------------------- ----- 0 0.02699545 ryd = 2962.4078 cm-1 0.404 2 0.00904574 ryd = 992.6552 cm-1 0.720 - ------------------------------------- ----- - ------------------------------------- ----- 0 0.02693252 ryd = 2955.5024 cm-1 0.404 2 0.00911043 ryd = 999.7541 cm-1 0.720 9.00000 0.08199 2.00000 2.00000 0.00000 0.00820 -0.32812 0.00000 ag i d9 5s2 -d9 5s9s 2 0.1000 5 0.9951 5 6 10 10 0.289 0.063 127.336 sec rcn mod 32 ee,eee= -0.62159 -0.31080 ee,eee= -0.03465 -0.32812 slater integrals for ag i d9 5s2 nconf= 6 z= 47 ion= 0 exf=0.650 irel= 1 ag i d9 5s9s nconf=10 kut=-1 corrf=0.000 class 1 k rdk( 5s, 5s, 5s, 9s) frac k rek( 5s, 5s, 5s, 9s) frac - ------------------------------------- ----- - ------------------------------------- ----- 0 0.01530895 ryd = 1679.9631 cm-1 0.281 0 0.01530895 ryd = 1679.9626 cm-1 0.282 - ------------------------------------- ----- - ------------------------------------- ----- 0 0.01439846 ryd = 1580.0482 cm-1 0.268 0 0.01439846 ryd = 1580.0478 cm-1 0.268 - ------------------------------------- ----- - ------------------------------------- ----- 0 0.01633950 ryd = 1793.0533 cm-1 0.292 0 0.02385463 ryd = 2617.7433 cm-1 0.466 - ------------------------------------- ----- - ------------------------------------- ----- 0 0.01536898 ryd = 1686.5507 cm-1 0.292 0 0.01912654 ryd = 2098.8955 cm-1 0.466 1.00000 0.01193 0.00000 0.00000 0.00000 0.00596 -0.32812 0.00000 ag i d9 5s2 -d9 5s9s 1 0.6544 5 6 10 10 0.289 0.047 127.680 sec sqrtdel= 1.0000 1.0000 0.1000 0.9951 0.6544 rcn mod 32 ee,eee= -1.47222 -0.73611 ee,eee= -0.20180 -0.83701 slater integrals for ag i d9 5s2 nconf= 6 z= 47 ion= 0 exf=0.650 irel= 1 ag i d8 5s2 6s nconf=11 kut=-1 corrf=0.000 class 0 k rdk( 4d, 4d, 4d, 6s) frac k rek( 4d, 4d, 4d, 6s) frac - ------------------------------------- ----- - ------------------------------------- ----- 2 -0.03539951 ryd = -3884.6474 cm-1 -0.415 2 -0.03539959 ryd = -3884.6562 cm-1 -0.415 ag i d9 5s2 -d8 5s2 6s 1 -3.8846 5 6 11 11 0.531 0.031 128.242 sec sqrtdel= 1.0000 1.0000 -3.8846 rcn mod 32 ee,eee= -0.62159 -0.31080 ee,eee= -0.11438 -0.36798 slater integrals for ag i d9 5s2 nconf= 6 z= 47 ion= 0 exf=0.650 irel= 1 ag i d10 5d nconf=12 kut=-1 corrf=0.000 class 0 k rdk( 5s, 5s, 4d, 5d) frac k rek( 5s, 5s, 4d, 5d) frac - ------------------------------------- ----- - ------------------------------------- ----- 2 -0.01630249 ryd = -1788.9912 cm-1 -0.702 2 -0.01630251 ryd = -1788.9936 cm-1 -0.702 ag i d9 5s2 -d10 5d 1 -1.7890 5 6 12 12 0.891 0.031 129.172 sec sqrtdel= 1.0000 1.0000 -1.7890 rcn mod 32 ee,eee= -0.06361 -0.34260 slater integrals for ag i d9 5s2 nconf= 6 z= 47 ion= 0 exf=0.650 irel= 1 ag i d10 6d nconf=13 kut=-1 corrf=0.000 class 0 k rdk( 5s, 5s, 4d, 6d) frac k rek( 5s, 5s, 4d, 6d) frac - ------------------------------------- ----- - ------------------------------------- ----- 2 -0.01211245 ryd = -1329.1873 cm-1 -0.713 2 -0.01211246 ryd = -1329.1891 cm-1 -0.713 ag i d9 5s2 -d10 6d 1 -1.3292 5 6 13 1 0.031 0.031 129.234 sec sqrtdel= 1.0000 1.0000 -1.3292 rcn mod 32 ee,eee= -0.04051 -0.33105 slater integrals for ag i d9 5s2 nconf= 6 z= 47 ion= 0 exf=0.650 irel= 1 ag i d10 7d nconf=14 kut=-1 corrf=0.000 class 0 k rdk( 5s, 5s, 4d, 7d) frac k rek( 5s, 5s, 4d, 7d) frac - ------------------------------------- ----- - ------------------------------------- ----- 2 -0.00912729 ryd = -1001.6040 cm-1 -0.716 2 -0.00912730 ryd = -1001.6054 cm-1 -0.715 ag i d9 5s2 -d10 7d 1 -1.0016 5 6 14 1 0.070 0.047 129.352 sec sqrtdel= 1.0000 1.0000 -1.0016 rcn mod 32 ee,eee= -0.02805 -0.32482 slater integrals for ag i d9 5s2 nconf= 6 z= 47 ion= 0 exf=0.650 irel= 1 ag i d10 8d nconf=15 kut=-1 corrf=0.000 class 0 k rdk( 5s, 5s, 4d, 8d) frac k rek( 5s, 5s, 4d, 8d) frac - ------------------------------------- ----- - ------------------------------------- ----- 2 -0.00712824 ryd = -782.2339 cm-1 -0.716 2 -0.00712825 ryd = -782.2350 cm-1 -0.716 ag i d9 5s2 -d10 8d 1 -0.7822 5 6 15 1 0.023 0.031 129.422 sec sqrtdel= 1.0000 1.0000 -0.7822 rcn mod 32 ee,eee= -0.02057 -0.32108 slater integrals for ag i d9 5s2 nconf= 6 z= 47 ion= 0 exf=0.650 irel= 1 ag i d10 9d nconf=16 kut=-1 corrf=0.000 class 0 k rdk( 5s, 5s, 4d, 9d) frac k rek( 5s, 5s, 4d, 9d) frac - ------------------------------------- ----- - ------------------------------------- ----- 2 -0.00576677 ryd = -632.8297 cm-1 -0.717 2 -0.00576678 ryd = -632.8306 cm-1 -0.717 ag i d9 5s2 -d10 9d 1 -0.6328 5 6 16 1 0.031 0.094 129.547 sec sqrtdel= 1.0000 1.0000 -0.6328 rcn mod 32 ee,eee= -0.62159 -0.31080 ee,eee= -0.12010 -0.37085 slater integrals for ag i d9 5s2 nconf= 6 z= 47 ion= 0 exf=0.650 irel= 1 ag i d9 5s5d nconf=17 kut=-1 corrf=0.000 class 0 k rdk( 4d, 5s, 4d, 5d) frac k rek( 4d, 5s, 4d, 5d) frac - ------------------------------------- ----- - ------------------------------------- ----- 2 0.02226626 ryd = 2443.4393 cm-1 0.748 2 0.00341329 ryd = 374.5653 cm-1 0.183 ag i d9 5s2 -d9 5s5d 2 2.4434 5 0.3746 5 6 17 17 0.477 0.008 130.031 sec sqrtdel= 1.0000 1.0000 2.4434 0.3746 rcn mod 32 ee,eee= -0.06554 -0.34357 slater integrals for ag i d9 5s2 nconf= 6 z= 47 ion= 0 exf=0.650 irel= 1 ag i d9 5s6d nconf=18 kut=-1 corrf=0.000 class 0 k rdk( 4d, 5s, 4d, 6d) frac k rek( 4d, 5s, 4d, 6d) frac - ------------------------------------- ----- - ------------------------------------- ----- 2 0.01663979 ryd = 1826.0053 cm-1 0.755 2 0.00273189 ryd = 299.7905 cm-1 0.196 ag i d9 5s2 -d9 5s6d 2 1.8260 5 0.2998 5 6 18 1 0.039 0.023 130.117 sec sqrtdel= 1.0000 1.0000 1.8260 0.2998 rcn mod 32 ee,eee= -0.04139 -0.33149 slater integrals for ag i d9 5s2 nconf= 6 z= 47 ion= 0 exf=0.650 irel= 1 ag i d9 5s7d nconf=19 kut=-1 corrf=0.000 class 0 k rdk( 4d, 5s, 4d, 7d) frac k rek( 4d, 5s, 4d, 7d) frac - ------------------------------------- ----- - ------------------------------------- ----- 2 0.01258222 ryd = 1380.7395 cm-1 0.759 2 0.00214479 ryd = 235.3637 cm-1 0.204 ag i d9 5s2 -d9 5s7d 2 1.3807 5 0.2354 5 6 19 1 0.031 0.016 130.172 sec sqrtdel= 1.0000 1.0000 1.3807 0.2354 rcn mod 32 ee,eee= -0.02853 -0.32506 slater integrals for ag i d9 5s2 nconf= 6 z= 47 ion= 0 exf=0.650 irel= 1 ag i d9 5s8d nconf=20 kut=-1 corrf=0.000 class 0 k rdk( 4d, 5s, 4d, 8d) frac k rek( 4d, 5s, 4d, 8d) frac - ------------------------------------- ----- - ------------------------------------- ----- 2 0.00983793 ryd = 1079.5882 cm-1 0.762 2 0.00171124 ryd = 187.7864 cm-1 0.208 ag i d9 5s2 -d9 5s8d 2 1.0796 5 0.1878 5 6 20 1 0.031 0.031 130.242 sec sqrtdel= 1.0000 1.0000 1.0796 0.1878 rcn mod 32 ee,eee= -0.02086 -0.32123 slater integrals for ag i d9 5s2 nconf= 6 z= 47 ion= 0 exf=0.650 irel= 1 ag i d9 5s9d nconf=21 kut=-1 corrf=0.000 class 0 k rdk( 4d, 5s, 4d, 9d) frac k rek( 4d, 5s, 4d, 9d) frac - ------------------------------------- ----- - ------------------------------------- ----- 2 0.00793071 ryd = 870.2953 cm-1 0.763 2 0.00139658 ryd = 153.2565 cm-1 0.211 ag i d9 5s2 -d9 5s9d 2 0.8703 5 0.1533 5 6 21 1 0.031 0.023 130.320 sec sqrtdel= 1.0000 1.0000 0.8703 0.1533 rcn mod 32 ee,eee= -1.47222 -0.73611 ee,eee= -0.12522 -0.79872 slater integrals for ag i d9 5s2 nconf= 6 z= 47 ion= 0 exf=0.650 irel= 1 ag i d8 5s2 5d nconf=22 kut=-1 corrf=0.000 class 1 k rdk( 4d, 4d, 4d, 5d) frac k rek( 4d, 4d, 4d, 5d) frac - ------------------------------------- ----- - ------------------------------------- ----- 0 0.07144551 ryd = 7840.2378 cm-1 0.586 0 0.07144551 ryd = 7840.2376 cm-1 0.586 2 0.04389067 ryd = 4816.4441 cm-1 0.813 2 0.04389066 ryd = 4816.4427 cm-1 0.814 4 0.03040426 ryd = 3336.4818 cm-1 0.887 4 0.03040424 ryd = 3336.4793 cm-1 0.887 - ------------------------------------- ----- - ------------------------------------- ----- 0 0.07033341 ryd = 7718.1996 cm-1 0.582 0 0.07033341 ryd = 7718.1993 cm-1 0.582 2 0.04281613 ryd = 4698.5264 cm-1 0.803 2 0.04281611 ryd = 4698.5249 cm-1 0.803 4 0.02958846 ryd = 3246.9580 cm-1 0.875 4 0.02958843 ryd = 3246.9553 cm-1 0.876 - ------------------------------------- ----- - ------------------------------------- ----- 0 0.07267255 ryd = 7974.8904 cm-1 0.590 0 0.08045787 ryd = 8829.2297 cm-1 0.683 2 0.04498359 ryd = 4936.3783 cm-1 0.823 2 0.04608249 ryd = 5056.9681 cm-1 0.852 4 0.03122397 ryd = 3426.4342 cm-1 0.897 4 0.03150925 ryd = 3457.7399 cm-1 0.907 - ------------------------------------- ----- - ------------------------------------- ----- 0 0.07150298 ryd = 7846.5450 cm-1 0.590 0 0.07539564 ryd = 8273.7145 cm-1 0.683 2 0.04389986 ryd = 4817.4523 cm-1 0.823 2 0.04444930 ryd = 4877.7465 cm-1 0.852 4 0.03040621 ryd = 3336.6961 cm-1 0.897 4 0.03054884 ryd = 3352.3476 cm-1 0.907 8.00000 0.32183 2.00000 0.00000 2.00000 0.03218 -0.79872 0.00000 8.00000 0.37462 2.00000 2.00000 2.00000 0.04289 -0.79872 0.00000 8.00000 0.25754 2.00000 4.00000 2.00000 0.05025 -0.79872 0.00000 ag i d9 5s2 -d8 5s2 5d 3 0.6892 5 4.8164 5 3.3365 5 6 22 22 0.641 0.406 131.367 sec sqrtdel= 1.0000 1.0000 0.6892 4.8164 3.3365 rcn mod 32 ee,eee= -0.62159 -0.31080 ee,eee= -0.04004 -0.33082 slater integrals for ag i d9 5s2 nconf= 6 z= 47 ion= 0 exf=0.650 irel= 1 ag i d9 5s5g nconf=28 kut=-1 corrf=0.000 class 0 k rdk( 4d, 5s, 4d, 5g) frac k rek( 4d, 5s, 4d, 5g) frac - ------------------------------------- ----- - ------------------------------------- ----- 4 0.00005548 ryd = 6.0885 cm-1 0.993 2 0.00004600 ryd = 5.0479 cm-1 0.917 ag i d9 5s2 -d9 5s5g 2 0.0061 5 0.0050 5 6 28 28 0.953 0.055 132.391 sec sqrtdel= 1.0000 1.0000 0.0061 0.0050 rcn mod 32 ee,eee= -0.02782 -0.32471 slater integrals for ag i d9 5s2 nconf= 6 z= 47 ion= 0 exf=0.650 irel= 1 ag i d9 5s6g nconf=29 kut=-1 corrf=0.000 class 0 k rdk( 4d, 5s, 4d, 6g) frac k rek( 4d, 5s, 4d, 6g) frac - ------------------------------------- ----- - ------------------------------------- ----- 4 0.00005957 ryd = 6.5370 cm-1 0.993 2 0.00004955 ryd = 5.4378 cm-1 0.916 ag i d9 5s2 -d9 5s6g 2 0.0065 5 0.0054 5 6 29 1 0.031 0.047 132.680 sec sqrtdel= 1.0000 1.0000 0.0065 0.0054 rcn mod 32 ee,eee= -0.02044 -0.32101 slater integrals for ag i d9 5s2 nconf= 6 z= 47 ion= 0 exf=0.650 irel= 1 ag i d9 5s7g nconf=30 kut=-1 corrf=0.000 class 0 k rdk( 4d, 5s, 4d, 7g) frac k rek( 4d, 5s, 4d, 7g) frac - ------------------------------------- ----- - ------------------------------------- ----- 4 0.00005589 ryd = 6.1332 cm-1 0.993 2 0.00004658 ryd = 5.1114 cm-1 0.915 ag i d9 5s2 -d9 5s7g 2 0.0061 5 0.0051 5 6 30 1 0.031 0.016 132.813 sec sqrtdel= 1.0000 1.0000 0.0061 0.0051 rcn mod 32 ee,eee= -0.01565 -0.31862 slater integrals for ag i d9 5s2 nconf= 6 z= 47 ion= 0 exf=0.650 irel= 1 ag i d9 5s8g nconf=31 kut=-1 corrf=0.000 class 0 k rdk( 4d, 5s, 4d, 8g) frac k rek( 4d, 5s, 4d, 8g) frac - ------------------------------------- ----- - ------------------------------------- ----- 4 0.00005051 ryd = 5.5425 cm-1 0.993 2 0.00004214 ryd = 4.6245 cm-1 0.915 ag i d9 5s2 -d9 5s8g 2 0.0055 5 0.0046 5 6 31 1 0.031 0.031 132.883 sec sqrtdel= 1.0000 1.0000 0.0055 0.0046 rcn mod 32 ee,eee= -0.01236 -0.31698 slater integrals for ag i d9 5s2 nconf= 6 z= 47 ion= 0 exf=0.650 irel= 1 ag i d9 5s9g nconf=32 kut=-1 corrf=0.000 class 0 k rdk( 4d, 5s, 4d, 9g) frac k rek( 4d, 5s, 4d, 9g) frac - ------------------------------------- ----- - ------------------------------------- ----- 4 0.00004516 ryd = 4.9562 cm-1 0.992 2 0.00003771 ryd = 4.1387 cm-1 0.915 ag i d9 5s2 -d9 5s9g 2 0.0050 5 0.0041 5 6 32 1 0.023 0.016 132.930 sec sqrtdel= 1.0000 1.0000 0.0050 0.0041 rcn mod 32 ee,eee= -0.62159 -0.31080 ee,eee= -0.38785 -0.50472 slater integrals for ag i d9 5s2 nconf= 6 z= 47 ion= 0 exf=0.650 irel= 1 ag i d9 5p2 nconf=41 kut=-1 corrf=0.000 class 0 k rdk( 5s, 5s, 5p, 5p) frac k rek( 5s, 5s, 5p, 5p) frac - ------------------------------------- ----- - ------------------------------------- ----- 1 0.30760305 ryd = 33755.5316 cm-1 0.999 1 0.30760305 ryd = 33755.5316 cm-1 0.999 ag i d9 5s2 -d9 5p2 1 33.7555 5 6 41 41 1.359 0.016 134.461 sec sqrtdel= 1.0000 1.0000 33.7555 rcn mod 32 ee,eee= -0.18687 -0.09343 ee,eee= -0.08885 -0.13786 slater integrals for ag i d9 5s6s nconf= 7 z= 47 ion= 0 exf=0.650 irel= 1 ag i d9 5s7s nconf= 8 kut=-1 corrf=0.000 class 11 k rdk( 4d, 6s, 4d, 7s) frac k rek( 4d, 6s, 4d, 7s) frac - ------------------------------------- ----- - ------------------------------------- ----- 0 0.06292162 ryd = 6904.8493 cm-1 0.458 2 0.00549957 ryd = 603.5076 cm-1 0.708 - ------------------------------------- ----- - ------------------------------------- ----- 0 0.06291934 ryd = 6904.5991 cm-1 0.458 2 0.00550191 ryd = 603.7646 cm-1 0.708 - ------------------------------------- ----- - ------------------------------------- ----- 0 0.06292395 ryd = 6905.1050 cm-1 0.458 2 0.00549755 ryd = 603.2868 cm-1 0.708 - ------------------------------------- ----- - ------------------------------------- ----- 0 0.06292164 ryd = 6904.8520 cm-1 0.458 2 0.00549973 ryd = 603.5257 cm-1 0.708 9.00000 0.04950 2.00000 2.00000 0.00000 0.00000 -0.13786 0.00000 ag i d9 5s6s -d9 5s7s 2 0.0000 5 0.6035 5 7 8 8 0.234 0.109 134.805 sec rcn mod 32 ee,eee= -0.18687 -0.09343 ee,eee= -0.08885 -0.13786 slater integrals for ag i d9 5s6s nconf= 7 z= 47 ion= 0 exf=0.650 irel= 1 ag i d9 5s7s nconf= 8 kut=-1 corrf=0.000 class 11 k rdk( 5s, 6s, 5s, 7s) frac k rek( 5s, 6s, 5s, 7s) frac - ------------------------------------- ----- - ------------------------------------- ----- 0 0.05597898 ryd = 6142.9829 cm-1 0.429 0 0.01004527 ryd = 1102.3411 cm-1 0.331 - ------------------------------------- ----- - ------------------------------------- ----- 0 0.05594210 ryd = 6138.9356 cm-1 0.429 0 0.00992638 ryd = 1089.2945 cm-1 0.325 - ------------------------------------- ----- - ------------------------------------- ----- 0 0.05601962 ryd = 6147.4426 cm-1 0.429 0 0.01017818 ryd = 1116.9258 cm-1 0.338 - ------------------------------------- ----- - ------------------------------------- ----- 0 0.05598086 ryd = 6143.1891 cm-1 0.429 0 0.01005228 ryd = 1103.1101 cm-1 0.338 1.00000 0.01005 0.00000 0.00000 0.00000 0.00000 -0.13786 0.00000 ag i d9 5s6s -d9 5s7s 2 0.0000 5 1.1023 5 7 8 8 0.359 0.094 135.266 sec sqrtdel= 1.0000 1.0000 0.0000 0.6035 0.0000 1.1023 rcn mod 32 ee,eee= -0.18687 -0.09343 ee,eee= -0.05243 -0.11965 slater integrals for ag i d9 5s6s nconf= 7 z= 47 ion= 0 exf=0.650 irel= 1 ag i d9 5s8s nconf= 9 kut=-1 corrf=0.000 class 11 k rdk( 4d, 6s, 4d, 8s) frac k rek( 4d, 6s, 4d, 8s) frac - ------------------------------------- ----- - ------------------------------------- ----- 0 0.03603433 ryd = 3954.3100 cm-1 0.411 2 0.00372098 ryd = 408.3303 cm-1 0.706 - ------------------------------------- ----- - ------------------------------------- ----- 0 0.03603234 ryd = 3954.0923 cm-1 0.411 2 0.00372301 ryd = 408.5533 cm-1 0.705 - ------------------------------------- ----- - ------------------------------------- ----- 0 0.03603636 ryd = 3954.5328 cm-1 0.411 2 0.00371934 ryd = 408.1505 cm-1 0.706 - ------------------------------------- ----- - ------------------------------------- ----- 0 0.03603435 ryd = 3954.3125 cm-1 0.411 2 0.00372118 ryd = 408.3519 cm-1 0.706 9.00000 0.03349 2.00000 2.00000 0.00000 0.00000 -0.11965 0.00000 ag i d9 5s6s -d9 5s8s 2 0.0000 5 0.4083 5 7 9 9 0.258 0.148 135.672 sec rcn mod 32 ee,eee= -0.18687 -0.09343 ee,eee= -0.05243 -0.11965 slater integrals for ag i d9 5s6s nconf= 7 z= 47 ion= 0 exf=0.650 irel= 1 ag i d9 5s8s nconf= 9 kut=-1 corrf=0.000 class 11 k rdk( 5s, 6s, 5s, 8s) frac k rek( 5s, 6s, 5s, 8s) frac - ------------------------------------- ----- - ------------------------------------- ----- 0 0.03132609 ryd = 3437.6407 cm-1 0.377 0 0.00666200 ryd = 731.0703 cm-1 0.326 - ------------------------------------- ----- - ------------------------------------- ----- 0 0.03129449 ryd = 3434.1727 cm-1 0.377 0 0.00656553 ryd = 720.4836 cm-1 0.318 - ------------------------------------- ----- - ------------------------------------- ----- 0 0.03136088 ryd = 3441.4589 cm-1 0.378 0 0.00677375 ryd = 743.3328 cm-1 0.333 - ------------------------------------- ----- - ------------------------------------- ----- 0 0.03132768 ryd = 3437.8158 cm-1 0.378 0 0.00666964 ryd = 731.9082 cm-1 0.333 1.00000 0.00667 0.00000 0.00000 0.00000 0.00000 -0.11965 0.00000 ag i d9 5s6s -d9 5s8s 2 0.0000 5 0.7311 5 7 9 9 0.789 0.125 136.586 sec sqrtdel= 1.0000 1.0000 0.0000 0.4083 0.0000 0.7311 rcn mod 32 ee,eee= -0.18687 -0.09343 ee,eee= -0.03465 -0.11076 slater integrals for ag i d9 5s6s nconf= 7 z= 47 ion= 0 exf=0.650 irel= 1 ag i d9 5s9s nconf=10 kut=-1 corrf=0.000 class 11 k rdk( 4d, 6s, 4d, 9s) frac k rek( 4d, 6s, 4d, 9s) frac - ------------------------------------- ----- - ------------------------------------- ----- 0 0.02461631 ryd = 2701.3272 cm-1 0.390 2 0.00273554 ryd = 300.1912 cm-1 0.704 - ------------------------------------- ----- - ------------------------------------- ----- 0 0.02461472 ryd = 2701.1528 cm-1 0.390 2 0.00273717 ryd = 300.3694 cm-1 0.704 - ------------------------------------- ----- - ------------------------------------- ----- 0 0.02461793 ryd = 2701.5056 cm-1 0.390 2 0.00273428 ryd = 300.0521 cm-1 0.705 - ------------------------------------- ----- - ------------------------------------- ----- 0 0.02461632 ryd = 2701.3292 cm-1 0.390 2 0.00273572 ryd = 300.2107 cm-1 0.705 9.00000 0.02462 2.00000 2.00000 0.00000 0.00000 -0.11076 0.00000 ag i d9 5s6s -d9 5s9s 2 0.0000 5 0.3002 5 7 10 10 0.273 0.086 136.977 sec rcn mod 32 ee,eee= -0.18687 -0.09343 ee,eee= -0.03465 -0.11076 slater integrals for ag i d9 5s6s nconf= 7 z= 47 ion= 0 exf=0.650 irel= 1 ag i d9 5s9s nconf=10 kut=-1 corrf=0.000 class 11 k rdk( 5s, 6s, 5s, 9s) frac k rek( 5s, 6s, 5s, 9s) frac - ------------------------------------- ----- - ------------------------------------- ----- 0 0.02115040 ryd = 2320.9882 cm-1 0.355 0 0.00484673 ryd = 531.8675 cm-1 0.323 - ------------------------------------- ----- - ------------------------------------- ----- 0 0.02112538 ryd = 2318.2421 cm-1 0.355 0 0.00477244 ryd = 523.7151 cm-1 0.315 - ------------------------------------- ----- - ------------------------------------- ----- 0 0.02117784 ryd = 2323.9996 cm-1 0.355 0 0.00493401 ryd = 541.4454 cm-1 0.331 - ------------------------------------- ----- - ------------------------------------- ----- 0 0.02115161 ryd = 2321.1209 cm-1 0.355 0 0.00485323 ryd = 532.5803 cm-1 0.331 1.00000 0.00485 0.00000 0.00000 0.00000 0.00000 -0.11076 0.00000 ag i d9 5s6s -d9 5s9s 2 0.0000 5 0.5319 5 7 10 10 0.344 0.070 137.391 sec sqrtdel= 1.0000 1.0000 0.0000 0.3002 0.0000 0.5319 rcn mod 32 ee,eee= -1.84023 -0.92011 ee,eee= -1.02769 -1.43396 slater integrals for ag i d9 5s6s nconf= 7 z= 47 ion= 0 exf=0.650 irel= 1 ag i d8 5s2 6s nconf=11 kut=-1 corrf=0.000 class 0 k rdk( 4d, 4d, 4d, 5s) frac k rek( 4d, 4d, 4d, 5s) frac - ------------------------------------- ----- - ------------------------------------- ----- 2 -0.13164309 ryd = -14446.1583 cm-1 -0.439 2 -0.13164337 ryd = -14446.1894 cm-1 -0.439 ag i d9 5s6s -d8 5s2 6s 1 -14.4462 5 7 11 11 0.445 0.070 137.922 sec sqrtdel= 1.0000 1.0000 -14.4462 rcn mod 32 ee,eee= -0.18687 -0.09343 ee,eee= -0.11438 -0.15062 slater integrals for ag i d9 5s6s nconf= 7 z= 47 ion= 0 exf=0.650 irel= 1 ag i d10 5d nconf=12 kut=-1 corrf=0.000 class 0 k rdk( 5s, 6s, 4d, 5d) frac k rek( 5s, 6s, 4d, 5d) frac - ------------------------------------- ----- - ------------------------------------- ----- 2 0.01054234 ryd = 1156.8877 cm-1 0.687 2 -0.00237784 ryd = -260.9374 cm-1 -0.393 ag i d9 5s6s -d10 5d 2 1.1569 5 -0.2609 5 7 12 12 0.602 0.055 138.586 sec sqrtdel= 1.0000 1.0000 1.1569 -0.2609 rcn mod 32 ee,eee= -0.06361 -0.12524 slater integrals for ag i d9 5s6s nconf= 7 z= 47 ion= 0 exf=0.650 irel= 1 ag i d10 6d nconf=13 kut=-1 corrf=0.000 class 0 k rdk( 5s, 6s, 4d, 6d) frac k rek( 5s, 6s, 4d, 6d) frac - ------------------------------------- ----- - ------------------------------------- ----- 2 0.00516575 ryd = 566.8755 cm-1 0.561 2 -0.00187723 ryd = -206.0021 cm-1 -0.421 ag i d9 5s6s -d10 6d 2 0.5669 5 -0.2060 5 7 13 1 0.031 0.023 138.656 sec sqrtdel= 1.0000 1.0000 0.5669 -0.2060 rcn mod 32 ee,eee= -0.04051 -0.11369 slater integrals for ag i d9 5s6s nconf= 7 z= 47 ion= 0 exf=0.650 irel= 1 ag i d10 7d nconf=14 kut=-1 corrf=0.000 class 0 k rdk( 5s, 6s, 4d, 7d) frac k rek( 5s, 6s, 4d, 7d) frac - ------------------------------------- ----- - ------------------------------------- ----- 2 0.00320482 ryd = 351.6886 cm-1 0.498 2 -0.00144929 ryd = -159.0417 cm-1 -0.431 ag i d9 5s6s -d10 7d 2 0.3517 5 -0.1590 5 7 14 1 0.031 0.031 138.773 sec sqrtdel= 1.0000 1.0000 0.3517 -0.1590 rcn mod 32 ee,eee= -0.02805 -0.10746 slater integrals for ag i d9 5s6s nconf= 7 z= 47 ion= 0 exf=0.650 irel= 1 ag i d10 8d nconf=15 kut=-1 corrf=0.000 class 0 k rdk( 5s, 6s, 4d, 8d) frac k rek( 5s, 6s, 4d, 8d) frac - ------------------------------------- ----- - ------------------------------------- ----- 2 0.00224424 ryd = 246.2763 cm-1 0.462 2 -0.00114520 ryd = -125.6714 cm-1 -0.435 ag i d9 5s6s -d10 8d 2 0.2463 5 -0.1257 5 7 15 1 0.023 0.063 138.867 sec sqrtdel= 1.0000 1.0000 0.2463 -0.1257 rcn mod 32 ee,eee= -0.02057 -0.10372 slater integrals for ag i d9 5s6s nconf= 7 z= 47 ion= 0 exf=0.650 irel= 1 ag i d10 9d nconf=16 kut=-1 corrf=0.000 class 0 k rdk( 5s, 6s, 4d, 9d) frac k rek( 5s, 6s, 4d, 9d) frac - ------------------------------------- ----- - ------------------------------------- ----- 2 0.00168392 ryd = 184.7889 cm-1 0.439 2 -0.00093485 ryd = -102.5874 cm-1 -0.440 ag i d9 5s6s -d10 9d 2 0.1848 5 -0.1026 5 7 16 1 0.023 0.023 138.914 sec sqrtdel= 1.0000 1.0000 0.1848 -0.1026 rcn mod 32 ee,eee= -0.18687 -0.09343 ee,eee= -0.12010 -0.15349 slater integrals for ag i d9 5s6s nconf= 7 z= 47 ion= 0 exf=0.650 irel= 1 ag i d9 5s5d nconf=17 kut=-1 corrf=0.000 class 0 k rdk( 4d, 6s, 4d, 5d) frac k rek( 4d, 6s, 4d, 5d) frac - ------------------------------------- ----- - ------------------------------------- ----- 2 -0.00526256 ryd = -577.4992 cm-1 -0.371 2 0.00055263 ryd = 60.6440 cm-1 0.098 ag i d9 5s6s -d9 5s5d 2 -0.5775 5 0.0606 5 7 17 17 0.508 0.023 139.445 sec sqrtdel= 1.0000 1.0000 -0.5775 0.0606 rcn mod 32 ee,eee= -0.06554 -0.12621 slater integrals for ag i d9 5s6s nconf= 7 z= 47 ion= 0 exf=0.650 irel= 1 ag i d9 5s6d nconf=18 kut=-1 corrf=0.000 class 0 k rdk( 4d, 6s, 4d, 6d) frac k rek( 4d, 6s, 4d, 6d) frac - ------------------------------------- ----- - ------------------------------------- ----- 2 -0.00174819 ryd = -191.8422 cm-1 -0.196 2 0.00047266 ryd = 51.8688 cm-1 0.112 ag i d9 5s6s -d9 5s6d 2 -0.1918 5 0.0519 5 7 18 1 0.031 0.031 139.516 sec sqrtdel= 1.0000 1.0000 -0.1918 0.0519 rcn mod 32 ee,eee= -0.04139 -0.11413 slater integrals for ag i d9 5s6s nconf= 7 z= 47 ion= 0 exf=0.650 irel= 1 ag i d9 5s7d nconf=19 kut=-1 corrf=0.000 class 0 k rdk( 4d, 6s, 4d, 7d) frac k rek( 4d, 6s, 4d, 7d) frac - ------------------------------------- ----- - ------------------------------------- ----- 2 -0.00072184 ryd = -79.2131 cm-1 -0.114 2 0.00038369 ryd = 42.1047 cm-1 0.120 ag i d9 5s6s -d9 5s7d 2 -0.0792 5 0.0421 5 7 19 1 0.031 0.008 139.563 sec sqrtdel= 1.0000 1.0000 -0.0792 0.0421 rcn mod 32 ee,eee= -0.02853 -0.10770 slater integrals for ag i d9 5s6s nconf= 7 z= 47 ion= 0 exf=0.650 irel= 1 ag i d9 5s8d nconf=20 kut=-1 corrf=0.000 class 0 k rdk( 4d, 6s, 4d, 8d) frac k rek( 4d, 6s, 4d, 8d) frac - ------------------------------------- ----- - ------------------------------------- ----- 2 -0.00032849 ryd = -36.0474 cm-1 -0.068 2 0.00031142 ryd = 34.1740 cm-1 0.125 ag i d9 5s6s -d9 5s8d 2 -0.0360 5 0.0342 5 7 20 1 0.031 0.016 139.633 sec sqrtdel= 1.0000 1.0000 -0.0360 0.0342 rcn mod 32 ee,eee= -0.02086 -0.10386 slater integrals for ag i d9 5s6s nconf= 7 z= 47 ion= 0 exf=0.650 irel= 1 ag i d9 5s9d nconf=21 kut=-1 corrf=0.000 class 0 k rdk( 4d, 6s, 4d, 9d) frac k rek( 4d, 6s, 4d, 9d) frac - ------------------------------------- ----- - ------------------------------------- ----- 2 -0.00015172 ryd = -16.6493 cm-1 -0.040 2 0.00025675 ryd = 28.1746 cm-1 0.128 ag i d9 5s6s -d9 5s9d 2 -0.0166 5 0.0282 5 7 21 1 0.031 0.070 139.734 sec sqrtdel= 1.0000 1.0000 -0.0166 0.0282 rcn mod 32 ee,eee= -0.12522 -0.15604 slater integrals for ag i d9 5s6s nconf= 7 z= 47 ion= 0 exf=0.650 irel= 1 ag i d8 5s2 5d nconf=22 kut=-1 corrf=0.000 class 0 k rdk( 4d, 6s, 5s, 5d) frac k rek( 4d, 6s, 5s, 5d) frac - ------------------------------------- ----- - ------------------------------------- ----- 2 0.00983849 ryd = 1079.6493 cm-1 0.628 0 0.00712815 ryd = 782.2236 cm-1 0.336 ag i d9 5s6s -d8 5s2 5d 2 1.0796 5 0.7822 5 7 22 1 0.031 0.047 139.813 sec sqrtdel= 1.0000 1.0000 1.0796 0.7822 rcn mod 32 ee,eee= -0.04004 -0.11346 slater integrals for ag i d9 5s6s nconf= 7 z= 47 ion= 0 exf=0.650 irel= 1 ag i d9 5s5g nconf=28 kut=-1 corrf=0.000 class 0 k rdk( 4d, 6s, 4d, 5g) frac k rek( 4d, 6s, 4d, 5g) frac - ------------------------------------- ----- - ------------------------------------- ----- 4 -0.00002803 ryd = -3.0761 cm-1 -0.648 2 0.00000972 ryd = 1.0665 cm-1 0.759 ag i d9 5s6s -d9 5s5g 2 -0.0031 5 0.0011 5 7 28 6 0.148 0.016 140.000 sec sqrtdel= 1.0000 1.0000 -0.0031 0.0011 rcn mod 32 ee,eee= -0.02782 -0.10735 slater integrals for ag i d9 5s6s nconf= 7 z= 47 ion= 0 exf=0.650 irel= 1 ag i d9 5s6g nconf=29 kut=-1 corrf=0.000 class 0 k rdk( 4d, 6s, 4d, 6g) frac k rek( 4d, 6s, 4d, 6g) frac - ------------------------------------- ----- - ------------------------------------- ----- 4 -0.00002760 ryd = -3.0285 cm-1 -0.624 2 0.00001053 ryd = 1.1560 cm-1 0.761 ag i d9 5s6s -d9 5s6g 2 -0.0030 5 0.0012 5 7 29 1 0.031 0.086 140.133 sec sqrtdel= 1.0000 1.0000 -0.0030 0.0012 rcn mod 32 ee,eee= -0.02044 -0.10365 slater integrals for ag i d9 5s6s nconf= 7 z= 47 ion= 0 exf=0.650 irel= 1 ag i d9 5s7g nconf=30 kut=-1 corrf=0.000 class 0 k rdk( 4d, 6s, 4d, 7g) frac k rek( 4d, 6s, 4d, 7g) frac - ------------------------------------- ----- - ------------------------------------- ----- 4 -0.00002458 ryd = -2.6972 cm-1 -0.610 2 0.00000993 ryd = 1.0902 cm-1 0.762 ag i d9 5s6s -d9 5s7g 2 -0.0027 5 0.0011 5 7 30 1 0.031 0.031 140.203 sec sqrtdel= 1.0000 1.0000 -0.0027 0.0011 rcn mod 32 ee,eee= -0.01565 -0.10126 slater integrals for ag i d9 5s6s nconf= 7 z= 47 ion= 0 exf=0.650 irel= 1 ag i d9 5s8g nconf=31 kut=-1 corrf=0.000 class 0 k rdk( 4d, 6s, 4d, 8g) frac k rek( 4d, 6s, 4d, 8g) frac - ------------------------------------- ----- - ------------------------------------- ----- 4 -0.00002145 ryd = -2.3541 cm-1 -0.600 2 0.00000901 ryd = 0.9884 cm-1 0.763 ag i d9 5s6s -d9 5s8g 2 -0.0024 5 0.0010 5 7 31 1 0.031 0.023 140.266 sec sqrtdel= 1.0000 1.0000 -0.0024 0.0010 rcn mod 32 ee,eee= -0.01236 -0.09962 slater integrals for ag i d9 5s6s nconf= 7 z= 47 ion= 0 exf=0.650 irel= 1 ag i d9 5s9g nconf=32 kut=-1 corrf=0.000 class 0 k rdk( 4d, 6s, 4d, 9g) frac k rek( 4d, 6s, 4d, 9g) frac - ------------------------------------- ----- - ------------------------------------- ----- 4 -0.00001871 ryd = -2.0537 cm-1 -0.593 2 0.00000807 ryd = 0.8859 cm-1 0.763 ag i d9 5s6s -d9 5s9g 2 -0.0021 5 0.0009 5 7 32 1 0.031 0.047 140.344 sec sqrtdel= 1.0000 1.0000 -0.0021 0.0009 rcn mod 32 ee,eee= -0.18687 -0.09343 ee,eee= -0.38785 -0.28736 slater integrals for ag i d9 5s6s nconf= 7 z= 47 ion= 0 exf=0.650 irel= 1 ag i d9 5p2 nconf=41 kut=-1 corrf=0.000 class 0 k rdk( 5s, 6s, 5p, 5p) frac k rek( 5s, 6s, 5p, 5p) frac - ------------------------------------- ----- - ------------------------------------- ----- 1 -0.00972448 ryd = -1067.1382 cm-1 -0.089 1 -0.00972448 ryd = -1067.1382 cm-1 -0.089 ag i d9 5s6s -d9 5p2 1 -1.0671 5 7 41 41 1.781 0.031 142.242 sec sqrtdel= 1.0000 1.0000 -1.0671 rcn mod 32 ee,eee= -0.08885 -0.04442 ee,eee= -0.05243 -0.07064 slater integrals for ag i d9 5s7s nconf= 8 z= 47 ion= 0 exf=0.650 irel= 1 ag i d9 5s8s nconf= 9 kut=-1 corrf=0.000 class 11 k rdk( 4d, 7s, 4d, 8s) frac k rek( 4d, 7s, 4d, 8s) frac - ------------------------------------- ----- - ------------------------------------- ----- 0 0.04042503 ryd = 4436.1341 cm-1 0.470 2 0.00216144 ryd = 237.1903 cm-1 0.701 - ------------------------------------- ----- - ------------------------------------- ----- 0 0.04042477 ryd = 4436.1059 cm-1 0.470 2 0.00216166 ryd = 237.2152 cm-1 0.701 - ------------------------------------- ----- - ------------------------------------- ----- 0 0.04042529 ryd = 4436.1627 cm-1 0.470 2 0.00216122 ryd = 237.1668 cm-1 0.701 - ------------------------------------- ----- - ------------------------------------- ----- 0 0.04042503 ryd = 4436.1343 cm-1 0.470 2 0.00216144 ryd = 237.1910 cm-1 0.701 9.00000 0.01945 2.00000 2.00000 0.00000 0.00000 -0.07064 0.00000 ag i d9 5s7s -d9 5s8s 2 0.0000 5 0.2372 5 8 9 9 0.266 0.047 142.563 sec rcn mod 32 ee,eee= -0.08885 -0.04442 ee,eee= -0.05243 -0.07064 slater integrals for ag i d9 5s7s nconf= 8 z= 47 ion= 0 exf=0.650 irel= 1 ag i d9 5s8s nconf= 9 kut=-1 corrf=0.000 class 11 k rdk( 5s, 7s, 5s, 8s) frac k rek( 5s, 7s, 5s, 8s) frac - ------------------------------------- ----- - ------------------------------------- ----- 0 0.03767733 ryd = 4134.6092 cm-1 0.452 0 0.00371082 ryd = 407.2152 cm-1 0.315 - ------------------------------------- ----- - ------------------------------------- ----- 0 0.03767334 ryd = 4134.1711 cm-1 0.452 0 0.00369922 ryd = 405.9428 cm-1 0.314 - ------------------------------------- ----- - ------------------------------------- ----- 0 0.03768152 ryd = 4135.0689 cm-1 0.452 0 0.00372288 ryd = 408.5384 cm-1 0.317 - ------------------------------------- ----- - ------------------------------------- ----- 0 0.03767743 ryd = 4134.6200 cm-1 0.452 0 0.00371105 ryd = 407.2406 cm-1 0.317 1.00000 0.00371 0.00000 0.00000 0.00000 0.00000 -0.07064 0.00000 ag i d9 5s7s -d9 5s8s 2 0.0000 5 0.4072 5 8 9 9 0.352 0.336 143.250 sec sqrtdel= 1.0000 1.0000 0.0000 0.2372 0.0000 0.4072 rcn mod 32 ee,eee= -0.08885 -0.04442 ee,eee= -0.03465 -0.06175 slater integrals for ag i d9 5s7s nconf= 8 z= 47 ion= 0 exf=0.650 irel= 1 ag i d9 5s9s nconf=10 kut=-1 corrf=0.000 class 11 k rdk( 4d, 7s, 4d, 9s) frac k rek( 4d, 7s, 4d, 9s) frac - ------------------------------------- ----- - ------------------------------------- ----- 0 0.02473538 ryd = 2714.3944 cm-1 0.420 2 0.00158933 ryd = 174.4083 cm-1 0.700 - ------------------------------------- ----- - ------------------------------------- ----- 0 0.02473512 ryd = 2714.3653 cm-1 0.420 2 0.00158956 ryd = 174.4340 cm-1 0.700 - ------------------------------------- ----- - ------------------------------------- ----- 0 0.02473565 ryd = 2714.4238 cm-1 0.420 2 0.00158911 ryd = 174.3849 cm-1 0.700 - ------------------------------------- ----- - ------------------------------------- ----- 0 0.02473538 ryd = 2714.3946 cm-1 0.420 2 0.00158934 ryd = 174.4094 cm-1 0.700 9.00000 0.01430 2.00000 2.00000 0.00000 0.00000 -0.06175 0.00000 ag i d9 5s7s -d9 5s9s 2 0.0000 5 0.1744 5 8 10 10 0.422 0.172 143.867 sec rcn mod 32 ee,eee= -0.08885 -0.04442 ee,eee= -0.03465 -0.06175 slater integrals for ag i d9 5s7s nconf= 8 z= 47 ion= 0 exf=0.650 irel= 1 ag i d9 5s9s nconf=10 kut=-1 corrf=0.000 class 11 k rdk( 5s, 7s, 5s, 9s) frac k rek( 5s, 7s, 5s, 9s) frac - ------------------------------------- ----- - ------------------------------------- ----- 0 0.02271213 ryd = 2492.3680 cm-1 0.400 0 0.00270200 ryd = 296.5099 cm-1 0.312 - ------------------------------------- ----- - ------------------------------------- ----- 0 0.02270815 ryd = 2491.9311 cm-1 0.400 0 0.00269072 ryd = 295.2728 cm-1 0.310 - ------------------------------------- ----- - ------------------------------------- ----- 0 0.02271632 ryd = 2492.8281 cm-1 0.400 0 0.00271393 ryd = 297.8188 cm-1 0.314 - ------------------------------------- ----- - ------------------------------------- ----- 0 0.02271224 ryd = 2492.3796 cm-1 0.400 0 0.00270232 ryd = 296.5458 cm-1 0.314 1.00000 0.00270 0.00000 0.00000 0.00000 0.00000 -0.06175 0.00000 ag i d9 5s7s -d9 5s9s 2 0.0000 5 0.2965 5 8 10 10 0.289 0.070 144.227 sec sqrtdel= 1.0000 1.0000 0.0000 0.1744 0.0000 0.2965 rcn mod 32 ee,eee= -1.96077 -0.98039 ee,eee= -1.02769 -1.49423 slater integrals for ag i d9 5s7s nconf= 8 z= 47 ion= 0 exf=0.650 irel= 1 ag i d8 5s2 6s nconf=11 kut=-1 corrf=0.000 class 0 k rdk( 4d, 4d, 4d, 5s) frac k rek( 4d, 4d, 4d, 5s) frac - ------------------------------------- ----- - ------------------------------------- ----- 2 0.00000000 ryd = 0.0000 cm-1 0.000 2 0.00000000 ryd = 0.0000 cm-1 0.000 ag i d9 5s7s -d8 5s2 6s 1 0.0000 5 8 11 11 0.320 0.008 144.563 sec sqrtdel= 1.0000 1.0000 0.0000 rcn mod 32 ee,eee= -0.08885 -0.04442 ee,eee= -0.11438 -0.10161 slater integrals for ag i d9 5s7s nconf= 8 z= 47 ion= 0 exf=0.650 irel= 1 ag i d10 5d nconf=12 kut=-1 corrf=0.000 class 0 k rdk( 5s, 7s, 4d, 5d) frac k rek( 5s, 7s, 4d, 5d) frac - ------------------------------------- ----- - ------------------------------------- ----- 2 0.00380793 ryd = 417.8723 cm-1 0.473 2 -0.00121956 ryd = -133.8316 cm-1 -0.349 ag i d9 5s7s -d10 5d 2 0.4179 5 -0.1338 5 8 12 12 0.344 0.023 145.094 sec sqrtdel= 1.0000 1.0000 0.4179 -0.1338 rcn mod 32 ee,eee= -0.06361 -0.07623 slater integrals for ag i d9 5s7s nconf= 8 z= 47 ion= 0 exf=0.650 irel= 1 ag i d10 6d nconf=13 kut=-1 corrf=0.000 class 0 k rdk( 5s, 7s, 4d, 6d) frac k rek( 5s, 7s, 4d, 6d) frac - ------------------------------------- ----- - ------------------------------------- ----- 2 0.00345376 ryd = 379.0068 cm-1 0.635 2 -0.00097266 ryd = -106.7371 cm-1 -0.377 ag i d9 5s7s -d10 6d 2 0.3790 5 -0.1067 5 8 13 1 0.023 0.016 145.141 sec sqrtdel= 1.0000 1.0000 0.3790 -0.1067 rcn mod 32 ee,eee= -0.04051 -0.06468 slater integrals for ag i d9 5s7s nconf= 8 z= 47 ion= 0 exf=0.650 irel= 1 ag i d10 7d nconf=14 kut=-1 corrf=0.000 class 0 k rdk( 5s, 7s, 4d, 7d) frac k rek( 5s, 7s, 4d, 7d) frac - ------------------------------------- ----- - ------------------------------------- ----- 2 0.00231174 ryd = 253.6847 cm-1 0.598 2 -0.00075380 ryd = -82.7200 cm-1 -0.387 ag i d9 5s7s -d10 7d 2 0.2537 5 -0.0827 5 8 14 1 0.023 0.047 145.227 sec sqrtdel= 1.0000 1.0000 0.2537 -0.0827 rcn mod 32 ee,eee= -0.02805 -0.05845 slater integrals for ag i d9 5s7s nconf= 8 z= 47 ion= 0 exf=0.650 irel= 1 ag i d10 8d nconf=15 kut=-1 corrf=0.000 class 0 k rdk( 5s, 7s, 4d, 8d) frac k rek( 5s, 7s, 4d, 8d) frac - ------------------------------------- ----- - ------------------------------------- ----- 2 0.00167978 ryd = 184.3343 cm-1 0.573 2 -0.00059666 ryd = -65.4761 cm-1 -0.392 ag i d9 5s7s -d10 8d 2 0.1843 5 -0.0655 5 8 15 1 0.023 0.023 145.273 sec sqrtdel= 1.0000 1.0000 0.1843 -0.0655 rcn mod 32 ee,eee= -0.02057 -0.05471 slater integrals for ag i d9 5s7s nconf= 8 z= 47 ion= 0 exf=0.650 irel= 1 ag i d10 9d nconf=16 kut=-1 corrf=0.000 class 0 k rdk( 5s, 7s, 4d, 9d) frac k rek( 5s, 7s, 4d, 9d) frac - ------------------------------------- ----- - ------------------------------------- ----- 2 0.00129039 ryd = 141.6041 cm-1 0.556 2 -0.00048777 ryd = -53.5263 cm-1 -0.396 ag i d9 5s7s -d10 9d 2 0.1416 5 -0.0535 5 8 16 1 0.031 0.031 145.344 sec sqrtdel= 1.0000 1.0000 0.1416 -0.0535 rcn mod 32 ee,eee= -0.08885 -0.04442 ee,eee= -0.12010 -0.10448 slater integrals for ag i d9 5s7s nconf= 8 z= 47 ion= 0 exf=0.650 irel= 1 ag i d9 5s5d nconf=17 kut=-1 corrf=0.000 class 0 k rdk( 4d, 7s, 4d, 5d) frac k rek( 4d, 7s, 4d, 5d) frac - ------------------------------------- ----- - ------------------------------------- ----- 2 -0.00160705 ryd = -176.3528 cm-1 -0.210 2 0.00027898 ryd = 30.6146 cm-1 0.085 ag i d9 5s7s -d9 5s5d 2 -0.1764 5 0.0306 5 8 17 17 0.828 0.023 146.195 sec sqrtdel= 1.0000 1.0000 -0.1764 0.0306 rcn mod 32 ee,eee= -0.06554 -0.07720 slater integrals for ag i d9 5s7s nconf= 8 z= 47 ion= 0 exf=0.650 irel= 1 ag i d9 5s6d nconf=18 kut=-1 corrf=0.000 class 0 k rdk( 4d, 7s, 4d, 6d) frac k rek( 4d, 7s, 4d, 6d) frac - ------------------------------------- ----- - ------------------------------------- ----- 2 -0.00153064 ryd = -167.9680 cm-1 -0.287 2 0.00024328 ryd = 26.6970 cm-1 0.098 ag i d9 5s7s -d9 5s6d 2 -0.1680 5 0.0267 5 8 18 1 0.031 0.086 146.320 sec sqrtdel= 1.0000 1.0000 -0.1680 0.0267 rcn mod 32 ee,eee= -0.04139 -0.06512 slater integrals for ag i d9 5s7s nconf= 8 z= 47 ion= 0 exf=0.650 irel= 1 ag i d9 5s7d nconf=19 kut=-1 corrf=0.000 class 0 k rdk( 4d, 7s, 4d, 7d) frac k rek( 4d, 7s, 4d, 7d) frac - ------------------------------------- ----- - ------------------------------------- ----- 2 -0.00086489 ryd = -94.9108 cm-1 -0.227 2 0.00019933 ryd = 21.8742 cm-1 0.107 ag i d9 5s7s -d9 5s7d 2 -0.0949 5 0.0219 5 8 19 1 0.031 0.047 146.414 sec sqrtdel= 1.0000 1.0000 -0.0949 0.0219 rcn mod 32 ee,eee= -0.02853 -0.05869 slater integrals for ag i d9 5s7s nconf= 8 z= 47 ion= 0 exf=0.650 irel= 1 ag i d9 5s8d nconf=20 kut=-1 corrf=0.000 class 0 k rdk( 4d, 7s, 4d, 8d) frac k rek( 4d, 7s, 4d, 8d) frac - ------------------------------------- ----- - ------------------------------------- ----- 2 -0.00054878 ryd = -60.2219 cm-1 -0.189 2 0.00016254 ryd = 17.8363 cm-1 0.112 ag i d9 5s7s -d9 5s8d 2 -0.0602 5 0.0178 5 8 20 1 0.055 0.023 146.523 sec sqrtdel= 1.0000 1.0000 -0.0602 0.0178 rcn mod 32 ee,eee= -0.02086 -0.05485 slater integrals for ag i d9 5s7s nconf= 8 z= 47 ion= 0 exf=0.650 irel= 1 ag i d9 5s9d nconf=21 kut=-1 corrf=0.000 class 0 k rdk( 4d, 7s, 4d, 9d) frac k rek( 4d, 7s, 4d, 9d) frac - ------------------------------------- ----- - ------------------------------------- ----- 2 -0.00037912 ryd = -41.6040 cm-1 -0.165 2 0.00013436 ryd = 14.7445 cm-1 0.114 ag i d9 5s7s -d9 5s9d 2 -0.0416 5 0.0147 5 8 21 1 0.047 0.055 146.625 sec sqrtdel= 1.0000 1.0000 -0.0416 0.0147 rcn mod 32 ee,eee= -0.12522 -0.10703 slater integrals for ag i d9 5s7s nconf= 8 z= 47 ion= 0 exf=0.650 irel= 1 ag i d8 5s2 5d nconf=22 kut=-1 corrf=0.000 class 0 k rdk( 4d, 7s, 5s, 5d) frac k rek( 4d, 7s, 5s, 5d) frac - ------------------------------------- ----- - ------------------------------------- ----- 2 0.00380943 ryd = 418.0371 cm-1 0.459 0 0.00402263 ryd = 441.4323 cm-1 0.327 ag i d9 5s7s -d8 5s2 5d 2 0.4180 5 0.4414 5 8 22 1 0.070 0.016 146.711 sec sqrtdel= 1.0000 1.0000 0.4180 0.4414 rcn mod 32 ee,eee= -0.04004 -0.06445 slater integrals for ag i d9 5s7s nconf= 8 z= 47 ion= 0 exf=0.650 irel= 1 ag i d9 5s5g nconf=28 kut=-1 corrf=0.000 class 0 k rdk( 4d, 7s, 4d, 5g) frac k rek( 4d, 7s, 4d, 5g) frac - ------------------------------------- ----- - ------------------------------------- ----- 4 -0.00000207 ryd = -0.2268 cm-1 -0.085 2 0.00000537 ryd = 0.5896 cm-1 0.727 ag i d9 5s7s -d9 5s5g 2 -0.0002 5 0.0006 5 8 28 6 0.164 0.031 146.922 sec sqrtdel= 1.0000 1.0000 -0.0002 0.0006 rcn mod 32 ee,eee= -0.02782 -0.05833 slater integrals for ag i d9 5s7s nconf= 8 z= 47 ion= 0 exf=0.650 irel= 1 ag i d9 5s6g nconf=29 kut=-1 corrf=0.000 class 0 k rdk( 4d, 7s, 4d, 6g) frac k rek( 4d, 7s, 4d, 6g) frac - ------------------------------------- ----- - ------------------------------------- ----- 4 -0.00000344 ryd = -0.3776 cm-1 -0.143 2 0.00000583 ryd = 0.6396 cm-1 0.729 ag i d9 5s7s -d9 5s6g 2 -0.0004 5 0.0006 5 8 29 1 0.031 0.023 146.977 sec sqrtdel= 1.0000 1.0000 -0.0004 0.0006 rcn mod 32 ee,eee= -0.02044 -0.05464 slater integrals for ag i d9 5s7s nconf= 8 z= 47 ion= 0 exf=0.650 irel= 1 ag i d9 5s7g nconf=30 kut=-1 corrf=0.000 class 0 k rdk( 4d, 7s, 4d, 7g) frac k rek( 4d, 7s, 4d, 7g) frac - ------------------------------------- ----- - ------------------------------------- ----- 4 -0.00000372 ryd = -0.4087 cm-1 -0.173 2 0.00000550 ryd = 0.6035 cm-1 0.731 ag i d9 5s7s -d9 5s7g 2 -0.0004 5 0.0006 5 8 30 1 0.031 0.016 147.031 sec sqrtdel= 1.0000 1.0000 -0.0004 0.0006 rcn mod 32 ee,eee= -0.01565 -0.05225 slater integrals for ag i d9 5s7s nconf= 8 z= 47 ion= 0 exf=0.650 irel= 1 ag i d9 5s8g nconf=31 kut=-1 corrf=0.000 class 0 k rdk( 4d, 7s, 4d, 8g) frac k rek( 4d, 7s, 4d, 8g) frac - ------------------------------------- ----- - ------------------------------------- ----- 4 -0.00000360 ryd = -0.3946 cm-1 -0.191 2 0.00000499 ryd = 0.5473 cm-1 0.732 ag i d9 5s7s -d9 5s8g 2 -0.0004 5 0.0005 5 8 31 1 0.031 0.008 147.094 sec sqrtdel= 1.0000 1.0000 -0.0004 0.0005 rcn mod 32 ee,eee= -0.01236 -0.05060 slater integrals for ag i d9 5s7s nconf= 8 z= 47 ion= 0 exf=0.650 irel= 1 ag i d9 5s9g nconf=32 kut=-1 corrf=0.000 class 0 k rdk( 4d, 7s, 4d, 9g) frac k rek( 4d, 7s, 4d, 9g) frac - ------------------------------------- ----- - ------------------------------------- ----- 4 -0.00000333 ryd = -0.3659 cm-1 -0.201 2 0.00000447 ryd = 0.4906 cm-1 0.732 ag i d9 5s7s -d9 5s9g 2 -0.0004 5 0.0005 5 8 32 1 0.023 0.039 147.164 sec sqrtdel= 1.0000 1.0000 -0.0004 0.0005 rcn mod 32 ee,eee= -0.08885 -0.04442 ee,eee= -0.38785 -0.23835 slater integrals for ag i d9 5s7s nconf= 8 z= 47 ion= 0 exf=0.650 irel= 1 ag i d9 5p2 nconf=41 kut=-1 corrf=0.000 class 0 k rdk( 5s, 7s, 5p, 5p) frac k rek( 5s, 7s, 5p, 5p) frac - ------------------------------------- ----- - ------------------------------------- ----- 1 -0.00524472 ryd = -575.5415 cm-1 -0.086 1 -0.00524472 ryd = -575.5415 cm-1 -0.086 ag i d9 5s7s -d9 5p2 1 -0.5755 5 8 41 41 1.352 0.070 148.617 sec sqrtdel= 1.0000 1.0000 -0.5755 rcn mod 32 ee,eee= -0.05243 -0.02622 ee,eee= -0.03465 -0.04354 slater integrals for ag i d9 5s8s nconf= 9 z= 47 ion= 0 exf=0.650 irel= 1 ag i d9 5s9s nconf=10 kut=-1 corrf=0.000 class 11 k rdk( 4d, 8s, 4d, 9s) frac k rek( 4d, 8s, 4d, 9s) frac - ------------------------------------- ----- - ------------------------------------- ----- 0 0.02779717 ryd = 3050.3863 cm-1 0.477 2 0.00107599 ryd = 118.0759 cm-1 0.698 - ------------------------------------- ----- - ------------------------------------- ----- 0 0.02779712 ryd = 3050.3807 cm-1 0.477 2 0.00107603 ryd = 118.0806 cm-1 0.698 - ------------------------------------- ----- - ------------------------------------- ----- 0 0.02779722 ryd = 3050.3920 cm-1 0.477 2 0.00107595 ryd = 118.0714 cm-1 0.698 - ------------------------------------- ----- - ------------------------------------- ----- 0 0.02779717 ryd = 3050.3864 cm-1 0.477 2 0.00107599 ryd = 118.0760 cm-1 0.698 9.00000 0.00968 2.00000 2.00000 0.00000 0.00000 -0.04354 0.00000 ag i d9 5s8s -d9 5s9s 2 0.0000 5 0.1181 5 9 10 10 0.570 0.203 149.406 sec rcn mod 32 ee,eee= -0.05243 -0.02622 ee,eee= -0.03465 -0.04354 slater integrals for ag i d9 5s8s nconf= 9 z= 47 ion= 0 exf=0.650 irel= 1 ag i d9 5s9s nconf=10 kut=-1 corrf=0.000 class 11 k rdk( 5s, 8s, 5s, 9s) frac k rek( 5s, 8s, 5s, 9s) frac - ------------------------------------- ----- - ------------------------------------- ----- 0 0.02642404 ryd = 2899.7028 cm-1 0.464 0 0.00179704 ryd = 197.2027 cm-1 0.308 - ------------------------------------- ----- - ------------------------------------- ----- 0 0.02642331 ryd = 2899.6235 cm-1 0.464 0 0.00179506 ryd = 196.9849 cm-1 0.307 - ------------------------------------- ----- - ------------------------------------- ----- 0 0.02642478 ryd = 2899.7840 cm-1 0.464 0 0.00179906 ryd = 197.4243 cm-1 0.308 - ------------------------------------- ----- - ------------------------------------- ----- 0 0.02642405 ryd = 2899.7037 cm-1 0.464 0 0.00179706 ryd = 197.2046 cm-1 0.308 1.00000 0.00180 0.00000 0.00000 0.00000 0.00000 -0.04354 0.00000 ag i d9 5s8s -d9 5s9s 2 0.0000 5 0.1972 5 9 10 10 0.445 0.109 149.961 sec sqrtdel= 1.0000 1.0000 0.0000 0.1181 0.0000 0.1972 rcn mod 32 ee,eee= -2.01415 -1.00708 ee,eee= -1.02769 -1.52092 slater integrals for ag i d9 5s8s nconf= 9 z= 47 ion= 0 exf=0.650 irel= 1 ag i d8 5s2 6s nconf=11 kut=-1 corrf=0.000 class 0 k rdk( 4d, 4d, 4d, 5s) frac k rek( 4d, 4d, 4d, 5s) frac - ------------------------------------- ----- - ------------------------------------- ----- 2 0.00000000 ryd = 0.0000 cm-1 0.000 2 0.00000000 ryd = 0.0000 cm-1 0.000 ag i d9 5s8s -d8 5s2 6s 1 0.0000 5 9 11 11 0.688 0.031 150.703 sec sqrtdel= 1.0000 1.0000 0.0000 rcn mod 32 ee,eee= -0.05243 -0.02622 ee,eee= -0.11438 -0.08340 slater integrals for ag i d9 5s8s nconf= 9 z= 47 ion= 0 exf=0.650 irel= 1 ag i d10 5d nconf=12 kut=-1 corrf=0.000 class 0 k rdk( 5s, 8s, 4d, 5d) frac k rek( 5s, 8s, 4d, 5d) frac - ------------------------------------- ----- - ------------------------------------- ----- 2 0.00237435 ryd = 260.5551 cm-1 0.449 2 -0.00078552 ryd = -86.2007 cm-1 -0.332 ag i d9 5s8s -d10 5d 2 0.2606 5 -0.0862 5 9 12 12 0.383 0.016 151.102 sec sqrtdel= 1.0000 1.0000 0.2606 -0.0862 rcn mod 32 ee,eee= -0.06361 -0.05802 slater integrals for ag i d9 5s8s nconf= 9 z= 47 ion= 0 exf=0.650 irel= 1 ag i d10 6d nconf=13 kut=-1 corrf=0.000 class 0 k rdk( 5s, 8s, 4d, 6d) frac k rek( 5s, 8s, 4d, 6d) frac - ------------------------------------- ----- - ------------------------------------- ----- 2 0.00183595 ryd = 201.4717 cm-1 0.524 2 -0.00062908 ryd = -69.0337 cm-1 -0.360 ag i d9 5s8s -d10 6d 2 0.2015 5 -0.0690 5 9 13 1 0.023 0.023 151.164 sec sqrtdel= 1.0000 1.0000 0.2015 -0.0690 rcn mod 32 ee,eee= -0.04051 -0.04647 slater integrals for ag i d9 5s8s nconf= 9 z= 47 ion= 0 exf=0.650 irel= 1 ag i d10 7d nconf=14 kut=-1 corrf=0.000 class 0 k rdk( 5s, 8s, 4d, 7d) frac k rek( 5s, 8s, 4d, 7d) frac - ------------------------------------- ----- - ------------------------------------- ----- 2 0.00155773 ryd = 170.9411 cm-1 0.608 2 -0.00048827 ryd = -53.5817 cm-1 -0.371 ag i d9 5s8s -d10 7d 2 0.1709 5 -0.0536 5 9 14 1 0.031 0.031 151.227 sec sqrtdel= 1.0000 1.0000 0.1709 -0.0536 rcn mod 32 ee,eee= -0.02805 -0.04024 slater integrals for ag i d9 5s8s nconf= 9 z= 47 ion= 0 exf=0.650 irel= 1 ag i d10 8d nconf=15 kut=-1 corrf=0.000 class 0 k rdk( 5s, 8s, 4d, 8d) frac k rek( 5s, 8s, 4d, 8d) frac - ------------------------------------- ----- - ------------------------------------- ----- 2 0.00116994 ryd = 128.3862 cm-1 0.597 2 -0.00038675 ryd = -42.4408 cm-1 -0.375 ag i d9 5s8s -d10 8d 2 0.1284 5 -0.0424 5 9 15 1 0.023 0.023 151.273 sec sqrtdel= 1.0000 1.0000 0.1284 -0.0424 rcn mod 32 ee,eee= -0.02057 -0.03650 slater integrals for ag i d9 5s8s nconf= 9 z= 47 ion= 0 exf=0.650 irel= 1 ag i d10 9d nconf=16 kut=-1 corrf=0.000 class 0 k rdk( 5s, 8s, 4d, 9d) frac k rek( 5s, 8s, 4d, 9d) frac - ------------------------------------- ----- - ------------------------------------- ----- 2 0.00091286 ryd = 100.1753 cm-1 0.585 2 -0.00031635 ryd = -34.7150 cm-1 -0.380 ag i d9 5s8s -d10 9d 2 0.1002 5 -0.0347 5 9 16 1 0.031 0.078 151.391 sec sqrtdel= 1.0000 1.0000 0.1002 -0.0347 rcn mod 32 ee,eee= -0.05243 -0.02622 ee,eee= -0.12010 -0.08627 slater integrals for ag i d9 5s8s nconf= 9 z= 47 ion= 0 exf=0.650 irel= 1 ag i d9 5s5d nconf=17 kut=-1 corrf=0.000 class 0 k rdk( 4d, 8s, 4d, 5d) frac k rek( 4d, 8s, 4d, 5d) frac - ------------------------------------- ----- - ------------------------------------- ----- 2 -0.00096314 ryd = -105.6924 cm-1 -0.190 2 0.00017785 ryd = 19.5170 cm-1 0.079 ag i d9 5s8s -d9 5s5d 2 -0.1057 5 0.0195 5 9 17 17 0.492 0.031 151.914 sec sqrtdel= 1.0000 1.0000 -0.1057 0.0195 rcn mod 32 ee,eee= -0.06554 -0.05899 slater integrals for ag i d9 5s8s nconf= 9 z= 47 ion= 0 exf=0.650 irel= 1 ag i d9 5s6d nconf=18 kut=-1 corrf=0.000 class 0 k rdk( 4d, 8s, 4d, 6d) frac k rek( 4d, 8s, 4d, 6d) frac - ------------------------------------- ----- - ------------------------------------- ----- 2 -0.00072687 ryd = -79.7649 cm-1 -0.209 2 0.00015649 ryd = 17.1727 cm-1 0.093 ag i d9 5s8s -d9 5s6d 2 -0.0798 5 0.0172 5 9 18 1 0.031 0.039 151.984 sec sqrtdel= 1.0000 1.0000 -0.0798 0.0172 rcn mod 32 ee,eee= -0.04139 -0.04691 slater integrals for ag i d9 5s8s nconf= 9 z= 47 ion= 0 exf=0.650 irel= 1 ag i d9 5s7d nconf=19 kut=-1 corrf=0.000 class 0 k rdk( 4d, 8s, 4d, 7d) frac k rek( 4d, 8s, 4d, 7d) frac - ------------------------------------- ----- - ------------------------------------- ----- 2 -0.00063108 ryd = -69.2526 cm-1 -0.246 2 0.00012876 ryd = 14.1300 cm-1 0.102 ag i d9 5s8s -d9 5s7d 2 -0.0693 5 0.0141 5 9 19 1 0.055 0.031 152.086 sec sqrtdel= 1.0000 1.0000 -0.0693 0.0141 rcn mod 32 ee,eee= -0.02853 -0.04048 slater integrals for ag i d9 5s8s nconf= 9 z= 47 ion= 0 exf=0.650 irel= 1 ag i d9 5s8d nconf=20 kut=-1 corrf=0.000 class 0 k rdk( 4d, 8s, 4d, 8d) frac k rek( 4d, 8s, 4d, 8d) frac - ------------------------------------- ----- - ------------------------------------- ----- 2 -0.00043102 ryd = -47.2986 cm-1 -0.219 2 0.00010521 ryd = 11.5456 cm-1 0.106 ag i d9 5s8s -d9 5s8d 2 -0.0473 5 0.0115 5 9 20 1 0.039 0.047 152.180 sec sqrtdel= 1.0000 1.0000 -0.0473 0.0115 rcn mod 32 ee,eee= -0.02086 -0.03665 slater integrals for ag i d9 5s8s nconf= 9 z= 47 ion= 0 exf=0.650 irel= 1 ag i d9 5s9d nconf=21 kut=-1 corrf=0.000 class 0 k rdk( 4d, 8s, 4d, 9d) frac k rek( 4d, 8s, 4d, 9d) frac - ------------------------------------- ----- - ------------------------------------- ----- 2 -0.00031230 ryd = -34.2710 cm-1 -0.200 2 0.00008708 ryd = 9.5557 cm-1 0.109 ag i d9 5s8s -d9 5s9d 2 -0.0343 5 0.0096 5 9 21 1 0.070 0.031 152.281 sec sqrtdel= 1.0000 1.0000 -0.0343 0.0096 rcn mod 32 ee,eee= -0.12522 -0.08882 slater integrals for ag i d9 5s8s nconf= 9 z= 47 ion= 0 exf=0.650 irel= 1 ag i d8 5s2 5d nconf=22 kut=-1 corrf=0.000 class 0 k rdk( 4d, 8s, 5s, 5d) frac k rek( 4d, 8s, 5s, 5d) frac - ------------------------------------- ----- - ------------------------------------- ----- 2 0.00240693 ryd = 264.1299 cm-1 0.440 0 0.00269351 ryd = 295.5782 cm-1 0.324 ag i d9 5s8s -d8 5s2 5d 2 0.2641 5 0.2956 5 9 22 1 0.023 0.016 152.336 sec sqrtdel= 1.0000 1.0000 0.2641 0.2956 rcn mod 32 ee,eee= -0.04004 -0.04624 slater integrals for ag i d9 5s8s nconf= 9 z= 47 ion= 0 exf=0.650 irel= 1 ag i d9 5s5g nconf=28 kut=-1 corrf=0.000 class 0 k rdk( 4d, 8s, 4d, 5g) frac k rek( 4d, 8s, 4d, 5g) frac - ------------------------------------- ----- - ------------------------------------- ----- 4 -0.00000219 ryd = -0.2403 cm-1 -0.140 2 0.00000357 ryd = 0.3917 cm-1 0.715 ag i d9 5s8s -d9 5s5g 2 -0.0002 5 0.0004 5 9 28 6 0.555 0.031 152.953 sec sqrtdel= 1.0000 1.0000 -0.0002 0.0004 rcn mod 32 ee,eee= -0.02782 -0.04013 slater integrals for ag i d9 5s8s nconf= 9 z= 47 ion= 0 exf=0.650 irel= 1 ag i d9 5s6g nconf=29 kut=-1 corrf=0.000 class 0 k rdk( 4d, 8s, 4d, 6g) frac k rek( 4d, 8s, 4d, 6g) frac - ------------------------------------- ----- - ------------------------------------- ----- 4 -0.00000205 ryd = -0.2252 cm-1 -0.134 2 0.00000387 ryd = 0.4250 cm-1 0.717 ag i d9 5s8s -d9 5s6g 2 -0.0002 5 0.0004 5 9 29 1 0.031 0.047 153.031 sec sqrtdel= 1.0000 1.0000 -0.0002 0.0004 rcn mod 32 ee,eee= -0.02044 -0.03643 slater integrals for ag i d9 5s8s nconf= 9 z= 47 ion= 0 exf=0.650 irel= 1 ag i d9 5s7g nconf=30 kut=-1 corrf=0.000 class 0 k rdk( 4d, 8s, 4d, 7g) frac k rek( 4d, 8s, 4d, 7g) frac - ------------------------------------- ----- - ------------------------------------- ----- 4 -0.00000194 ryd = -0.2126 cm-1 -0.140 2 0.00000365 ryd = 0.4011 cm-1 0.719 ag i d9 5s8s -d9 5s7g 2 -0.0002 5 0.0004 5 9 30 1 0.031 0.023 153.086 sec sqrtdel= 1.0000 1.0000 -0.0002 0.0004 rcn mod 32 ee,eee= -0.01565 -0.03404 slater integrals for ag i d9 5s8s nconf= 9 z= 47 ion= 0 exf=0.650 irel= 1 ag i d9 5s8g nconf=31 kut=-1 corrf=0.000 class 0 k rdk( 4d, 8s, 4d, 8g) frac k rek( 4d, 8s, 4d, 8g) frac - ------------------------------------- ----- - ------------------------------------- ----- 4 -0.00000178 ryd = -0.1957 cm-1 -0.146 2 0.00000331 ryd = 0.3638 cm-1 0.720 ag i d9 5s8s -d9 5s8g 2 -0.0002 5 0.0004 5 9 31 1 0.031 0.102 153.234 sec sqrtdel= 1.0000 1.0000 -0.0002 0.0004 rcn mod 32 ee,eee= -0.01236 -0.03240 slater integrals for ag i d9 5s8s nconf= 9 z= 47 ion= 0 exf=0.650 irel= 1 ag i d9 5s9g nconf=32 kut=-1 corrf=0.000 class 0 k rdk( 4d, 8s, 4d, 9g) frac k rek( 4d, 8s, 4d, 9g) frac - ------------------------------------- ----- - ------------------------------------- ----- 4 -0.00000162 ryd = -0.1777 cm-1 -0.150 2 0.00000297 ryd = 0.3261 cm-1 0.720 ag i d9 5s8s -d9 5s9g 2 -0.0002 5 0.0003 5 9 32 1 0.031 0.031 153.305 sec sqrtdel= 1.0000 1.0000 -0.0002 0.0003 rcn mod 32 ee,eee= -0.05243 -0.02622 ee,eee= -0.38785 -0.22014 slater integrals for ag i d9 5s8s nconf= 9 z= 47 ion= 0 exf=0.650 irel= 1 ag i d9 5p2 nconf=41 kut=-1 corrf=0.000 class 0 k rdk( 5s, 8s, 5p, 5p) frac k rek( 5s, 8s, 5p, 5p) frac - ------------------------------------- ----- - ------------------------------------- ----- 1 -0.00353685 ryd = -388.1248 cm-1 -0.087 1 -0.00353685 ryd = -388.1248 cm-1 -0.087 ag i d9 5s8s -d9 5p2 1 -0.3881 5 9 41 41 1.156 0.031 154.523 sec sqrtdel= 1.0000 1.0000 -0.3881 rcn mod 32 ee,eee= -2.04237 -1.02118 ee,eee= -1.02769 -1.53503 slater integrals for ag i d9 5s9s nconf=10 z= 47 ion= 0 exf=0.650 irel= 1 ag i d8 5s2 6s nconf=11 kut=-1 corrf=0.000 class 0 k rdk( 4d, 4d, 4d, 5s) frac k rek( 4d, 4d, 4d, 5s) frac - ------------------------------------- ----- - ------------------------------------- ----- 2 0.00000000 ryd = 0.0000 cm-1 0.000 2 0.00000000 ryd = 0.0000 cm-1 0.000 ag i d9 5s9s -d8 5s2 6s 1 0.0000 5 10 11 11 0.648 0.047 155.227 sec sqrtdel= 1.0000 1.0000 0.0000 rcn mod 32 ee,eee= -0.03465 -0.01732 ee,eee= -0.11438 -0.07451 slater integrals for ag i d9 5s9s nconf=10 z= 47 ion= 0 exf=0.650 irel= 1 ag i d10 5d nconf=12 kut=-1 corrf=0.000 class 0 k rdk( 5s, 9s, 4d, 5d) frac k rek( 5s, 9s, 4d, 5d) frac - ------------------------------------- ----- - ------------------------------------- ----- 2 0.00168217 ryd = 184.5967 cm-1 0.438 2 -0.00056323 ryd = -61.8076 cm-1 -0.324 ag i d9 5s9s -d10 5d 2 0.1846 5 -0.0618 5 10 12 12 0.352 0.031 155.617 sec sqrtdel= 1.0000 1.0000 0.1846 -0.0618 rcn mod 32 ee,eee= -0.06361 -0.04913 slater integrals for ag i d9 5s9s nconf=10 z= 47 ion= 0 exf=0.650 irel= 1 ag i d10 6d nconf=13 kut=-1 corrf=0.000 class 0 k rdk( 5s, 9s, 4d, 6d) frac k rek( 5s, 9s, 4d, 6d) frac - ------------------------------------- ----- - ------------------------------------- ----- 2 0.00128136 ryd = 140.6132 cm-1 0.508 2 -0.00045201 ryd = -49.6029 cm-1 -0.352 ag i d9 5s9s -d10 6d 2 0.1406 5 -0.0496 5 10 13 1 0.016 0.023 155.664 sec sqrtdel= 1.0000 1.0000 0.1406 -0.0496 rcn mod 32 ee,eee= -0.04051 -0.03758 slater integrals for ag i d9 5s9s nconf=10 z= 47 ion= 0 exf=0.650 irel= 1 ag i d10 7d nconf=14 kut=-1 corrf=0.000 class 0 k rdk( 5s, 9s, 4d, 7d) frac k rek( 5s, 9s, 4d, 7d) frac - ------------------------------------- ----- - ------------------------------------- ----- 2 0.00099489 ryd = 109.1761 cm-1 0.542 2 -0.00035111 ryd = -38.5299 cm-1 -0.363 ag i d9 5s9s -d10 7d 2 0.1092 5 -0.0385 5 10 14 1 0.031 0.039 155.742 sec sqrtdel= 1.0000 1.0000 0.1092 -0.0385 rcn mod 32 ee,eee= -0.02805 -0.03135 slater integrals for ag i d9 5s9s nconf=10 z= 47 ion= 0 exf=0.650 irel= 1 ag i d10 8d nconf=15 kut=-1 corrf=0.000 class 0 k rdk( 5s, 9s, 4d, 8d) frac k rek( 5s, 9s, 4d, 8d) frac - ------------------------------------- ----- - ------------------------------------- ----- 2 0.00083905 ryd = 92.0750 cm-1 0.593 2 -0.00027820 ryd = -30.5289 cm-1 -0.367 ag i d9 5s9s -d10 8d 2 0.0921 5 -0.0305 5 10 15 1 0.031 0.031 155.805 sec sqrtdel= 1.0000 1.0000 0.0921 -0.0305 rcn mod 32 ee,eee= -0.02057 -0.02761 slater integrals for ag i d9 5s9s nconf=10 z= 47 ion= 0 exf=0.650 irel= 1 ag i d10 9d nconf=16 kut=-1 corrf=0.000 class 0 k rdk( 5s, 9s, 4d, 9d) frac k rek( 5s, 9s, 4d, 9d) frac - ------------------------------------- ----- - ------------------------------------- ----- 2 0.00066692 ryd = 73.1863 cm-1 0.589 2 -0.00022762 ryd = -24.9788 cm-1 -0.371 ag i d9 5s9s -d10 9d 2 0.0732 5 -0.0250 5 10 16 1 0.031 0.039 155.875 sec sqrtdel= 1.0000 1.0000 0.0732 -0.0250 rcn mod 32 ee,eee= -0.03465 -0.01732 ee,eee= -0.12010 -0.07737 slater integrals for ag i d9 5s9s nconf=10 z= 47 ion= 0 exf=0.650 irel= 1 ag i d9 5s5d nconf=17 kut=-1 corrf=0.000 class 0 k rdk( 4d, 9s, 4d, 5d) frac k rek( 4d, 9s, 4d, 5d) frac - ------------------------------------- ----- - ------------------------------------- ----- 2 -0.00067018 ryd = -73.5433 cm-1 -0.181 2 0.00012673 ryd = 13.9072 cm-1 0.077 ag i d9 5s9s -d9 5s5d 2 -0.0735 5 0.0139 5 10 17 17 0.469 0.055 156.406 sec sqrtdel= 1.0000 1.0000 -0.0735 0.0139 rcn mod 32 ee,eee= -0.06554 -0.05009 slater integrals for ag i d9 5s9s nconf=10 z= 47 ion= 0 exf=0.650 irel= 1 ag i d9 5s6d nconf=18 kut=-1 corrf=0.000 class 0 k rdk( 4d, 9s, 4d, 6d) frac k rek( 4d, 9s, 4d, 6d) frac - ------------------------------------- ----- - ------------------------------------- ----- 2 -0.00049283 ryd = -54.0822 cm-1 -0.195 2 0.00011205 ryd = 12.2964 cm-1 0.091 ag i d9 5s9s -d9 5s6d 2 -0.0541 5 0.0123 5 10 18 1 0.031 0.102 156.547 sec sqrtdel= 1.0000 1.0000 -0.0541 0.0123 rcn mod 32 ee,eee= -0.04139 -0.03802 slater integrals for ag i d9 5s9s nconf=10 z= 47 ion= 0 exf=0.650 irel= 1 ag i d9 5s7d nconf=19 kut=-1 corrf=0.000 class 0 k rdk( 4d, 9s, 4d, 7d) frac k rek( 4d, 9s, 4d, 7d) frac - ------------------------------------- ----- - ------------------------------------- ----- 2 -0.00037233 ryd = -40.8584 cm-1 -0.201 2 0.00009241 ryd = 10.1408 cm-1 0.099 ag i d9 5s9s -d9 5s7d 2 -0.0409 5 0.0101 5 10 19 1 0.023 0.047 156.617 sec sqrtdel= 1.0000 1.0000 -0.0409 0.0101 rcn mod 32 ee,eee= -0.02853 -0.03159 slater integrals for ag i d9 5s9s nconf=10 z= 47 ion= 0 exf=0.650 irel= 1 ag i d9 5s8d nconf=20 kut=-1 corrf=0.000 class 0 k rdk( 4d, 9s, 4d, 8d) frac k rek( 4d, 9s, 4d, 8d) frac - ------------------------------------- ----- - ------------------------------------- ----- 2 -0.00031870 ryd = -34.9737 cm-1 -0.222 2 0.00007559 ryd = 8.2952 cm-1 0.104 ag i d9 5s9s -d9 5s8d 2 -0.0350 5 0.0083 5 10 20 1 0.031 0.016 156.680 sec sqrtdel= 1.0000 1.0000 -0.0350 0.0083 rcn mod 32 ee,eee= -0.02086 -0.02775 slater integrals for ag i d9 5s9s nconf=10 z= 47 ion= 0 exf=0.650 irel= 1 ag i d9 5s9d nconf=21 kut=-1 corrf=0.000 class 0 k rdk( 4d, 9s, 4d, 9d) frac k rek( 4d, 9s, 4d, 9d) frac - ------------------------------------- ----- - ------------------------------------- ----- 2 -0.00023923 ryd = -26.2523 cm-1 -0.209 2 0.00006260 ryd = 6.8699 cm-1 0.107 ag i d9 5s9s -d9 5s9d 2 -0.0263 5 0.0069 5 10 21 1 0.031 0.086 156.797 sec sqrtdel= 1.0000 1.0000 -0.0263 0.0069 rcn mod 32 ee,eee= -0.12522 -0.07993 slater integrals for ag i d9 5s9s nconf=10 z= 47 ion= 0 exf=0.650 irel= 1 ag i d8 5s2 5d nconf=22 kut=-1 corrf=0.000 class 0 k rdk( 4d, 9s, 5s, 5d) frac k rek( 4d, 9s, 5s, 5d) frac - ------------------------------------- ----- - ------------------------------------- ----- 2 0.00171689 ryd = 188.4072 cm-1 0.432 0 0.00196997 ryd = 216.1797 cm-1 0.323 ag i d9 5s9s -d8 5s2 5d 2 0.1884 5 0.2162 5 10 22 1 0.031 0.008 156.844 sec sqrtdel= 1.0000 1.0000 0.1884 0.2162 rcn mod 32 ee,eee= -0.04004 -0.03735 slater integrals for ag i d9 5s9s nconf=10 z= 47 ion= 0 exf=0.650 irel= 1 ag i d9 5s5g nconf=28 kut=-1 corrf=0.000 class 0 k rdk( 4d, 9s, 4d, 5g) frac k rek( 4d, 9s, 4d, 5g) frac - ------------------------------------- ----- - ------------------------------------- ----- 4 -0.00000153 ryd = -0.1675 cm-1 -0.136 2 0.00000260 ryd = 0.2853 cm-1 0.708 ag i d9 5s9s -d9 5s5g 2 -0.0002 5 0.0003 5 10 28 6 0.289 0.031 157.203 sec sqrtdel= 1.0000 1.0000 -0.0002 0.0003 rcn mod 32 ee,eee= -0.02782 -0.03123 slater integrals for ag i d9 5s9s nconf=10 z= 47 ion= 0 exf=0.650 irel= 1 ag i d9 5s6g nconf=29 kut=-1 corrf=0.000 class 0 k rdk( 4d, 9s, 4d, 6g) frac k rek( 4d, 9s, 4d, 6g) frac - ------------------------------------- ----- - ------------------------------------- ----- 4 -0.00000158 ryd = -0.1729 cm-1 -0.142 2 0.00000282 ryd = 0.3097 cm-1 0.711 ag i d9 5s9s -d9 5s6g 2 -0.0002 5 0.0003 5 10 29 1 0.047 0.492 157.844 sec sqrtdel= 1.0000 1.0000 -0.0002 0.0003 rcn mod 32 ee,eee= -0.02044 -0.02754 slater integrals for ag i d9 5s9s nconf=10 z= 47 ion= 0 exf=0.650 irel= 1 ag i d9 5s7g nconf=30 kut=-1 corrf=0.000 class 0 k rdk( 4d, 9s, 4d, 7g) frac k rek( 4d, 9s, 4d, 7g) frac - ------------------------------------- ----- - ------------------------------------- ----- 4 -0.00000141 ryd = -0.1546 cm-1 -0.141 2 0.00000266 ryd = 0.2923 cm-1 0.712 ag i d9 5s9s -d9 5s7g 2 -0.0002 5 0.0003 5 10 30 1 0.086 0.047 157.977 sec sqrtdel= 1.0000 1.0000 -0.0002 0.0003 rcn mod 32 ee,eee= -0.01565 -0.02515 slater integrals for ag i d9 5s9s nconf=10 z= 47 ion= 0 exf=0.650 irel= 1 ag i d9 5s8g nconf=31 kut=-1 corrf=0.000 class 0 k rdk( 4d, 9s, 4d, 8g) frac k rek( 4d, 9s, 4d, 8g) frac - ------------------------------------- ----- - ------------------------------------- ----- 4 -0.00000125 ryd = -0.1374 cm-1 -0.142 2 0.00000242 ryd = 0.2651 cm-1 0.713 ag i d9 5s9s -d9 5s8g 2 -0.0001 5 0.0003 5 10 31 1 0.023 0.055 158.055 sec sqrtdel= 1.0000 1.0000 -0.0001 0.0003 rcn mod 32 ee,eee= -0.01236 -0.02350 slater integrals for ag i d9 5s9s nconf=10 z= 47 ion= 0 exf=0.650 irel= 1 ag i d9 5s9g nconf=32 kut=-1 corrf=0.000 class 0 k rdk( 4d, 9s, 4d, 9g) frac k rek( 4d, 9s, 4d, 9g) frac - ------------------------------------- ----- - ------------------------------------- ----- 4 -0.00000111 ryd = -0.1221 cm-1 -0.143 2 0.00000217 ryd = 0.2377 cm-1 0.714 ag i d9 5s9s -d9 5s9g 2 -0.0001 5 0.0002 5 10 32 1 0.188 0.023 158.266 sec sqrtdel= 1.0000 1.0000 -0.0001 0.0002 rcn mod 32 ee,eee= -0.03465 -0.01732 ee,eee= -0.38785 -0.21125 slater integrals for ag i d9 5s9s nconf=10 z= 47 ion= 0 exf=0.650 irel= 1 ag i d9 5p2 nconf=41 kut=-1 corrf=0.000 class 0 k rdk( 5s, 9s, 5p, 5p) frac k rek( 5s, 9s, 5p, 5p) frac - ------------------------------------- ----- - ------------------------------------- ----- 1 -0.00260072 ryd = -285.3966 cm-1 -0.087 1 -0.00260072 ryd = -285.3966 cm-1 -0.087 ag i d9 5s9s -d9 5p2 1 -0.2854 5 10 41 41 1.078 0.125 159.500 sec sqrtdel= 1.0000 1.0000 -0.2854 rcn mod 32 ee,eee= -0.20180 -0.10090 ee,eee= -0.12010 -0.16095 slater integrals for ag i d8 5s2 6s nconf=11 z= 47 ion= 0 exf=0.650 irel= 1 ag i d9 5s5d nconf=17 kut=-1 corrf=0.000 class 0 k rdk( 5s, 6s, 4d, 5d) frac k rek( 5s, 6s, 4d, 5d) frac - ------------------------------------- ----- - ------------------------------------- ----- 2 0.01050653 ryd = 1152.9588 cm-1 0.647 2 -0.00305588 ryd = -335.3437 cm-1 -0.452 ag i d8 5s2 6s -d9 5s5d 2 1.1530 5 -0.3353 5 11 17 17 0.758 0.031 160.305 sec sqrtdel= 1.0000 1.0000 1.1530 -0.3353 rcn mod 32 ee,eee= -0.06554 -0.13367 slater integrals for ag i d8 5s2 6s nconf=11 z= 47 ion= 0 exf=0.650 irel= 1 ag i d9 5s6d nconf=18 kut=-1 corrf=0.000 class 0 k rdk( 5s, 6s, 4d, 6d) frac k rek( 5s, 6s, 4d, 6d) frac - ------------------------------------- ----- - ------------------------------------- ----- 2 0.00512842 ryd = 562.7793 cm-1 0.521 2 -0.00235011 ryd = -257.8949 cm-1 -0.468 ag i d8 5s2 6s -d9 5s6d 2 0.5628 5 -0.2579 5 11 18 1 0.047 0.023 160.391 sec sqrtdel= 1.0000 1.0000 0.5628 -0.2579 rcn mod 32 ee,eee= -0.04139 -0.12160 slater integrals for ag i d8 5s2 6s nconf=11 z= 47 ion= 0 exf=0.650 irel= 1 ag i d9 5s7d nconf=19 kut=-1 corrf=0.000 class 0 k rdk( 5s, 6s, 4d, 7d) frac k rek( 5s, 6s, 4d, 7d) frac - ------------------------------------- ----- - ------------------------------------- ----- 2 0.00311303 ryd = 341.6155 cm-1 0.453 2 -0.00180325 ryd = -197.8838 cm-1 -0.476 ag i d8 5s2 6s -d9 5s7d 2 0.3416 5 -0.1979 5 11 19 1 0.023 0.047 160.477 sec sqrtdel= 1.0000 1.0000 0.3416 -0.1979 rcn mod 32 ee,eee= -0.02853 -0.11517 slater integrals for ag i d8 5s2 6s nconf=11 z= 47 ion= 0 exf=0.650 irel= 1 ag i d9 5s8d nconf=20 kut=-1 corrf=0.000 class 0 k rdk( 5s, 6s, 4d, 8d) frac k rek( 5s, 6s, 4d, 8d) frac - ------------------------------------- ----- - ------------------------------------- ----- 2 0.00213141 ryd = 233.8957 cm-1 0.413 2 -0.00142120 ryd = -155.9591 cm-1 -0.481 ag i d8 5s2 6s -d9 5s8d 2 0.2339 5 -0.1560 5 11 20 1 0.031 0.008 160.523 sec sqrtdel= 1.0000 1.0000 0.2339 -0.1560 rcn mod 32 ee,eee= -0.02086 -0.11133 slater integrals for ag i d8 5s2 6s nconf=11 z= 47 ion= 0 exf=0.650 irel= 1 ag i d9 5s9d nconf=21 kut=-1 corrf=0.000 class 0 k rdk( 5s, 6s, 4d, 9d) frac k rek( 5s, 6s, 4d, 9d) frac - ------------------------------------- ----- - ------------------------------------- ----- 2 0.00157273 ryd = 172.5869 cm-1 0.388 2 -0.00115129 ryd = -126.3398 cm-1 -0.484 ag i d8 5s2 6s -d9 5s9d 2 0.1726 5 -0.1263 5 11 21 1 0.023 0.047 160.617 sec sqrtdel= 1.0000 1.0000 0.1726 -0.1263 rcn mod 32 ee,eee= -0.20180 -0.10090 ee,eee= -0.12522 -0.16351 slater integrals for ag i d8 5s2 6s nconf=11 z= 47 ion= 0 exf=0.650 irel= 1 ag i d8 5s2 5d nconf=22 kut=-1 corrf=0.000 class 0 k rdk( 4d, 6s, 4d, 5d) frac k rek( 4d, 6s, 4d, 5d) frac - ------------------------------------- ----- - ------------------------------------- ----- 2 -0.00726270 ryd = -796.9886 cm-1 -0.484 2 -0.00058766 ryd = -64.4885 cm-1 -0.087 ag i d8 5s2 6s -d8 5s2 5d 2 -0.7970 5 -0.0645 5 11 22 22 0.898 0.031 161.547 sec sqrtdel= 1.0000 1.0000 -0.7970 -0.0645 rcn mod 32 ee,eee= -1.59171 -0.79586 ee,eee= -0.98467 -1.28819 slater integrals for ag i d10 5d nconf=12 z= 47 ion= 0 exf=0.650 irel= 1 ag i d9 5s5d nconf=17 kut=-1 corrf=0.000 class 0 k rdk( 4d, 4d, 4d, 5s) frac k rek( 4d, 4d, 4d, 5s) frac - ------------------------------------- ----- - ------------------------------------- ----- 2 -0.13708633 ryd = -15043.4848 cm-1 -0.475 2 -0.13708659 ryd = -15043.5137 cm-1 -0.476 ag i d10 5d -d9 5s5d 1 -15.0435 5 12 17 17 0.719 0.070 162.391 sec rcn mod 32 ee,eee= -0.11438 -0.05719 ee,eee= -0.12010 -0.11724 slater integrals for ag i d10 5d nconf=12 z= 47 ion= 0 exf=0.650 irel= 1 ag i d9 5s5d nconf=17 kut=-1 corrf=0.000 class 0 k rdk( 4d, 5d, 5s, 5d) frac k rek( 4d, 5d, 5s, 5d) frac - ------------------------------------- ----- - ------------------------------------- ----- 2 -0.01389441 ryd = -1524.7356 cm-1 -0.915 2 -0.00182179 ryd = -199.9188 cm-1 -0.522 ag i d10 5d -d9 5s5d 2 -1.5247 5 -0.1999 5 12 17 17 0.516 0.016 162.961 sec sqrtdel= 1.0000 1.0000 -15.0435 -1.5247 -0.1999 rcn mod 32 ee,eee= -1.59171 -0.79586 ee,eee= -1.08362 -1.33766 slater integrals for ag i d10 5d nconf=12 z= 47 ion= 0 exf=0.650 irel= 1 ag i d9 5s6d nconf=18 kut=-1 corrf=0.000 class 0 k rdk( 4d, 4d, 4d, 5s) frac k rek( 4d, 4d, 4d, 5s) frac - ------------------------------------- ----- - ------------------------------------- ----- 2 0.00000000 ryd = 0.0000 cm-1 0.000 2 0.00000000 ryd = 0.0000 cm-1 0.000 ag i d10 5d -d9 5s6d 1 0.0000 5 12 18 18 0.516 0.055 163.531 sec rcn mod 32 ee,eee= -0.11438 -0.05719 ee,eee= -0.06554 -0.08996 slater integrals for ag i d10 5d nconf=12 z= 47 ion= 0 exf=0.650 irel= 1 ag i d9 5s6d nconf=18 kut=-1 corrf=0.000 class 0 k rdk( 4d, 5d, 5s, 6d) frac k rek( 4d, 5d, 5s, 6d) frac - ------------------------------------- ----- - ------------------------------------- ----- 2 -0.00731630 ryd = -802.8709 cm-1 -0.809 2 -0.00133056 ryd = -146.0121 cm-1 -0.518 ag i d10 5d -d9 5s6d 2 -0.8029 5 -0.1460 5 12 18 18 0.602 0.023 164.156 sec sqrtdel= 1.0000 1.0000 0.0000 -0.8029 -0.1460 rcn mod 32 ee,eee= -1.59171 -0.79586 ee,eee= -1.12961 -1.36066 slater integrals for ag i d10 5d nconf=12 z= 47 ion= 0 exf=0.650 irel= 1 ag i d9 5s7d nconf=19 kut=-1 corrf=0.000 class 0 k rdk( 4d, 4d, 4d, 5s) frac k rek( 4d, 4d, 4d, 5s) frac - ------------------------------------- ----- - ------------------------------------- ----- 2 0.00000000 ryd = 0.0000 cm-1 0.000 2 0.00000000 ryd = 0.0000 cm-1 0.000 ag i d10 5d -d9 5s7d 1 0.0000 5 12 19 19 0.961 0.031 165.227 sec rcn mod 32 ee,eee= -0.11438 -0.05719 ee,eee= -0.04139 -0.07788 slater integrals for ag i d10 5d nconf=12 z= 47 ion= 0 exf=0.650 irel= 1 ag i d9 5s7d nconf=19 kut=-1 corrf=0.000 class 0 k rdk( 4d, 5d, 5s, 7d) frac k rek( 4d, 5d, 5s, 7d) frac - ------------------------------------- ----- - ------------------------------------- ----- 2 -0.00483591 ryd = -530.6795 cm-1 -0.768 2 -0.00099557 ryd = -109.2513 cm-1 -0.517 ag i d10 5d -d9 5s7d 2 -0.5307 5 -0.1093 5 12 19 19 1.016 0.055 166.297 sec sqrtdel= 1.0000 1.0000 0.0000 -0.5307 -0.1093 rcn mod 32 ee,eee= -1.59171 -0.79586 ee,eee= -1.15460 -1.37316 slater integrals for ag i d10 5d nconf=12 z= 47 ion= 0 exf=0.650 irel= 1 ag i d9 5s8d nconf=20 kut=-1 corrf=0.000 class 0 k rdk( 4d, 4d, 4d, 5s) frac k rek( 4d, 4d, 4d, 5s) frac - ------------------------------------- ----- - ------------------------------------- ----- 2 0.00000000 ryd = 0.0000 cm-1 0.000 2 0.00000000 ryd = 0.0000 cm-1 0.000 ag i d10 5d -d9 5s8d 1 0.0000 5 12 20 20 0.680 0.023 167.016 sec rcn mod 32 ee,eee= -0.11438 -0.05719 ee,eee= -0.02853 -0.07145 slater integrals for ag i d10 5d nconf=12 z= 47 ion= 0 exf=0.650 irel= 1 ag i d9 5s8d nconf=20 kut=-1 corrf=0.000 class 0 k rdk( 4d, 5d, 5s, 8d) frac k rek( 4d, 5d, 5s, 8d) frac - ------------------------------------- ----- - ------------------------------------- ----- 2 -0.00351976 ryd = -386.2487 cm-1 -0.746 2 -0.00077402 ryd = -84.9389 cm-1 -0.516 ag i d10 5d -d9 5s8d 2 -0.3862 5 -0.0849 5 12 20 20 0.680 0.031 167.734 sec sqrtdel= 1.0000 1.0000 0.0000 -0.3862 -0.0849 rcn mod 32 ee,eee= -1.59171 -0.79586 ee,eee= -1.16965 -1.38068 slater integrals for ag i d10 5d nconf=12 z= 47 ion= 0 exf=0.650 irel= 1 ag i d9 5s9d nconf=21 kut=-1 corrf=0.000 class 0 k rdk( 4d, 4d, 4d, 5s) frac k rek( 4d, 4d, 4d, 5s) frac - ------------------------------------- ----- - ------------------------------------- ----- 2 0.00000000 ryd = 0.0000 cm-1 0.000 2 0.00000000 ryd = 0.0000 cm-1 0.000 ag i d10 5d -d9 5s9d 1 0.0000 5 12 21 21 1.008 0.031 168.781 sec rcn mod 32 ee,eee= -0.11438 -0.05719 ee,eee= -0.02086 -0.06762 slater integrals for ag i d10 5d nconf=12 z= 47 ion= 0 exf=0.650 irel= 1 ag i d9 5s9d nconf=21 kut=-1 corrf=0.000 class 0 k rdk( 4d, 5d, 5s, 9d) frac k rek( 4d, 5d, 5s, 9d) frac - ------------------------------------- ----- - ------------------------------------- ----- 2 -0.00271457 ryd = -297.8895 cm-1 -0.732 2 -0.00062181 ryd = -68.2355 cm-1 -0.516 ag i d10 5d -d9 5s9d 2 -0.2979 5 -0.0682 5 12 21 21 0.742 0.031 169.555 sec sqrtdel= 1.0000 1.0000 0.0000 -0.2979 -0.0682 rcn mod 32 ee,eee= -1.59171 -0.79586 ee,eee= -1.05985 -1.32578 slater integrals for ag i d10 5d nconf=12 z= 47 ion= 0 exf=0.650 irel= 1 ag i d8 5s2 5d nconf=22 kut=-1 corrf=0.000 class 0 k rdk( 4d, 4d, 5s, 5s) frac k rek( 4d, 4d, 5s, 5s) frac - ------------------------------------- ----- - ------------------------------------- ----- 2 0.15458865 ryd = 16964.1428 cm-1 0.781 2 0.15458865 ryd = 16964.1428 cm-1 0.781 ag i d10 5d -d8 5s2 5d 1 16.9641 5 12 22 22 0.742 0.023 170.320 sec sqrtdel= 1.0000 1.0000 16.9641 rcn mod 32 ee,eee= -0.11438 -0.05719 ee,eee= -0.04004 -0.07721 slater integrals for ag i d10 5d nconf=12 z= 47 ion= 0 exf=0.650 irel= 1 ag i d9 5s5g nconf=28 kut=-1 corrf=0.000 class 0 k rdk( 4d, 5d, 5s, 5g) frac k rek( 4d, 5d, 5s, 5g) frac - ------------------------------------- ----- - ------------------------------------- ----- 2 -0.00101230 ryd = -111.0867 cm-1 -0.961 2 -0.00002276 ryd = -2.4976 cm-1 -0.948 ag i d10 5d -d9 5s5g 2 -0.1111 5 -0.0025 5 12 28 28 1.063 0.023 171.430 sec sqrtdel= 1.0000 1.0000 -0.1111 -0.0025 rcn mod 32 ee,eee= -0.02782 -0.07110 slater integrals for ag i d10 5d nconf=12 z= 47 ion= 0 exf=0.650 irel= 1 ag i d9 5s6g nconf=29 kut=-1 corrf=0.000 class 0 k rdk( 4d, 5d, 5s, 6g) frac k rek( 4d, 5d, 5s, 6g) frac - ------------------------------------- ----- - ------------------------------------- ----- 2 -0.00094583 ryd = -103.7925 cm-1 -0.960 2 -0.00002414 ryd = -2.6494 cm-1 -0.947 ag i d10 5d -d9 5s6g 2 -0.1038 5 -0.0026 5 12 29 1 0.031 0.023 171.484 sec sqrtdel= 1.0000 1.0000 -0.1038 -0.0026 rcn mod 32 ee,eee= -0.02044 -0.06741 slater integrals for ag i d10 5d nconf=12 z= 47 ion= 0 exf=0.650 irel= 1 ag i d9 5s7g nconf=30 kut=-1 corrf=0.000 class 0 k rdk( 4d, 5d, 5s, 7g) frac k rek( 4d, 5d, 5s, 7g) frac - ------------------------------------- ----- - ------------------------------------- ----- 2 -0.00081975 ryd = -89.9576 cm-1 -0.958 2 -0.00002250 ryd = -2.4692 cm-1 -0.947 ag i d10 5d -d9 5s7g 2 -0.0900 5 -0.0025 5 12 30 1 0.031 0.008 171.563 sec sqrtdel= 1.0000 1.0000 -0.0900 -0.0025 rcn mod 32 ee,eee= -0.01565 -0.06501 slater integrals for ag i d10 5d nconf=12 z= 47 ion= 0 exf=0.650 irel= 1 ag i d9 5s8g nconf=31 kut=-1 corrf=0.000 class 0 k rdk( 4d, 5d, 5s, 8g) frac k rek( 4d, 5d, 5s, 8g) frac - ------------------------------------- ----- - ------------------------------------- ----- 2 -0.00070423 ryd = -77.2807 cm-1 -0.957 2 -0.00002025 ryd = -2.2217 cm-1 -0.946 ag i d10 5d -d9 5s8g 2 -0.0773 5 -0.0022 5 12 31 1 0.031 0.125 171.727 sec sqrtdel= 1.0000 1.0000 -0.0773 -0.0022 rcn mod 32 ee,eee= -0.01236 -0.06337 slater integrals for ag i d10 5d nconf=12 z= 47 ion= 0 exf=0.650 irel= 1 ag i d9 5s9g nconf=32 kut=-1 corrf=0.000 class 0 k rdk( 4d, 5d, 5s, 9g) frac k rek( 4d, 5d, 5s, 9g) frac - ------------------------------------- ----- - ------------------------------------- ----- 2 -0.00060825 ryd = -66.7473 cm-1 -0.956 2 -0.00001805 ryd = -1.9807 cm-1 -0.946 ag i d10 5d -d9 5s9g 2 -0.0667 5 -0.0020 5 12 32 1 0.016 0.047 171.797 sec sqrtdel= 1.0000 1.0000 -0.0667 -0.0020 rcn mod 32 ee,eee= -0.38785 -0.25111 slater integrals for ag i d10 5d nconf=12 z= 47 ion= 0 exf=0.650 irel= 1 ag i d9 5p2 nconf=41 kut=-1 corrf=0.000 class 0 k rdk( 4d, 5d, 5p, 5p) frac k rek( 4d, 5d, 5p, 5p) frac - ------------------------------------- ----- - ------------------------------------- ----- 1 -0.02710107 ryd = -2973.9990 cm-1 -0.766 1 -0.02710107 ryd = -2973.9990 cm-1 -0.766 3 -0.01156367 ryd = -1268.9657 cm-1 -0.836 3 -0.01156367 ryd = -1268.9657 cm-1 -0.836 ag i d10 5d -d9 5p2 2 -2.9740 5 -1.2690 5 12 41 9 0.211 0.031 172.063 sec sqrtdel= 1.0000 1.0000 -2.9740 -1.2690 rcn mod 32 ee,eee= -1.68623 -0.84311 ee,eee= -0.98467 -1.33545 slater integrals for ag i d10 6d nconf=13 z= 47 ion= 0 exf=0.650 irel= 1 ag i d9 5s5d nconf=17 kut=-1 corrf=0.000 class 0 k rdk( 4d, 4d, 4d, 5s) frac k rek( 4d, 4d, 4d, 5s) frac - ------------------------------------- ----- - ------------------------------------- ----- 2 0.00000000 ryd = 0.0000 cm-1 0.000 2 0.00000000 ryd = 0.0000 cm-1 0.000 ag i d10 6d -d9 5s5d 1 0.0000 5 13 17 17 0.516 0.023 172.625 sec rcn mod 32 ee,eee= -0.06361 -0.03181 ee,eee= -0.12010 -0.09186 slater integrals for ag i d10 6d nconf=13 z= 47 ion= 0 exf=0.650 irel= 1 ag i d9 5s5d nconf=17 kut=-1 corrf=0.000 class 0 k rdk( 4d, 6d, 5s, 5d) frac k rek( 4d, 6d, 5s, 5d) frac - ------------------------------------- ----- - ------------------------------------- ----- 2 -0.00772547 ryd = -847.7728 cm-1 -0.837 2 -0.00131148 ryd = -143.9188 cm-1 -0.515 ag i d10 6d -d9 5s5d 2 -0.8478 5 -0.1439 5 13 17 17 1.211 0.047 173.883 sec sqrtdel= 1.0000 1.0000 0.0000 -0.8478 -0.1439 rcn mod 32 ee,eee= -1.68623 -0.84311 ee,eee= -1.08362 -1.38492 slater integrals for ag i d10 6d nconf=13 z= 47 ion= 0 exf=0.650 irel= 1 ag i d9 5s6d nconf=18 kut=-1 corrf=0.000 class 0 k rdk( 4d, 4d, 4d, 5s) frac k rek( 4d, 4d, 4d, 5s) frac - ------------------------------------- ----- - ------------------------------------- ----- 2 -0.13743167 ryd = -15081.3819 cm-1 -0.475 2 -0.13743194 ryd = -15081.4109 cm-1 -0.475 ag i d10 6d -d9 5s6d 1 -15.0814 5 13 18 18 0.727 0.023 174.641 sec rcn mod 32 ee,eee= -0.06361 -0.03181 ee,eee= -0.06554 -0.06458 slater integrals for ag i d10 6d nconf=13 z= 47 ion= 0 exf=0.650 irel= 1 ag i d9 5s6d nconf=18 kut=-1 corrf=0.000 class 0 k rdk( 4d, 6d, 5s, 6d) frac k rek( 4d, 6d, 5s, 6d) frac - ------------------------------------- ----- - ------------------------------------- ----- 2 -0.00564077 ryd = -619.0026 cm-1 -0.900 2 -0.00096164 ryd = -105.5280 cm-1 -0.512 ag i d10 6d -d9 5s6d 2 -0.6190 5 -0.1055 5 13 18 18 0.500 0.008 175.164 sec sqrtdel= 1.0000 1.0000 -15.0814 -0.6190 -0.1055 rcn mod 32 ee,eee= -1.68623 -0.84311 ee,eee= -1.12961 -1.40792 slater integrals for ag i d10 6d nconf=13 z= 47 ion= 0 exf=0.650 irel= 1 ag i d9 5s7d nconf=19 kut=-1 corrf=0.000 class 0 k rdk( 4d, 4d, 4d, 5s) frac k rek( 4d, 4d, 4d, 5s) frac - ------------------------------------- ----- - ------------------------------------- ----- 2 0.00000000 ryd = 0.0000 cm-1 0.000 2 0.00000000 ryd = 0.0000 cm-1 0.000 ag i d10 6d -d9 5s7d 1 0.0000 5 13 19 19 0.914 0.039 176.125 sec rcn mod 32 ee,eee= -0.06361 -0.03181 ee,eee= -0.04139 -0.05250 slater integrals for ag i d10 6d nconf=13 z= 47 ion= 0 exf=0.650 irel= 1 ag i d9 5s7d nconf=19 kut=-1 corrf=0.000 class 0 k rdk( 4d, 6d, 5s, 7d) frac k rek( 4d, 6d, 5s, 7d) frac - ------------------------------------- ----- - ------------------------------------- ----- 2 -0.00369291 ryd = -405.2499 cm-1 -0.857 2 -0.00072088 ryd = -79.1075 cm-1 -0.511 ag i d10 6d -d9 5s7d 2 -0.4052 5 -0.0791 5 13 19 19 0.531 0.016 176.672 sec sqrtdel= 1.0000 1.0000 0.0000 -0.4052 -0.0791 rcn mod 32 ee,eee= -1.68623 -0.84311 ee,eee= -1.15460 -1.42042 slater integrals for ag i d10 6d nconf=13 z= 47 ion= 0 exf=0.650 irel= 1 ag i d9 5s8d nconf=20 kut=-1 corrf=0.000 class 0 k rdk( 4d, 4d, 4d, 5s) frac k rek( 4d, 4d, 4d, 5s) frac - ------------------------------------- ----- - ------------------------------------- ----- 2 0.00000000 ryd = 0.0000 cm-1 0.000 2 0.00000000 ryd = 0.0000 cm-1 0.000 ag i d10 6d -d9 5s8d 1 0.0000 5 13 20 20 0.563 0.008 177.250 sec rcn mod 32 ee,eee= -0.06361 -0.03181 ee,eee= -0.02853 -0.04607 slater integrals for ag i d10 6d nconf=13 z= 47 ion= 0 exf=0.650 irel= 1 ag i d9 5s8d nconf=20 kut=-1 corrf=0.000 class 0 k rdk( 4d, 6d, 5s, 8d) frac k rek( 4d, 6d, 5s, 8d) frac - ------------------------------------- ----- - ------------------------------------- ----- 2 -0.00269463 ryd = -295.7011 cm-1 -0.838 2 -0.00056101 ryd = -61.5639 cm-1 -0.511 ag i d10 6d -d9 5s8d 2 -0.2957 5 -0.0616 5 13 20 20 0.977 0.148 178.391 sec sqrtdel= 1.0000 1.0000 0.0000 -0.2957 -0.0616 rcn mod 32 ee,eee= -1.68623 -0.84311 ee,eee= -1.16965 -1.42794 slater integrals for ag i d10 6d nconf=13 z= 47 ion= 0 exf=0.650 irel= 1 ag i d9 5s9d nconf=21 kut=-1 corrf=0.000 class 0 k rdk( 4d, 4d, 4d, 5s) frac k rek( 4d, 4d, 4d, 5s) frac - ------------------------------------- ----- - ------------------------------------- ----- 2 0.00000000 ryd = 0.0000 cm-1 0.000 2 0.00000000 ryd = 0.0000 cm-1 0.000 ag i d10 6d -d9 5s9d 1 0.0000 5 13 21 21 0.711 0.023 179.141 sec rcn mod 32 ee,eee= -0.06361 -0.03181 ee,eee= -0.02086 -0.04224 slater integrals for ag i d10 6d nconf=13 z= 47 ion= 0 exf=0.650 irel= 1 ag i d9 5s9d nconf=21 kut=-1 corrf=0.000 class 0 k rdk( 4d, 6d, 5s, 9d) frac k rek( 4d, 6d, 5s, 9d) frac - ------------------------------------- ----- - ------------------------------------- ----- 2 -0.00208336 ryd = -228.6224 cm-1 -0.826 2 -0.00045096 ryd = -49.4866 cm-1 -0.511 ag i d10 6d -d9 5s9d 2 -0.2286 5 -0.0495 5 13 21 21 0.586 0.023 179.750 sec sqrtdel= 1.0000 1.0000 0.0000 -0.2286 -0.0495 rcn mod 32 ee,eee= -1.68623 -0.84311 ee,eee= -1.05985 -1.37304 slater integrals for ag i d10 6d nconf=13 z= 47 ion= 0 exf=0.650 irel= 1 ag i d8 5s2 5d nconf=22 kut=-1 corrf=0.000 class 0 k rdk( 4d, 4d, 5s, 5s) frac k rek( 4d, 4d, 5s, 5s) frac - ------------------------------------- ----- - ------------------------------------- ----- 2 0.00000000 ryd = 0.0000 cm-1 0.000 2 0.00000000 ryd = 0.0000 cm-1 0.000 ag i d10 6d -d8 5s2 5d 1 0.0000 5 13 22 22 1.094 0.008 180.852 sec sqrtdel= 1.0000 1.0000 0.0000 rcn mod 32 ee,eee= -0.06361 -0.03181 ee,eee= -0.04004 -0.05183 slater integrals for ag i d10 6d nconf=13 z= 47 ion= 0 exf=0.650 irel= 1 ag i d9 5s5g nconf=28 kut=-1 corrf=0.000 class 0 k rdk( 4d, 6d, 5s, 5g) frac k rek( 4d, 6d, 5s, 5g) frac - ------------------------------------- ----- - ------------------------------------- ----- 2 0.00023431 ryd = 25.7129 cm-1 0.294 2 -0.00001627 ryd = -1.7859 cm-1 -0.951 ag i d10 6d -d9 5s5g 2 0.0257 5 -0.0018 5 13 28 28 1.211 0.047 182.133 sec sqrtdel= 1.0000 1.0000 0.0257 -0.0018 rcn mod 32 ee,eee= -0.02782 -0.04572 slater integrals for ag i d10 6d nconf=13 z= 47 ion= 0 exf=0.650 irel= 1 ag i d9 5s6g nconf=29 kut=-1 corrf=0.000 class 0 k rdk( 4d, 6d, 5s, 6g) frac k rek( 4d, 6d, 5s, 6g) frac - ------------------------------------- ----- - ------------------------------------- ----- 2 0.00002070 ryd = 2.2719 cm-1 0.034 2 -0.00001728 ryd = -1.8962 cm-1 -0.950 ag i d10 6d -d9 5s6g 2 0.0023 5 -0.0019 5 13 29 1 0.031 0.016 182.180 sec sqrtdel= 1.0000 1.0000 0.0023 -0.0019 rcn mod 32 ee,eee= -0.02044 -0.04202 slater integrals for ag i d10 6d nconf=13 z= 47 ion= 0 exf=0.650 irel= 1 ag i d9 5s7g nconf=30 kut=-1 corrf=0.000 class 0 k rdk( 4d, 6d, 5s, 7g) frac k rek( 4d, 6d, 5s, 7g) frac - ------------------------------------- ----- - ------------------------------------- ----- 2 -0.00005448 ryd = -5.9785 cm-1 -0.109 2 -0.00001611 ryd = -1.7681 cm-1 -0.949 ag i d10 6d -d9 5s7g 2 -0.0060 5 -0.0018 5 13 30 1 0.164 0.023 182.367 sec sqrtdel= 1.0000 1.0000 -0.0060 -0.0018 rcn mod 32 ee,eee= -0.01565 -0.03963 slater integrals for ag i d10 6d nconf=13 z= 47 ion= 0 exf=0.650 irel= 1 ag i d9 5s8g nconf=31 kut=-1 corrf=0.000 class 0 k rdk( 4d, 6d, 5s, 8g) frac k rek( 4d, 6d, 5s, 8g) frac - ------------------------------------- ----- - ------------------------------------- ----- 2 -0.00008032 ryd = -8.8137 cm-1 -0.194 2 -0.00001450 ryd = -1.5915 cm-1 -0.949 ag i d10 6d -d9 5s8g 2 -0.0088 5 -0.0016 5 13 31 1 0.023 0.031 182.422 sec sqrtdel= 1.0000 1.0000 -0.0088 -0.0016 rcn mod 32 ee,eee= -0.01236 -0.03799 slater integrals for ag i d10 6d nconf=13 z= 47 ion= 0 exf=0.650 irel= 1 ag i d9 5s9g nconf=32 kut=-1 corrf=0.000 class 0 k rdk( 4d, 6d, 5s, 9g) frac k rek( 4d, 6d, 5s, 9g) frac - ------------------------------------- ----- - ------------------------------------- ----- 2 -0.00008712 ryd = -9.5599 cm-1 -0.248 2 -0.00001293 ryd = -1.4192 cm-1 -0.949 ag i d10 6d -d9 5s9g 2 -0.0096 5 -0.0014 5 13 32 1 0.023 0.023 182.477 sec sqrtdel= 1.0000 1.0000 -0.0096 -0.0014 rcn mod 32 ee,eee= -0.38785 -0.22573 slater integrals for ag i d10 6d nconf=13 z= 47 ion= 0 exf=0.650 irel= 1 ag i d9 5p2 nconf=41 kut=-1 corrf=0.000 class 0 k rdk( 4d, 6d, 5p, 5p) frac k rek( 4d, 6d, 5p, 5p) frac - ------------------------------------- ----- - ------------------------------------- ----- 1 -0.01830629 ryd = -2008.8828 cm-1 -0.757 1 -0.01830629 ryd = -2008.8828 cm-1 -0.757 3 -0.00832188 ryd = -913.2209 cm-1 -0.837 3 -0.00832188 ryd = -913.2209 cm-1 -0.837 ag i d10 6d -d9 5p2 2 -2.0089 5 -0.9132 5 13 41 9 0.516 0.039 183.055 sec sqrtdel= 1.0000 1.0000 -2.0089 -0.9132 rcn mod 32 ee,eee= -1.73019 -0.86509 ee,eee= -0.98467 -1.35743 slater integrals for ag i d10 7d nconf=14 z= 47 ion= 0 exf=0.650 irel= 1 ag i d9 5s5d nconf=17 kut=-1 corrf=0.000 class 0 k rdk( 4d, 4d, 4d, 5s) frac k rek( 4d, 4d, 4d, 5s) frac - ------------------------------------- ----- - ------------------------------------- ----- 2 0.00000000 ryd = 0.0000 cm-1 0.000 2 0.00000000 ryd = 0.0000 cm-1 0.000 ag i d10 7d -d9 5s5d 1 0.0000 5 14 17 17 0.563 0.016 183.641 sec rcn mod 32 ee,eee= -0.04051 -0.02026 ee,eee= -0.12010 -0.08031 slater integrals for ag i d10 7d nconf=14 z= 47 ion= 0 exf=0.650 irel= 1 ag i d9 5s5d nconf=17 kut=-1 corrf=0.000 class 0 k rdk( 4d, 7d, 5s, 5d) frac k rek( 4d, 7d, 5s, 5d) frac - ------------------------------------- ----- - ------------------------------------- ----- 2 -0.00524802 ryd = -575.9032 cm-1 -0.806 2 -0.00097479 ryd = -106.9709 cm-1 -0.511 ag i d10 7d -d9 5s5d 2 -0.5759 5 -0.1070 5 14 17 17 0.523 0.031 184.211 sec sqrtdel= 1.0000 1.0000 0.0000 -0.5759 -0.1070 rcn mod 32 ee,eee= -1.73019 -0.86509 ee,eee= -1.08362 -1.40690 slater integrals for ag i d10 7d nconf=14 z= 47 ion= 0 exf=0.650 irel= 1 ag i d9 5s6d nconf=18 kut=-1 corrf=0.000 class 0 k rdk( 4d, 4d, 4d, 5s) frac k rek( 4d, 4d, 4d, 5s) frac - ------------------------------------- ----- - ------------------------------------- ----- 2 0.00000000 ryd = 0.0000 cm-1 0.000 2 0.00000000 ryd = 0.0000 cm-1 0.000 ag i d10 7d -d9 5s6d 1 0.0000 5 14 18 18 0.539 0.008 184.781 sec rcn mod 32 ee,eee= -0.04051 -0.02026 ee,eee= -0.06554 -0.05303 slater integrals for ag i d10 7d nconf=14 z= 47 ion= 0 exf=0.650 irel= 1 ag i d9 5s6d nconf=18 kut=-1 corrf=0.000 class 0 k rdk( 4d, 7d, 5s, 6d) frac k rek( 4d, 7d, 5s, 6d) frac - ------------------------------------- ----- - ------------------------------------- ----- 2 -0.00384135 ryd = -421.5399 cm-1 -0.870 2 -0.00071602 ryd = -78.5738 cm-1 -0.508 ag i d10 7d -d9 5s6d 2 -0.4215 5 -0.0786 5 14 18 18 0.898 0.055 185.734 sec sqrtdel= 1.0000 1.0000 0.0000 -0.4215 -0.0786 rcn mod 32 ee,eee= -1.73019 -0.86509 ee,eee= -1.12961 -1.42990 slater integrals for ag i d10 7d nconf=14 z= 47 ion= 0 exf=0.650 irel= 1 ag i d9 5s7d nconf=19 kut=-1 corrf=0.000 class 0 k rdk( 4d, 4d, 4d, 5s) frac k rek( 4d, 4d, 4d, 5s) frac - ------------------------------------- ----- - ------------------------------------- ----- 2 -0.13757573 ryd = -15097.1904 cm-1 -0.475 2 -0.13757599 ryd = -15097.2194 cm-1 -0.475 ag i d10 7d -d9 5s7d 1 -15.0972 5 14 19 19 0.570 0.016 186.320 sec rcn mod 32 ee,eee= -0.04051 -0.02026 ee,eee= -0.04139 -0.04095 slater integrals for ag i d10 7d nconf=14 z= 47 ion= 0 exf=0.650 irel= 1 ag i d9 5s7d nconf=19 kut=-1 corrf=0.000 class 0 k rdk( 4d, 7d, 5s, 7d) frac k rek( 4d, 7d, 5s, 7d) frac - ------------------------------------- ----- - ------------------------------------- ----- 2 -0.00283949 ryd = -311.5979 cm-1 -0.892 2 -0.00053720 ryd = -58.9509 cm-1 -0.508 ag i d10 7d -d9 5s7d 2 -0.3116 5 -0.0590 5 14 19 19 0.672 0.070 187.063 sec sqrtdel= 1.0000 1.0000 -15.0972 -0.3116 -0.0590 rcn mod 32 ee,eee= -1.73019 -0.86509 ee,eee= -1.15460 -1.44240 slater integrals for ag i d10 7d nconf=14 z= 47 ion= 0 exf=0.650 irel= 1 ag i d9 5s8d nconf=20 kut=-1 corrf=0.000 class 0 k rdk( 4d, 4d, 4d, 5s) frac k rek( 4d, 4d, 4d, 5s) frac - ------------------------------------- ----- - ------------------------------------- ----- 2 0.00000000 ryd = 0.0000 cm-1 0.000 2 0.00000000 ryd = 0.0000 cm-1 0.000 ag i d10 7d -d9 5s8d 1 0.0000 5 14 20 20 1.023 0.008 188.094 sec rcn mod 32 ee,eee= -0.04051 -0.02026 ee,eee= -0.02853 -0.03452 slater integrals for ag i d10 7d nconf=14 z= 47 ion= 0 exf=0.650 irel= 1 ag i d9 5s8d nconf=20 kut=-1 corrf=0.000 class 0 k rdk( 4d, 7d, 5s, 8d) frac k rek( 4d, 7d, 5s, 8d) frac - ------------------------------------- ----- - ------------------------------------- ----- 2 -0.00205725 ryd = -225.7573 cm-1 -0.870 2 -0.00041825 ryd = -45.8975 cm-1 -0.508 ag i d10 7d -d9 5s8d 2 -0.2258 5 -0.0459 5 14 20 20 0.578 0.055 188.727 sec sqrtdel= 1.0000 1.0000 0.0000 -0.2258 -0.0459 rcn mod 32 ee,eee= -1.73019 -0.86509 ee,eee= -1.16965 -1.44992 slater integrals for ag i d10 7d nconf=14 z= 47 ion= 0 exf=0.650 irel= 1 ag i d9 5s9d nconf=21 kut=-1 corrf=0.000 class 0 k rdk( 4d, 4d, 4d, 5s) frac k rek( 4d, 4d, 4d, 5s) frac - ------------------------------------- ----- - ------------------------------------- ----- 2 0.00000000 ryd = 0.0000 cm-1 0.000 2 0.00000000 ryd = 0.0000 cm-1 0.000 ag i d10 7d -d9 5s9d 1 0.0000 5 14 21 21 0.594 0.023 189.344 sec rcn mod 32 ee,eee= -0.04051 -0.02026 ee,eee= -0.02086 -0.03069 slater integrals for ag i d10 7d nconf=14 z= 47 ion= 0 exf=0.650 irel= 1 ag i d9 5s9d nconf=21 kut=-1 corrf=0.000 class 0 k rdk( 4d, 7d, 5s, 9d) frac k rek( 4d, 7d, 5s, 9d) frac - ------------------------------------- ----- - ------------------------------------- ----- 2 -0.00159131 ryd = -174.6263 cm-1 -0.859 2 -0.00033629 ryd = -36.9033 cm-1 -0.508 ag i d10 7d -d9 5s9d 2 -0.1746 5 -0.0369 5 14 21 21 1.289 0.031 190.664 sec sqrtdel= 1.0000 1.0000 0.0000 -0.1746 -0.0369 rcn mod 32 ee,eee= -1.73019 -0.86509 ee,eee= -1.05985 -1.39502 slater integrals for ag i d10 7d nconf=14 z= 47 ion= 0 exf=0.650 irel= 1 ag i d8 5s2 5d nconf=22 kut=-1 corrf=0.000 class 0 k rdk( 4d, 4d, 5s, 5s) frac k rek( 4d, 4d, 5s, 5s) frac - ------------------------------------- ----- - ------------------------------------- ----- 2 0.00000000 ryd = 0.0000 cm-1 0.000 2 0.00000000 ryd = 0.0000 cm-1 0.000 ag i d10 7d -d8 5s2 5d 1 0.0000 5 14 22 22 0.719 0.125 191.516 sec sqrtdel= 1.0000 1.0000 0.0000 rcn mod 32 ee,eee= -0.04051 -0.02026 ee,eee= -0.04004 -0.04028 slater integrals for ag i d10 7d nconf=14 z= 47 ion= 0 exf=0.650 irel= 1 ag i d9 5s5g nconf=28 kut=-1 corrf=0.000 class 0 k rdk( 4d, 7d, 5s, 5g) frac k rek( 4d, 7d, 5s, 5g) frac - ------------------------------------- ----- - ------------------------------------- ----- 2 0.00000107 ryd = 0.1178 cm-1 0.002 2 -0.00001206 ryd = -1.3238 cm-1 -0.951 ag i d10 7d -d9 5s5g 2 0.0001 5 -0.0013 5 14 28 28 1.039 0.031 192.602 sec sqrtdel= 1.0000 1.0000 0.0001 -0.0013 rcn mod 32 ee,eee= -0.02782 -0.03417 slater integrals for ag i d10 7d nconf=14 z= 47 ion= 0 exf=0.650 irel= 1 ag i d9 5s6g nconf=29 kut=-1 corrf=0.000 class 0 k rdk( 4d, 7d, 5s, 6g) frac k rek( 4d, 7d, 5s, 6g) frac - ------------------------------------- ----- - ------------------------------------- ----- 2 0.00008476 ryd = 9.3012 cm-1 0.197 2 -0.00001281 ryd = -1.4062 cm-1 -0.950 ag i d10 7d -d9 5s6g 2 0.0093 5 -0.0014 5 14 29 1 0.023 0.031 192.672 sec sqrtdel= 1.0000 1.0000 0.0093 -0.0014 rcn mod 32 ee,eee= -0.02044 -0.03047 slater integrals for ag i d10 7d nconf=14 z= 47 ion= 0 exf=0.650 irel= 1 ag i d9 5s7g nconf=30 kut=-1 corrf=0.000 class 0 k rdk( 4d, 7d, 5s, 7g) frac k rek( 4d, 7d, 5s, 7g) frac - ------------------------------------- ----- - ------------------------------------- ----- 2 0.00004688 ryd = 5.1440 cm-1 0.131 2 -0.00001195 ryd = -1.3115 cm-1 -0.950 ag i d10 7d -d9 5s7g 2 0.0051 5 -0.0013 5 14 30 1 0.031 0.031 192.742 sec sqrtdel= 1.0000 1.0000 0.0051 -0.0013 rcn mod 32 ee,eee= -0.01565 -0.02808 slater integrals for ag i d10 7d nconf=14 z= 47 ion= 0 exf=0.650 irel= 1 ag i d9 5s8g nconf=31 kut=-1 corrf=0.000 class 0 k rdk( 4d, 7d, 5s, 8g) frac k rek( 4d, 7d, 5s, 8g) frac - ------------------------------------- ----- - ------------------------------------- ----- 2 0.00002201 ryd = 2.4153 cm-1 0.073 2 -0.00001076 ryd = -1.1807 cm-1 -0.950 ag i d10 7d -d9 5s8g 2 0.0024 5 -0.0012 5 14 31 1 0.031 0.039 192.813 sec sqrtdel= 1.0000 1.0000 0.0024 -0.0012 rcn mod 32 ee,eee= -0.01236 -0.02644 slater integrals for ag i d10 7d nconf=14 z= 47 ion= 0 exf=0.650 irel= 1 ag i d9 5s9g nconf=32 kut=-1 corrf=0.000 class 0 k rdk( 4d, 7d, 5s, 9g) frac k rek( 4d, 7d, 5s, 9g) frac - ------------------------------------- ----- - ------------------------------------- ----- 2 0.00000794 ryd = 0.8708 cm-1 0.031 2 -0.00000960 ryd = -1.0530 cm-1 -0.949 ag i d10 7d -d9 5s9g 2 0.0009 5 -0.0011 5 14 32 1 0.063 0.039 192.922 sec sqrtdel= 1.0000 1.0000 0.0009 -0.0011 rcn mod 32 ee,eee= -0.38785 -0.21418 slater integrals for ag i d10 7d nconf=14 z= 47 ion= 0 exf=0.650 irel= 1 ag i d9 5p2 nconf=41 kut=-1 corrf=0.000 class 0 k rdk( 4d, 7d, 5p, 5p) frac k rek( 4d, 7d, 5p, 5p) frac - ------------------------------------- ----- - ------------------------------------- ----- 1 -0.01325459 ryd = -1454.5234 cm-1 -0.751 1 -0.01325459 ryd = -1454.5234 cm-1 -0.751 3 -0.00618758 ryd = -679.0085 cm-1 -0.836 3 -0.00618758 ryd = -679.0085 cm-1 -0.836 ag i d10 7d -d9 5p2 2 -1.4545 5 -0.6790 5 14 41 9 0.289 0.063 193.305 sec sqrtdel= 1.0000 1.0000 -1.4545 -0.6790 rcn mod 32 ee,eee= -1.75421 -0.87710 ee,eee= -0.98467 -1.36944 slater integrals for ag i d10 8d nconf=15 z= 47 ion= 0 exf=0.650 irel= 1 ag i d9 5s5d nconf=17 kut=-1 corrf=0.000 class 0 k rdk( 4d, 4d, 4d, 5s) frac k rek( 4d, 4d, 4d, 5s) frac - ------------------------------------- ----- - ------------------------------------- ----- 2 0.00000000 ryd = 0.0000 cm-1 0.000 2 0.00000000 ryd = 0.0000 cm-1 0.000 ag i d10 8d -d9 5s5d 1 0.0000 5 15 17 17 0.477 0.211 193.992 sec rcn mod 32 ee,eee= -0.02805 -0.01402 ee,eee= -0.12010 -0.07408 slater integrals for ag i d10 8d nconf=15 z= 47 ion= 0 exf=0.650 irel= 1 ag i d9 5s5d nconf=17 kut=-1 corrf=0.000 class 0 k rdk( 4d, 8d, 5s, 5d) frac k rek( 4d, 8d, 5s, 5d) frac - ------------------------------------- ----- - ------------------------------------- ----- 2 -0.00389181 ryd = -427.0763 cm-1 -0.791 2 -0.00075621 ryd = -82.9848 cm-1 -0.508 ag i d10 8d -d9 5s5d 2 -0.4271 5 -0.0830 5 15 17 17 0.922 0.078 194.992 sec sqrtdel= 1.0000 1.0000 0.0000 -0.4271 -0.0830 rcn mod 32 ee,eee= -1.75421 -0.87710 ee,eee= -1.08362 -1.41891 slater integrals for ag i d10 8d nconf=15 z= 47 ion= 0 exf=0.650 irel= 1 ag i d9 5s6d nconf=18 kut=-1 corrf=0.000 class 0 k rdk( 4d, 4d, 4d, 5s) frac k rek( 4d, 4d, 4d, 5s) frac - ------------------------------------- ----- - ------------------------------------- ----- 2 0.00000000 ryd = 0.0000 cm-1 0.000 2 0.00000000 ryd = 0.0000 cm-1 0.000 ag i d10 8d -d9 5s6d 1 0.0000 5 15 18 18 0.516 0.000 195.516 sec rcn mod 32 ee,eee= -0.02805 -0.01402 ee,eee= -0.06554 -0.04679 slater integrals for ag i d10 8d nconf=15 z= 47 ion= 0 exf=0.650 irel= 1 ag i d9 5s6d nconf=18 kut=-1 corrf=0.000 class 0 k rdk( 4d, 8d, 5s, 6d) frac k rek( 4d, 8d, 5s, 6d) frac - ------------------------------------- ----- - ------------------------------------- ----- 2 -0.00286244 ryd = -314.1162 cm-1 -0.858 2 -0.00055598 ryd = -61.0118 cm-1 -0.505 ag i d10 8d -d9 5s6d 2 -0.3141 5 -0.0610 5 15 18 18 0.625 0.102 196.242 sec sqrtdel= 1.0000 1.0000 0.0000 -0.3141 -0.0610 rcn mod 32 ee,eee= -1.75421 -0.87710 ee,eee= -1.12961 -1.44191 slater integrals for ag i d10 8d nconf=15 z= 47 ion= 0 exf=0.650 irel= 1 ag i d9 5s7d nconf=19 kut=-1 corrf=0.000 class 0 k rdk( 4d, 4d, 4d, 5s) frac k rek( 4d, 4d, 4d, 5s) frac - ------------------------------------- ----- - ------------------------------------- ----- 2 0.00000000 ryd = 0.0000 cm-1 0.000 2 0.00000000 ryd = 0.0000 cm-1 0.000 ag i d10 8d -d9 5s7d 1 0.0000 5 15 19 19 0.531 0.172 196.945 sec rcn mod 32 ee,eee= -0.02805 -0.01402 ee,eee= -0.04139 -0.03472 slater integrals for ag i d10 8d nconf=15 z= 47 ion= 0 exf=0.650 irel= 1 ag i d9 5s7d nconf=19 kut=-1 corrf=0.000 class 0 k rdk( 4d, 8d, 5s, 7d) frac k rek( 4d, 8d, 5s, 7d) frac - ------------------------------------- ----- - ------------------------------------- ----- 2 -0.00211697 ryd = -232.3105 cm-1 -0.877 2 -0.00041731 ryd = -45.7948 cm-1 -0.505 ag i d10 8d -d9 5s7d 2 -0.2323 5 -0.0458 5 15 19 19 0.664 0.008 197.633 sec sqrtdel= 1.0000 1.0000 0.0000 -0.2323 -0.0458 rcn mod 32 ee,eee= -1.75421 -0.87710 ee,eee= -1.15460 -1.45440 slater integrals for ag i d10 8d nconf=15 z= 47 ion= 0 exf=0.650 irel= 1 ag i d9 5s8d nconf=20 kut=-1 corrf=0.000 class 0 k rdk( 4d, 4d, 4d, 5s) frac k rek( 4d, 4d, 4d, 5s) frac - ------------------------------------- ----- - ------------------------------------- ----- 2 -0.13763734 ryd = -15103.9510 cm-1 -0.475 2 -0.13763760 ryd = -15103.9800 cm-1 -0.475 ag i d10 8d -d9 5s8d 1 -15.1040 5 15 20 20 0.789 0.063 198.492 sec rcn mod 32 ee,eee= -0.02805 -0.01402 ee,eee= -0.02853 -0.02829 slater integrals for ag i d10 8d nconf=15 z= 47 ion= 0 exf=0.650 irel= 1 ag i d9 5s8d nconf=20 kut=-1 corrf=0.000 class 0 k rdk( 4d, 8d, 5s, 8d) frac k rek( 4d, 8d, 5s, 8d) frac - ------------------------------------- ----- - ------------------------------------- ----- 2 -0.00162761 ryd = -178.6095 cm-1 -0.888 2 -0.00032498 ryd = -35.6628 cm-1 -0.505 ag i d10 8d -d9 5s8d 2 -0.1786 5 -0.0357 5 15 20 20 1.109 0.039 199.641 sec sqrtdel= 1.0000 1.0000 -15.1040 -0.1786 -0.0357 rcn mod 32 ee,eee= -1.75421 -0.87710 ee,eee= -1.16965 -1.46193 slater integrals for ag i d10 8d nconf=15 z= 47 ion= 0 exf=0.650 irel= 1 ag i d9 5s9d nconf=21 kut=-1 corrf=0.000 class 0 k rdk( 4d, 4d, 4d, 5s) frac k rek( 4d, 4d, 4d, 5s) frac - ------------------------------------- ----- - ------------------------------------- ----- 2 0.00000000 ryd = 0.0000 cm-1 0.000 2 0.00000000 ryd = 0.0000 cm-1 0.000 ag i d10 8d -d9 5s9d 1 0.0000 5 15 21 21 0.578 0.016 200.250 sec rcn mod 32 ee,eee= -0.02805 -0.01402 ee,eee= -0.02086 -0.02445 slater integrals for ag i d10 8d nconf=15 z= 47 ion= 0 exf=0.650 irel= 1 ag i d9 5s9d nconf=21 kut=-1 corrf=0.000 class 0 k rdk( 4d, 8d, 5s, 9d) frac k rek( 4d, 8d, 5s, 9d) frac - ------------------------------------- ----- - ------------------------------------- ----- 2 -0.00125277 ryd = -137.4752 cm-1 -0.874 2 -0.00026134 ryd = -28.6782 cm-1 -0.505 ag i d10 8d -d9 5s9d 2 -0.1375 5 -0.0287 5 15 21 21 0.633 0.070 200.953 sec sqrtdel= 1.0000 1.0000 0.0000 -0.1375 -0.0287 rcn mod 32 ee,eee= -1.75421 -0.87710 ee,eee= -1.05985 -1.40703 slater integrals for ag i d10 8d nconf=15 z= 47 ion= 0 exf=0.650 irel= 1 ag i d8 5s2 5d nconf=22 kut=-1 corrf=0.000 class 0 k rdk( 4d, 4d, 5s, 5s) frac k rek( 4d, 4d, 5s, 5s) frac - ------------------------------------- ----- - ------------------------------------- ----- 2 0.00000000 ryd = 0.0000 cm-1 0.000 2 0.00000000 ryd = 0.0000 cm-1 0.000 ag i d10 8d -d8 5s2 5d 1 0.0000 5 15 22 22 1.313 0.016 202.281 sec sqrtdel= 1.0000 1.0000 0.0000 rcn mod 32 ee,eee= -0.02805 -0.01402 ee,eee= -0.04004 -0.03405 slater integrals for ag i d10 8d nconf=15 z= 47 ion= 0 exf=0.650 irel= 1 ag i d9 5s5g nconf=28 kut=-1 corrf=0.000 class 0 k rdk( 4d, 8d, 5s, 5g) frac k rek( 4d, 8d, 5s, 5g) frac - ------------------------------------- ----- - ------------------------------------- ----- 2 -0.00000225 ryd = -0.2473 cm-1 -0.006 2 -0.00000935 ryd = -1.0256 cm-1 -0.951 ag i d10 8d -d9 5s5g 2 -0.0002 5 -0.0010 5 15 28 28 0.750 0.055 203.117 sec sqrtdel= 1.0000 1.0000 -0.0002 -0.0010 rcn mod 32 ee,eee= -0.02782 -0.02793 slater integrals for ag i d10 8d nconf=15 z= 47 ion= 0 exf=0.650 irel= 1 ag i d9 5s6g nconf=29 kut=-1 corrf=0.000 class 0 k rdk( 4d, 8d, 5s, 6g) frac k rek( 4d, 8d, 5s, 6g) frac - ------------------------------------- ----- - ------------------------------------- ----- 2 0.00000077 ryd = 0.0847 cm-1 0.002 2 -0.00000993 ryd = -1.0896 cm-1 -0.950 ag i d10 8d -d9 5s6g 2 0.0001 5 -0.0011 5 15 29 1 0.086 0.023 203.227 sec sqrtdel= 1.0000 1.0000 0.0001 -0.0011 rcn mod 32 ee,eee= -0.02044 -0.02424 slater integrals for ag i d10 8d nconf=15 z= 47 ion= 0 exf=0.650 irel= 1 ag i d9 5s7g nconf=30 kut=-1 corrf=0.000 class 0 k rdk( 4d, 8d, 5s, 7g) frac k rek( 4d, 8d, 5s, 7g) frac - ------------------------------------- ----- - ------------------------------------- ----- 2 0.00003398 ryd = 3.7291 cm-1 0.132 2 -0.00000926 ryd = -1.0164 cm-1 -0.950 ag i d10 8d -d9 5s7g 2 0.0037 5 -0.0010 5 15 30 1 0.031 0.078 203.344 sec sqrtdel= 1.0000 1.0000 0.0037 -0.0010 rcn mod 32 ee,eee= -0.01565 -0.02185 slater integrals for ag i d10 8d nconf=15 z= 47 ion= 0 exf=0.650 irel= 1 ag i d9 5s8g nconf=31 kut=-1 corrf=0.000 class 0 k rdk( 4d, 8d, 5s, 8g) frac k rek( 4d, 8d, 5s, 8g) frac - ------------------------------------- ----- - ------------------------------------- ----- 2 0.00002708 ryd = 2.9715 cm-1 0.123 2 -0.00000834 ryd = -0.9151 cm-1 -0.949 ag i d10 8d -d9 5s8g 2 0.0030 5 -0.0009 5 15 31 1 0.023 0.023 203.414 sec sqrtdel= 1.0000 1.0000 0.0030 -0.0009 rcn mod 32 ee,eee= -0.01236 -0.02020 slater integrals for ag i d10 8d nconf=15 z= 47 ion= 0 exf=0.650 irel= 1 ag i d9 5s9g nconf=32 kut=-1 corrf=0.000 class 0 k rdk( 4d, 8d, 5s, 9g) frac k rek( 4d, 8d, 5s, 9g) frac - ------------------------------------- ----- - ------------------------------------- ----- 2 0.00001937 ryd = 2.1258 cm-1 0.103 2 -0.00000744 ryd = -0.8162 cm-1 -0.949 ag i d10 8d -d9 5s9g 2 0.0021 5 -0.0008 5 15 32 1 0.031 0.039 203.484 sec sqrtdel= 1.0000 1.0000 0.0021 -0.0008 rcn mod 32 ee,eee= -0.38785 -0.20795 slater integrals for ag i d10 8d nconf=15 z= 47 ion= 0 exf=0.650 irel= 1 ag i d9 5p2 nconf=41 kut=-1 corrf=0.000 class 0 k rdk( 4d, 8d, 5p, 5p) frac k rek( 4d, 8d, 5p, 5p) frac - ------------------------------------- ----- - ------------------------------------- ----- 1 -0.01014042 ryd = -1112.7825 cm-1 -0.748 1 -0.01014042 ryd = -1112.7825 cm-1 -0.748 3 -0.00480023 ryd = -526.7640 cm-1 -0.835 3 -0.00480023 ryd = -526.7640 cm-1 -0.835 ag i d10 8d -d9 5p2 2 -1.1128 5 -0.5268 5 15 41 9 0.234 0.031 203.781 sec sqrtdel= 1.0000 1.0000 -1.1128 -0.5268 rcn mod 32 ee,eee= -1.76875 -0.88437 ee,eee= -0.98467 -1.37671 slater integrals for ag i d10 9d nconf=16 z= 47 ion= 0 exf=0.650 irel= 1 ag i d9 5s5d nconf=17 kut=-1 corrf=0.000 class 0 k rdk( 4d, 4d, 4d, 5s) frac k rek( 4d, 4d, 4d, 5s) frac - ------------------------------------- ----- - ------------------------------------- ----- 2 0.00000000 ryd = 0.0000 cm-1 0.000 2 0.00000000 ryd = 0.0000 cm-1 0.000 ag i d10 9d -d9 5s5d 1 0.0000 5 16 17 17 0.734 0.016 204.531 sec rcn mod 32 ee,eee= -0.02057 -0.01029 ee,eee= -0.12010 -0.07034 slater integrals for ag i d10 9d nconf=16 z= 47 ion= 0 exf=0.650 irel= 1 ag i d9 5s5d nconf=17 kut=-1 corrf=0.000 class 0 k rdk( 4d, 9d, 5s, 5d) frac k rek( 4d, 9d, 5s, 5d) frac - ------------------------------------- ----- - ------------------------------------- ----- 2 -0.00304520 ryd = -334.1716 cm-1 -0.781 2 -0.00060837 ryd = -66.7612 cm-1 -0.506 ag i d10 9d -d9 5s5d 2 -0.3342 5 -0.0668 5 16 17 17 0.609 0.023 205.164 sec sqrtdel= 1.0000 1.0000 0.0000 -0.3342 -0.0668 rcn mod 32 ee,eee= -1.76875 -0.88437 ee,eee= -1.08362 -1.42618 slater integrals for ag i d10 9d nconf=16 z= 47 ion= 0 exf=0.650 irel= 1 ag i d9 5s6d nconf=18 kut=-1 corrf=0.000 class 0 k rdk( 4d, 4d, 4d, 5s) frac k rek( 4d, 4d, 4d, 5s) frac - ------------------------------------- ----- - ------------------------------------- ----- 2 0.00000000 ryd = 0.0000 cm-1 0.000 2 0.00000000 ryd = 0.0000 cm-1 0.000 ag i d10 9d -d9 5s6d 1 0.0000 5 16 18 18 0.500 0.016 205.680 sec rcn mod 32 ee,eee= -0.02057 -0.01029 ee,eee= -0.06554 -0.04306 slater integrals for ag i d10 9d nconf=16 z= 47 ion= 0 exf=0.650 irel= 1 ag i d9 5s6d nconf=18 kut=-1 corrf=0.000 class 0 k rdk( 4d, 9d, 5s, 6d) frac k rek( 4d, 9d, 5s, 6d) frac - ------------------------------------- ----- - ------------------------------------- ----- 2 -0.00224719 ryd = -246.6002 cm-1 -0.851 2 -0.00044757 ryd = -49.1156 cm-1 -0.504 ag i d10 9d -d9 5s6d 2 -0.2466 5 -0.0491 5 16 18 18 0.844 0.023 206.547 sec sqrtdel= 1.0000 1.0000 0.0000 -0.2466 -0.0491 rcn mod 32 ee,eee= -1.76875 -0.88437 ee,eee= -1.12961 -1.44918 slater integrals for ag i d10 9d nconf=16 z= 47 ion= 0 exf=0.650 irel= 1 ag i d9 5s7d nconf=19 kut=-1 corrf=0.000 class 0 k rdk( 4d, 4d, 4d, 5s) frac k rek( 4d, 4d, 4d, 5s) frac - ------------------------------------- ----- - ------------------------------------- ----- 2 0.00000000 ryd = 0.0000 cm-1 0.000 2 0.00000000 ryd = 0.0000 cm-1 0.000 ag i d10 9d -d9 5s7d 1 0.0000 5 16 19 19 0.875 0.031 207.492 sec rcn mod 32 ee,eee= -0.02057 -0.01029 ee,eee= -0.04139 -0.03098 slater integrals for ag i d10 9d nconf=16 z= 47 ion= 0 exf=0.650 irel= 1 ag i d9 5s7d nconf=19 kut=-1 corrf=0.000 class 0 k rdk( 4d, 9d, 5s, 7d) frac k rek( 4d, 9d, 5s, 7d) frac - ------------------------------------- ----- - ------------------------------------- ----- 2 -0.00166597 ryd = -182.8188 cm-1 -0.871 2 -0.00033605 ryd = -36.8772 cm-1 -0.504 ag i d10 9d -d9 5s7d 2 -0.1828 5 -0.0369 5 16 19 19 0.641 0.039 208.172 sec sqrtdel= 1.0000 1.0000 0.0000 -0.1828 -0.0369 rcn mod 32 ee,eee= -1.76875 -0.88437 ee,eee= -1.15460 -1.46167 slater integrals for ag i d10 9d nconf=16 z= 47 ion= 0 exf=0.650 irel= 1 ag i d9 5s8d nconf=20 kut=-1 corrf=0.000 class 0 k rdk( 4d, 4d, 4d, 5s) frac k rek( 4d, 4d, 4d, 5s) frac - ------------------------------------- ----- - ------------------------------------- ----- 2 0.00000000 ryd = 0.0000 cm-1 0.000 2 0.00000000 ryd = 0.0000 cm-1 0.000 ag i d10 9d -d9 5s8d 1 0.0000 5 16 20 20 0.984 0.063 209.227 sec rcn mod 32 ee,eee= -0.02057 -0.01029 ee,eee= -0.02853 -0.02455 slater integrals for ag i d10 9d nconf=16 z= 47 ion= 0 exf=0.650 irel= 1 ag i d9 5s8d nconf=20 kut=-1 corrf=0.000 class 0 k rdk( 4d, 9d, 5s, 8d) frac k rek( 4d, 9d, 5s, 8d) frac - ------------------------------------- ----- - ------------------------------------- ----- 2 -0.00128084 ryd = -140.5558 cm-1 -0.879 2 -0.00026174 ryd = -28.7229 cm-1 -0.504 ag i d10 9d -d9 5s8d 2 -0.1406 5 -0.0287 5 16 20 20 0.609 0.031 209.867 sec sqrtdel= 1.0000 1.0000 0.0000 -0.1406 -0.0287 rcn mod 32 ee,eee= -1.76875 -0.88437 ee,eee= -1.16965 -1.46920 slater integrals for ag i d10 9d nconf=16 z= 47 ion= 0 exf=0.650 irel= 1 ag i d9 5s9d nconf=21 kut=-1 corrf=0.000 class 0 k rdk( 4d, 4d, 4d, 5s) frac k rek( 4d, 4d, 4d, 5s) frac - ------------------------------------- ----- - ------------------------------------- ----- 2 -0.13766699 ryd = -15107.2055 cm-1 -0.475 2 -0.13766726 ryd = -15107.2345 cm-1 -0.475 ag i d10 9d -d9 5s9d 1 -15.1072 5 16 21 21 0.859 0.039 210.766 sec rcn mod 32 ee,eee= -0.02057 -0.01029 ee,eee= -0.02086 -0.02072 slater integrals for ag i d10 9d nconf=16 z= 47 ion= 0 exf=0.650 irel= 1 ag i d9 5s9d nconf=21 kut=-1 corrf=0.000 class 0 k rdk( 4d, 9d, 5s, 9d) frac k rek( 4d, 9d, 5s, 9d) frac - ------------------------------------- ----- - ------------------------------------- ----- 2 -0.00101968 ryd = -111.8964 cm-1 -0.885 2 -0.00021050 ryd = -23.0998 cm-1 -0.504 ag i d10 9d -d9 5s9d 2 -0.1119 5 -0.0231 5 16 21 21 0.891 0.023 211.680 sec sqrtdel= 1.0000 1.0000 -15.1072 -0.1119 -0.0231 rcn mod 32 ee,eee= -1.76875 -0.88437 ee,eee= -1.05985 -1.41430 slater integrals for ag i d10 9d nconf=16 z= 47 ion= 0 exf=0.650 irel= 1 ag i d8 5s2 5d nconf=22 kut=-1 corrf=0.000 class 0 k rdk( 4d, 4d, 5s, 5s) frac k rek( 4d, 4d, 5s, 5s) frac - ------------------------------------- ----- - ------------------------------------- ----- 2 0.00000000 ryd = 0.0000 cm-1 0.000 2 0.00000000 ryd = 0.0000 cm-1 0.000 ag i d10 9d -d8 5s2 5d 1 0.0000 5 16 22 22 0.641 0.031 212.367 sec sqrtdel= 1.0000 1.0000 0.0000 rcn mod 32 ee,eee= -0.02057 -0.01029 ee,eee= -0.04004 -0.03031 slater integrals for ag i d10 9d nconf=16 z= 47 ion= 0 exf=0.650 irel= 1 ag i d9 5s5g nconf=28 kut=-1 corrf=0.000 class 0 k rdk( 4d, 9d, 5s, 5g) frac k rek( 4d, 9d, 5s, 5g) frac - ------------------------------------- ----- - ------------------------------------- ----- 2 -0.00000301 ryd = -0.3300 cm-1 -0.011 2 -0.00000751 ryd = -0.8245 cm-1 -0.951 ag i d10 9d -d9 5s5g 2 -0.0003 5 -0.0008 5 16 28 28 0.750 0.078 213.211 sec sqrtdel= 1.0000 1.0000 -0.0003 -0.0008 rcn mod 32 ee,eee= -0.02782 -0.02420 slater integrals for ag i d10 9d nconf=16 z= 47 ion= 0 exf=0.650 irel= 1 ag i d9 5s6g nconf=29 kut=-1 corrf=0.000 class 0 k rdk( 4d, 9d, 5s, 6g) frac k rek( 4d, 9d, 5s, 6g) frac - ------------------------------------- ----- - ------------------------------------- ----- 2 -0.00000119 ryd = -0.1311 cm-1 -0.005 2 -0.00000798 ryd = -0.8761 cm-1 -0.951 ag i d10 9d -d9 5s6g 2 -0.0001 5 -0.0009 5 16 29 1 0.320 0.023 213.570 sec sqrtdel= 1.0000 1.0000 -0.0001 -0.0009 rcn mod 32 ee,eee= -0.02044 -0.02051 slater integrals for ag i d10 9d nconf=16 z= 47 ion= 0 exf=0.650 irel= 1 ag i d9 5s7g nconf=30 kut=-1 corrf=0.000 class 0 k rdk( 4d, 9d, 5s, 7g) frac k rek( 4d, 9d, 5s, 7g) frac - ------------------------------------- ----- - ------------------------------------- ----- 2 0.00000057 ryd = 0.0629 cm-1 0.003 2 -0.00000745 ryd = -0.8173 cm-1 -0.950 ag i d10 9d -d9 5s7g 2 0.0001 5 -0.0008 5 16 30 1 0.063 0.016 213.672 sec sqrtdel= 1.0000 1.0000 0.0001 -0.0008 rcn mod 32 ee,eee= -0.01565 -0.01811 slater integrals for ag i d10 9d nconf=16 z= 47 ion= 0 exf=0.650 irel= 1 ag i d9 5s8g nconf=31 kut=-1 corrf=0.000 class 0 k rdk( 4d, 9d, 5s, 8g) frac k rek( 4d, 9d, 5s, 8g) frac - ------------------------------------- ----- - ------------------------------------- ----- 2 0.00001528 ryd = 1.6772 cm-1 0.091 2 -0.00000671 ryd = -0.7359 cm-1 -0.950 ag i d10 9d -d9 5s8g 2 0.0017 5 -0.0007 5 16 31 1 0.031 0.063 213.773 sec sqrtdel= 1.0000 1.0000 0.0017 -0.0007 rcn mod 32 ee,eee= -0.01236 -0.01647 slater integrals for ag i d10 9d nconf=16 z= 47 ion= 0 exf=0.650 irel= 1 ag i d9 5s9g nconf=32 kut=-1 corrf=0.000 class 0 k rdk( 4d, 9d, 5s, 9g) frac k rek( 4d, 9d, 5s, 9g) frac - ------------------------------------- ----- - ------------------------------------- ----- 2 0.00001458 ryd = 1.5995 cm-1 0.101 2 -0.00000598 ryd = -0.6564 cm-1 -0.949 ag i d10 9d -d9 5s9g 2 0.0016 5 -0.0007 5 16 32 1 0.031 0.016 213.820 sec sqrtdel= 1.0000 1.0000 0.0016 -0.0007 rcn mod 32 ee,eee= -0.38785 -0.20421 slater integrals for ag i d10 9d nconf=16 z= 47 ion= 0 exf=0.650 irel= 1 ag i d9 5p2 nconf=41 kut=-1 corrf=0.000 class 0 k rdk( 4d, 9d, 5p, 5p) frac k rek( 4d, 9d, 5p, 5p) frac - ------------------------------------- ----- - ------------------------------------- ----- 1 -0.00808802 ryd = -887.5578 cm-1 -0.745 1 -0.00808802 ryd = -887.5578 cm-1 -0.745 3 -0.00386389 ryd = -424.0131 cm-1 -0.834 3 -0.00386389 ryd = -424.0131 cm-1 -0.834 ag i d10 9d -d9 5p2 2 -0.8876 5 -0.4240 5 16 41 9 0.211 0.109 214.172 sec sqrtdel= 1.0000 1.0000 -0.8876 -0.4240 rcn mod 32 ee,eee= -0.12010 -0.06005 ee,eee= -0.06554 -0.09282 slater integrals for ag i d9 5s5d nconf=17 z= 47 ion= 0 exf=0.650 irel= 1 ag i d9 5s6d nconf=18 kut=-1 corrf=0.000 class 11 k rdk( 4d, 5d, 4d, 6d) frac k rek( 4d, 5d, 4d, 6d) frac - ------------------------------------- ----- - ------------------------------------- ----- 0 0.05860817 ryd = 6431.5028 cm-1 0.462 0 0.00191771 ryd = 210.4448 cm-1 0.333 2 0.00784980 ryd = 861.4157 cm-1 0.936 2 0.00183977 ryd = 201.8910 cm-1 0.776 4 0.00246152 ryd = 270.1201 cm-1 0.996 4 0.00137992 ryd = 151.4283 cm-1 0.919 - ------------------------------------- ----- - ------------------------------------- ----- 0 0.05860804 ryd = 6431.4890 cm-1 0.462 0 0.00191735 ryd = 210.4049 cm-1 0.332 2 0.00785052 ryd = 861.4952 cm-1 0.936 2 0.00184022 ryd = 201.9411 cm-1 0.776 4 0.00246192 ryd = 270.1647 cm-1 0.996 4 0.00138023 ryd = 151.4627 cm-1 0.919 - ------------------------------------- ----- - ------------------------------------- ----- 0 0.05860830 ryd = 6431.5170 cm-1 0.462 0 0.00191807 ryd = 210.4836 cm-1 0.333 2 0.00784908 ryd = 861.3365 cm-1 0.936 2 0.00183934 ryd = 201.8447 cm-1 0.776 4 0.00246111 ryd = 270.0756 cm-1 0.996 4 0.00137962 ryd = 151.3955 cm-1 0.919 - ------------------------------------- ----- - ------------------------------------- ----- 0 0.05860817 ryd = 6431.5030 cm-1 0.462 0 0.00191771 ryd = 210.4443 cm-1 0.333 2 0.00784980 ryd = 861.4159 cm-1 0.936 2 0.00183978 ryd = 201.8929 cm-1 0.776 4 0.00246152 ryd = 270.1202 cm-1 0.996 4 0.00137992 ryd = 151.4291 cm-1 0.919 9.00000 0.01726 2.00000 0.00000 2.00000 0.00000 -0.09282 0.00000 9.00000 0.01656 2.00000 2.00000 2.00000 0.00000 -0.09282 0.00000 9.00000 0.01242 2.00000 4.00000 2.00000 0.00000 -0.09282 0.00000 ag i d9 5s5d -d9 5s6d 6 0.0000 5 0.8614 5 0.2701 5 0.2104 5 0.2019 5 0.1514 5 17 18 18 0.828 0.273 215.297 sec rcn mod 32 ee,eee= -0.12010 -0.06005 ee,eee= -0.06554 -0.09282 slater integrals for ag i d9 5s5d nconf=17 z= 47 ion= 0 exf=0.650 irel= 1 ag i d9 5s6d nconf=18 kut=-1 corrf=0.000 class 11 k rdk( 5s, 5d, 5s, 6d) frac k rek( 5s, 5d, 5s, 6d) frac - ------------------------------------- ----- - ------------------------------------- ----- 0 0.05631923 ryd = 6180.3206 cm-1 0.452 2 0.00844268 ryd = 926.4768 cm-1 0.950 - ------------------------------------- ----- - ------------------------------------- ----- 0 0.05630968 ryd = 6179.2732 cm-1 0.452 2 0.00851782 ryd = 934.7222 cm-1 0.951 - ------------------------------------- ----- - ------------------------------------- ----- 0 0.05633026 ryd = 6181.5316 cm-1 0.452 2 0.00837597 ryd = 919.1568 cm-1 0.950 - ------------------------------------- ----- - ------------------------------------- ----- 0 0.05631997 ryd = 6180.4024 cm-1 0.452 2 0.00844690 ryd = 926.9395 cm-1 0.950 1.00000 0.00845 0.00000 2.00000 2.00000 0.00000 -0.09282 0.00000 ag i d9 5s5d -d9 5s6d 2 0.0000 5 0.9265 5 17 18 18 0.977 0.148 216.430 sec sqrtdel= 1.0000 1.0000 0.0000 0.8614 0.2701 0.2104 0.2019 0.1514 0.0000 0.9265 rcn mod 32 ee,eee= -0.12010 -0.06005 ee,eee= -0.04139 -0.08075 slater integrals for ag i d9 5s5d nconf=17 z= 47 ion= 0 exf=0.650 irel= 1 ag i d9 5s7d nconf=19 kut=-1 corrf=0.000 class 11 k rdk( 4d, 5d, 4d, 7d) frac k rek( 4d, 5d, 4d, 7d) frac - ------------------------------------- ----- - ------------------------------------- ----- 0 0.03313640 ryd = 3636.2993 cm-1 0.393 0 0.00143660 ryd = 157.6488 cm-1 0.331 2 0.00543859 ryd = 596.8165 cm-1 0.911 2 0.00138315 ryd = 151.7832 cm-1 0.774 4 0.00181991 ryd = 199.7124 cm-1 0.994 4 0.00103860 ryd = 113.9735 cm-1 0.918 - ------------------------------------- ----- - ------------------------------------- ----- 0 0.03313625 ryd = 3636.2826 cm-1 0.393 0 0.00143619 ryd = 157.6033 cm-1 0.331 2 0.00543935 ryd = 596.8993 cm-1 0.911 2 0.00138367 ryd = 151.8397 cm-1 0.774 4 0.00182036 ryd = 199.7616 cm-1 0.994 4 0.00103896 ryd = 114.0124 cm-1 0.918 - ------------------------------------- ----- - ------------------------------------- ----- 0 0.03313656 ryd = 3636.3165 cm-1 0.393 0 0.00143701 ryd = 157.6939 cm-1 0.331 2 0.00543784 ryd = 596.7340 cm-1 0.912 2 0.00138269 ryd = 151.7332 cm-1 0.774 4 0.00181947 ryd = 199.6633 cm-1 0.994 4 0.00103827 ryd = 113.9371 cm-1 0.918 - ------------------------------------- ----- - ------------------------------------- ----- 0 0.03313640 ryd = 3636.2995 cm-1 0.393 0 0.00143660 ryd = 157.6486 cm-1 0.331 2 0.00543859 ryd = 596.8167 cm-1 0.912 2 0.00138318 ryd = 151.7864 cm-1 0.774 4 0.00181991 ryd = 199.7125 cm-1 0.994 4 0.00103861 ryd = 113.9748 cm-1 0.918 9.00000 0.01293 2.00000 0.00000 2.00000 0.00000 -0.08075 0.00000 9.00000 0.01245 2.00000 2.00000 2.00000 0.00000 -0.08075 0.00000 9.00000 0.00935 2.00000 4.00000 2.00000 0.00000 -0.08075 0.00000 ag i d9 5s5d -d9 5s7d 6 0.0000 5 0.5968 5 0.1997 5 0.1576 5 0.1518 5 0.1140 5 17 19 19 0.523 0.125 217.102 sec rcn mod 32 ee,eee= -0.12010 -0.06005 ee,eee= -0.04139 -0.08075 slater integrals for ag i d9 5s5d nconf=17 z= 47 ion= 0 exf=0.650 irel= 1 ag i d9 5s7d nconf=19 kut=-1 corrf=0.000 class 11 k rdk( 5s, 5d, 5s, 7d) frac k rek( 5s, 5d, 5s, 7d) frac - ------------------------------------- ----- - ------------------------------------- ----- 0 0.03141466 ryd = 3447.3602 cm-1 0.380 2 0.00622244 ryd = 682.8343 cm-1 0.950 - ------------------------------------- ----- - ------------------------------------- ----- 0 0.03140480 ryd = 3446.2778 cm-1 0.380 2 0.00629737 ryd = 691.0559 cm-1 0.950 - ------------------------------------- ----- - ------------------------------------- ----- 0 0.03142605 ryd = 3448.6101 cm-1 0.380 2 0.00615941 ryd = 675.9167 cm-1 0.949 - ------------------------------------- ----- - ------------------------------------- ----- 0 0.03141542 ryd = 3447.4439 cm-1 0.380 2 0.00622839 ryd = 683.4863 cm-1 0.949 1.00000 0.00623 0.00000 2.00000 2.00000 0.00000 -0.08075 0.00000 ag i d9 5s5d -d9 5s7d 2 0.0000 5 0.6828 5 17 19 19 0.523 0.125 217.766 sec sqrtdel= 1.0000 1.0000 0.0000 0.5968 0.1997 0.1576 0.1518 0.1140 0.0000 0.6828 rcn mod 32 ee,eee= -0.12010 -0.06005 ee,eee= -0.02853 -0.07432 slater integrals for ag i d9 5s5d nconf=17 z= 47 ion= 0 exf=0.650 irel= 1 ag i d9 5s8d nconf=20 kut=-1 corrf=0.000 class 11 k rdk( 4d, 5d, 4d, 8d) frac k rek( 4d, 5d, 4d, 8d) frac - ------------------------------------- ----- - ------------------------------------- ----- 0 0.02233890 ryd = 2451.4110 cm-1 0.359 0 0.00111787 ryd = 122.6719 cm-1 0.330 2 0.00406407 ryd = 445.9802 cm-1 0.899 2 0.00107832 ryd = 118.3324 cm-1 0.773 4 0.00140593 ryd = 154.2828 cm-1 0.992 4 0.00081022 ryd = 88.9112 cm-1 0.917 - ------------------------------------- ----- - ------------------------------------- ----- 0 0.02233876 ryd = 2451.3951 cm-1 0.359 0 0.00111749 ryd = 122.6302 cm-1 0.330 2 0.00406472 ryd = 446.0520 cm-1 0.898 2 0.00107879 ryd = 118.3837 cm-1 0.773 4 0.00140633 ryd = 154.3269 cm-1 0.992 4 0.00081054 ryd = 88.9466 cm-1 0.917 - ------------------------------------- ----- - ------------------------------------- ----- 0 0.02233905 ryd = 2451.4271 cm-1 0.359 0 0.00111825 ryd = 122.7134 cm-1 0.330 2 0.00406342 ryd = 445.9087 cm-1 0.899 2 0.00107792 ryd = 118.2879 cm-1 0.773 4 0.00140553 ryd = 154.2389 cm-1 0.992 4 0.00080992 ryd = 88.8784 cm-1 0.917 - ------------------------------------- ----- - ------------------------------------- ----- 0 0.02233890 ryd = 2451.4111 cm-1 0.359 0 0.00111787 ryd = 122.6718 cm-1 0.330 2 0.00406407 ryd = 445.9803 cm-1 0.899 2 0.00107836 ryd = 118.3358 cm-1 0.773 4 0.00140593 ryd = 154.2829 cm-1 0.992 4 0.00081023 ryd = 88.9125 cm-1 0.917 9.00000 0.01006 2.00000 0.00000 2.00000 0.00000 -0.07432 0.00000 9.00000 0.00971 2.00000 2.00000 2.00000 0.00000 -0.07432 0.00000 9.00000 0.00729 2.00000 4.00000 2.00000 0.00000 -0.07432 0.00000 ag i d9 5s5d -d9 5s8d 6 0.0000 5 0.4460 5 0.1543 5 0.1227 5 0.1183 5 0.0889 5 17 20 20 1.000 0.211 218.984 sec rcn mod 32 ee,eee= -0.12010 -0.06005 ee,eee= -0.02853 -0.07432 slater integrals for ag i d9 5s5d nconf=17 z= 47 ion= 0 exf=0.650 irel= 1 ag i d9 5s8d nconf=20 kut=-1 corrf=0.000 class 11 k rdk( 5s, 5d, 5s, 8d) frac k rek( 5s, 5d, 5s, 8d) frac - ------------------------------------- ----- - ------------------------------------- ----- 0 0.02099598 ryd = 2304.0422 cm-1 0.345 2 0.00479641 ryd = 526.3452 cm-1 0.949 - ------------------------------------- ----- - ------------------------------------- ----- 0 0.02098741 ryd = 2303.1018 cm-1 0.345 2 0.00485983 ryd = 533.3046 cm-1 0.950 - ------------------------------------- ----- - ------------------------------------- ----- 0 0.02100578 ryd = 2305.1175 cm-1 0.345 2 0.00474465 ryd = 520.6656 cm-1 0.949 - ------------------------------------- ----- - ------------------------------------- ----- 0 0.02099659 ryd = 2304.1096 cm-1 0.345 2 0.00480224 ryd = 526.9851 cm-1 0.949 1.00000 0.00480 0.00000 2.00000 2.00000 0.00000 -0.07432 0.00000 ag i d9 5s5d -d9 5s8d 2 0.0000 5 0.5263 5 17 20 20 0.695 0.063 219.742 sec sqrtdel= 1.0000 1.0000 0.0000 0.4460 0.1543 0.1227 0.1183 0.0889 0.0000 0.5263 rcn mod 32 ee,eee= -0.12010 -0.06005 ee,eee= -0.02086 -0.07048 slater integrals for ag i d9 5s5d nconf=17 z= 47 ion= 0 exf=0.650 irel= 1 ag i d9 5s9d nconf=21 kut=-1 corrf=0.000 class 11 k rdk( 4d, 5d, 4d, 9d) frac k rek( 4d, 5d, 4d, 9d) frac - ------------------------------------- ----- - ------------------------------------- ----- 0 0.01643819 ryd = 1803.8825 cm-1 0.339 0 0.00089867 ryd = 98.6180 cm-1 0.329 2 0.00318744 ryd = 349.7810 cm-1 0.890 2 0.00086786 ryd = 95.2371 cm-1 0.773 4 0.00112507 ryd = 123.4623 cm-1 0.991 4 0.00065234 ryd = 71.5859 cm-1 0.917 - ------------------------------------- ----- - ------------------------------------- ----- 0 0.01643806 ryd = 1803.8686 cm-1 0.339 0 0.00089834 ryd = 98.5817 cm-1 0.329 2 0.00318799 ryd = 349.8413 cm-1 0.890 2 0.00086827 ryd = 95.2815 cm-1 0.773 4 0.00112542 ryd = 123.5001 cm-1 0.991 4 0.00065262 ryd = 71.6167 cm-1 0.917 - ------------------------------------- ----- - ------------------------------------- ----- 0 0.01643832 ryd = 1803.8968 cm-1 0.339 0 0.00089900 ryd = 98.6542 cm-1 0.330 2 0.00318689 ryd = 349.7211 cm-1 0.890 2 0.00086752 ryd = 95.1991 cm-1 0.773 4 0.00112473 ryd = 123.4248 cm-1 0.991 4 0.00065208 ryd = 71.5577 cm-1 0.917 - ------------------------------------- ----- - ------------------------------------- ----- 0 0.01643819 ryd = 1803.8827 cm-1 0.339 0 0.00089867 ryd = 98.6180 cm-1 0.330 2 0.00318744 ryd = 349.7812 cm-1 0.890 2 0.00086789 ryd = 95.2403 cm-1 0.773 4 0.00112507 ryd = 123.4624 cm-1 0.991 4 0.00065235 ryd = 71.5872 cm-1 0.917 9.00000 0.00809 2.00000 0.00000 2.00000 0.00000 -0.07048 0.00000 9.00000 0.00781 2.00000 2.00000 2.00000 0.00000 -0.07048 0.00000 9.00000 0.00587 2.00000 4.00000 2.00000 0.00000 -0.07048 0.00000 ag i d9 5s5d -d9 5s9d 6 0.0000 5 0.3498 5 0.1235 5 0.0986 5 0.0952 5 0.0716 5 17 21 21 0.594 0.406 220.750 sec rcn mod 32 ee,eee= -0.12010 -0.06005 ee,eee= -0.02086 -0.07048 slater integrals for ag i d9 5s5d nconf=17 z= 47 ion= 0 exf=0.650 irel= 1 ag i d9 5s9d nconf=21 kut=-1 corrf=0.000 class 11 k rdk( 5s, 5d, 5s, 9d) frac k rek( 5s, 5d, 5s, 9d) frac - ------------------------------------- ----- - ------------------------------------- ----- 0 0.01535698 ryd = 1685.2335 cm-1 0.324 2 0.00383233 ryd = 420.5495 cm-1 0.949 - ------------------------------------- ----- - ------------------------------------- ----- 0 0.01534974 ryd = 1684.4392 cm-1 0.324 2 0.00388493 ryd = 426.3216 cm-1 0.950 - ------------------------------------- ----- - ------------------------------------- ----- 0 0.01536518 ryd = 1686.1338 cm-1 0.324 2 0.00379024 ryd = 415.9310 cm-1 0.948 - ------------------------------------- ----- - ------------------------------------- ----- 0 0.01535746 ryd = 1685.2865 cm-1 0.324 2 0.00383759 ryd = 421.1263 cm-1 0.948 1.00000 0.00384 0.00000 2.00000 2.00000 0.00000 -0.07048 0.00000 ag i d9 5s5d -d9 5s9d 2 0.0000 5 0.4205 5 17 21 21 0.578 0.086 221.430 sec sqrtdel= 1.0000 1.0000 0.0000 0.3498 0.1235 0.0986 0.0952 0.0716 0.0000 0.4205 rcn mod 32 ee,eee= -1.87534 -0.93767 ee,eee= -1.05985 -1.46759 slater integrals for ag i d9 5s5d nconf=17 z= 47 ion= 0 exf=0.650 irel= 1 ag i d8 5s2 5d nconf=22 kut=-1 corrf=0.000 class 0 k rdk( 4d, 4d, 4d, 5s) frac k rek( 4d, 4d, 4d, 5s) frac - ------------------------------------- ----- - ------------------------------------- ----- 2 -0.13180719 ryd = -14464.1660 cm-1 -0.438 2 -0.13180747 ryd = -14464.1972 cm-1 -0.438 ag i d9 5s5d -d8 5s2 5d 1 -14.4642 5 17 22 22 0.734 0.031 222.211 sec rcn mod 32 ee,eee= -0.12010 -0.06005 ee,eee= -0.12522 -0.12266 slater integrals for ag i d9 5s5d nconf=17 z= 47 ion= 0 exf=0.650 irel= 1 ag i d8 5s2 5d nconf=22 kut=-1 corrf=0.000 class 0 k rdk( 4d, 5d, 5s, 5d) frac k rek( 4d, 5d, 5s, 5d) frac - ------------------------------------- ----- - ------------------------------------- ----- 2 -0.01369095 ryd = -1502.4078 cm-1 -0.894 2 -0.00112022 ryd = -122.9300 cm-1 -0.296 ag i d9 5s5d -d8 5s2 5d 2 -1.5024 5 -0.1229 5 17 22 22 1.484 0.039 223.750 sec sqrtdel= 1.0000 1.0000 -14.4642 -1.5024 -0.1229 rcn mod 32 ee,eee= -0.12010 -0.06005 ee,eee= -0.04001 -0.08006 slater integrals for ag i d9 5s5d nconf=17 z= 47 ion= 0 exf=0.650 irel= 1 ag i d10 5g nconf=23 kut=-1 corrf=0.000 class 0 k rdk( 5s, 5d, 4d, 5g) frac k rek( 5s, 5d, 4d, 5g) frac - ------------------------------------- ----- - ------------------------------------- ----- 2 -0.00099991 ryd = -109.7278 cm-1 -0.961 4 -0.00001970 ryd = -2.1618 cm-1 -0.930 ag i d9 5s5d -d10 5g 2 -0.1097 5 -0.0022 5 17 23 23 0.625 0.055 224.445 sec sqrtdel= 1.0000 1.0000 -0.1097 -0.0022 rcn mod 32 ee,eee= -0.02779 -0.07395 slater integrals for ag i d9 5s5d nconf=17 z= 47 ion= 0 exf=0.650 irel= 1 ag i d10 6g nconf=24 kut=-1 corrf=0.000 class 0 k rdk( 5s, 5d, 4d, 6g) frac k rek( 5s, 5d, 4d, 6g) frac - ------------------------------------- ----- - ------------------------------------- ----- 2 -0.00093983 ryd = -103.1340 cm-1 -0.960 4 -0.00002068 ryd = -2.2695 cm-1 -0.928 ag i d9 5s5d -d10 6g 2 -0.1031 5 -0.0023 5 17 24 1 0.031 0.016 224.492 sec sqrtdel= 1.0000 1.0000 -0.1031 -0.0023 rcn mod 32 ee,eee= -0.02042 -0.07026 slater integrals for ag i d9 5s5d nconf=17 z= 47 ion= 0 exf=0.650 irel= 1 ag i d10 7g nconf=25 kut=-1 corrf=0.000 class 0 k rdk( 5s, 5d, 4d, 7g) frac k rek( 5s, 5d, 4d, 7g) frac - ------------------------------------- ----- - ------------------------------------- ----- 2 -0.00081700 ryd = -89.6549 cm-1 -0.959 4 -0.00001914 ryd = -2.1008 cm-1 -0.927 ag i d9 5s5d -d10 7g 2 -0.0897 5 -0.0021 5 17 25 1 0.039 0.023 224.555 sec sqrtdel= 1.0000 1.0000 -0.0897 -0.0021 rcn mod 32 ee,eee= -0.01563 -0.06787 slater integrals for ag i d9 5s5d nconf=17 z= 47 ion= 0 exf=0.650 irel= 1 ag i d10 8g nconf=26 kut=-1 corrf=0.000 class 0 k rdk( 5s, 5d, 4d, 8g) frac k rek( 5s, 5d, 4d, 8g) frac - ------------------------------------- ----- - ------------------------------------- ----- 2 -0.00070303 ryd = -77.1482 cm-1 -0.958 4 -0.00001714 ryd = -1.8809 cm-1 -0.927 ag i d9 5s5d -d10 8g 2 -0.0771 5 -0.0019 5 17 26 1 0.039 0.047 224.641 sec sqrtdel= 1.0000 1.0000 -0.0771 -0.0019 rcn mod 32 ee,eee= -0.01235 -0.06623 slater integrals for ag i d9 5s5d nconf=17 z= 47 ion= 0 exf=0.650 irel= 1 ag i d10 9g nconf=27 kut=-1 corrf=0.000 class 0 k rdk( 5s, 5d, 4d, 9g) frac k rek( 5s, 5d, 4d, 9g) frac - ------------------------------------- ----- - ------------------------------------- ----- 2 -0.00060779 ryd = -66.6967 cm-1 -0.957 4 -0.00001522 ryd = -1.6704 cm-1 -0.927 ag i d9 5s5d -d10 9g 2 -0.0667 5 -0.0017 5 17 27 1 0.031 0.023 224.695 sec sqrtdel= 1.0000 1.0000 -0.0667 -0.0017 rcn mod 32 ee,eee= -0.12010 -0.06005 ee,eee= -0.04004 -0.08007 slater integrals for ag i d9 5s5d nconf=17 z= 47 ion= 0 exf=0.650 irel= 1 ag i d9 5s5g nconf=28 kut=-1 corrf=0.000 class 0 k rdk( 4d, 5d, 4d, 5g) frac k rek( 4d, 5d, 4d, 5g) frac - ------------------------------------- ----- - ------------------------------------- ----- 2 0.00068929 ryd = 75.6405 cm-1 0.998 2 0.00000269 ryd = 0.2957 cm-1 0.434 4 0.00004053 ryd = 4.4475 cm-1 0.983 4 0.00000225 ryd = 0.2473 cm-1 0.638 ag i d9 5s5d -d9 5s5g 4 0.0756 5 0.0044 5 0.0003 5 0.0002 5 17 28 28 1.148 0.086 225.930 sec sqrtdel= 1.0000 1.0000 0.0756 0.0044 0.0003 0.0002 rcn mod 32 ee,eee= -0.02782 -0.07396 slater integrals for ag i d9 5s5d nconf=17 z= 47 ion= 0 exf=0.650 irel= 1 ag i d9 5s6g nconf=29 kut=-1 corrf=0.000 class 0 k rdk( 4d, 5d, 4d, 6g) frac k rek( 4d, 5d, 4d, 6g) frac - ------------------------------------- ----- - ------------------------------------- ----- 2 0.00064900 ryd = 71.2199 cm-1 0.997 2 0.00000285 ryd = 0.3132 cm-1 0.427 4 0.00004095 ryd = 4.4941 cm-1 0.981 4 0.00000240 ryd = 0.2635 cm-1 0.631 ag i d9 5s5d -d9 5s6g 4 0.0712 5 0.0045 5 0.0003 5 0.0003 5 17 29 1 0.031 0.023 226.016 sec sqrtdel= 1.0000 1.0000 0.0712 0.0045 0.0003 0.0003 rcn mod 32 ee,eee= -0.02044 -0.07027 slater integrals for ag i d9 5s5d nconf=17 z= 47 ion= 0 exf=0.650 irel= 1 ag i d9 5s7g nconf=30 kut=-1 corrf=0.000 class 0 k rdk( 4d, 5d, 4d, 7g) frac k rek( 4d, 5d, 4d, 7g) frac - ------------------------------------- ----- - ------------------------------------- ----- 2 0.00056495 ryd = 61.9961 cm-1 0.996 2 0.00000266 ryd = 0.2918 cm-1 0.423 4 0.00003710 ryd = 4.0717 cm-1 0.980 4 0.00000224 ryd = 0.2463 cm-1 0.627 ag i d9 5s5d -d9 5s7g 4 0.0620 5 0.0041 5 0.0003 5 0.0002 5 17 30 1 0.031 0.023 226.086 sec sqrtdel= 1.0000 1.0000 0.0620 0.0041 0.0003 0.0002 rcn mod 32 ee,eee= -0.01565 -0.06788 slater integrals for ag i d9 5s5d nconf=17 z= 47 ion= 0 exf=0.650 irel= 1 ag i d9 5s8g nconf=31 kut=-1 corrf=0.000 class 0 k rdk( 4d, 5d, 4d, 8g) frac k rek( 4d, 5d, 4d, 8g) frac - ------------------------------------- ----- - ------------------------------------- ----- 2 0.00048667 ryd = 53.4061 cm-1 0.995 2 0.00000239 ryd = 0.2625 cm-1 0.421 4 0.00003278 ryd = 3.5971 cm-1 0.980 4 0.00000202 ryd = 0.2221 cm-1 0.625 ag i d9 5s5d -d9 5s8g 4 0.0534 5 0.0036 5 0.0003 5 0.0002 5 17 31 1 0.023 0.039 226.164 sec sqrtdel= 1.0000 1.0000 0.0534 0.0036 0.0003 0.0002 rcn mod 32 ee,eee= -0.01236 -0.06623 slater integrals for ag i d9 5s5d nconf=17 z= 47 ion= 0 exf=0.650 irel= 1 ag i d9 5s9g nconf=32 kut=-1 corrf=0.000 class 0 k rdk( 4d, 5d, 4d, 9g) frac k rek( 4d, 5d, 4d, 9g) frac - ------------------------------------- ----- - ------------------------------------- ----- 2 0.00042112 ryd = 46.2128 cm-1 0.994 2 0.00000213 ryd = 0.2341 cm-1 0.420 4 0.00002885 ryd = 3.1663 cm-1 0.979 4 0.00000181 ryd = 0.1983 cm-1 0.624 ag i d9 5s5d -d9 5s9g 4 0.0462 5 0.0032 5 0.0002 5 0.0002 5 17 32 1 0.031 0.023 226.227 sec sqrtdel= 1.0000 1.0000 0.0462 0.0032 0.0002 0.0002 rcn mod 32 ee,eee= -0.02041 -0.07026 slater integrals for ag i d9 5s5d nconf=17 z= 47 ion= 0 exf=0.650 irel= 1 ag i d9 5s7i nconf=36 kut=-1 corrf=0.000 class 0 k rdk( 4d, 5d, 4d, 7i) frac k rek( 4d, 5d, 4d, 7i) frac - ------------------------------------- ----- - ------------------------------------- ----- 4 0.00000047 ryd = 0.0513 cm-1 1.000 4 0.00000000 ryd = 0.0005 cm-1 0.902 ag i d9 5s5d -d9 5s7i 2 0.0001 5 0.0000 5 17 36 4 0.133 0.023 226.406 sec sqrtdel= 1.0000 1.0000 0.0001 0.0000 rcn mod 32 ee,eee= -0.01563 -0.06786 slater integrals for ag i d9 5s5d nconf=17 z= 47 ion= 0 exf=0.650 irel= 1 ag i d9 5s8i nconf=37 kut=-1 corrf=0.000 class 0 k rdk( 4d, 5d, 4d, 8i) frac k rek( 4d, 5d, 4d, 8i) frac - ------------------------------------- ----- - ------------------------------------- ----- 4 0.00000058 ryd = 0.0637 cm-1 1.000 4 0.00000001 ryd = 0.0006 cm-1 0.901 ag i d9 5s5d -d9 5s8i 2 0.0001 5 0.0000 5 17 37 1 0.016 0.055 226.484 sec sqrtdel= 1.0000 1.0000 0.0001 0.0000 rcn mod 32 ee,eee= -0.01234 -0.06622 slater integrals for ag i d9 5s5d nconf=17 z= 47 ion= 0 exf=0.650 irel= 1 ag i d9 5s9i nconf=38 kut=-1 corrf=0.000 class 0 k rdk( 4d, 5d, 4d, 9i) frac k rek( 4d, 5d, 4d, 9i) frac - ------------------------------------- ----- - ------------------------------------- ----- 4 0.00000060 ryd = 0.0664 cm-1 1.000 4 0.00000001 ryd = 0.0006 cm-1 0.901 ag i d9 5s5d -d9 5s9i 2 0.0001 5 0.0000 5 17 38 1 0.031 0.016 226.531 sec sqrtdel= 1.0000 1.0000 0.0001 0.0000 rcn mod 32 ee,eee= -0.12010 -0.06005 ee,eee= -0.38785 -0.25397 slater integrals for ag i d9 5s5d nconf=17 z= 47 ion= 0 exf=0.650 irel= 1 ag i d9 5p2 nconf=41 kut=-1 corrf=0.000 class 0 k rdk( 5s, 5d, 5p, 5p) frac k rek( 5s, 5d, 5p, 5p) frac - ------------------------------------- ----- - ------------------------------------- ----- 1 0.09657182 ryd = 10597.5314 cm-1 0.987 1 0.09657182 ryd = 10597.5314 cm-1 0.987 ag i d9 5s5d -d9 5p2 1 10.5975 5 17 41 41 1.492 0.016 228.211 sec sqrtdel= 1.0000 1.0000 10.5975 rcn mod 32 ee,eee= -0.06554 -0.03277 ee,eee= -0.04139 -0.05347 slater integrals for ag i d9 5s6d nconf=18 z= 47 ion= 0 exf=0.650 irel= 1 ag i d9 5s7d nconf=19 kut=-1 corrf=0.000 class 11 k rdk( 4d, 6d, 4d, 7d) frac k rek( 4d, 6d, 4d, 7d) frac - ------------------------------------- ----- - ------------------------------------- ----- 0 0.04047802 ryd = 4441.9491 cm-1 0.498 0 0.00106519 ryd = 116.8909 cm-1 0.329 2 0.00407577 ryd = 447.2637 cm-1 0.977 2 0.00103082 ryd = 113.1199 cm-1 0.772 4 0.00133704 ryd = 146.7229 cm-1 1.000 4 0.00077558 ryd = 85.1097 cm-1 0.917 - ------------------------------------- ----- - ------------------------------------- ----- 0 0.04047798 ryd = 4441.9443 cm-1 0.498 0 0.00106508 ryd = 116.8791 cm-1 0.329 2 0.00407598 ryd = 447.2872 cm-1 0.977 2 0.00103094 ryd = 113.1329 cm-1 0.772 4 0.00133715 ryd = 146.7355 cm-1 1.000 4 0.00077566 ryd = 85.1191 cm-1 0.917 - ------------------------------------- ----- - ------------------------------------- ----- 0 0.04047807 ryd = 4441.9540 cm-1 0.498 0 0.00106530 ryd = 116.9029 cm-1 0.329 2 0.00407555 ryd = 447.2402 cm-1 0.977 2 0.00103071 ryd = 113.1074 cm-1 0.772 4 0.00133692 ryd = 146.7103 cm-1 1.000 4 0.00077549 ryd = 85.1005 cm-1 0.917 - ------------------------------------- ----- - ------------------------------------- ----- 0 0.04047802 ryd = 4441.9492 cm-1 0.498 0 0.00106519 ryd = 116.8910 cm-1 0.329 2 0.00407577 ryd = 447.2637 cm-1 0.977 2 0.00103083 ryd = 113.1201 cm-1 0.772 4 0.00133704 ryd = 146.7229 cm-1 1.000 4 0.00077558 ryd = 85.1098 cm-1 0.917 9.00000 0.00959 2.00000 0.00000 2.00000 0.00000 -0.05347 0.00000 9.00000 0.00928 2.00000 2.00000 2.00000 0.00000 -0.05347 0.00000 9.00000 0.00698 2.00000 4.00000 2.00000 0.00000 -0.05347 0.00000 ag i d9 5s6d -d9 5s7d 6 0.0000 5 0.4473 5 0.1467 5 0.1169 5 0.1131 5 0.0851 5 18 19 19 0.516 0.188 228.930 sec rcn mod 32 ee,eee= -0.06554 -0.03277 ee,eee= -0.04139 -0.05347 slater integrals for ag i d9 5s6d nconf=18 z= 47 ion= 0 exf=0.650 irel= 1 ag i d9 5s7d nconf=19 kut=-1 corrf=0.000 class 11 k rdk( 5s, 6d, 5s, 7d) frac k rek( 5s, 6d, 5s, 7d) frac - ------------------------------------- ----- - ------------------------------------- ----- 0 0.03919637 ryd = 4301.3038 cm-1 0.490 2 0.00445560 ryd = 488.9461 cm-1 0.949 - ------------------------------------- ----- - ------------------------------------- ----- 0 0.03919427 ryd = 4301.0739 cm-1 0.490 2 0.00446862 ryd = 490.3746 cm-1 0.949 - ------------------------------------- ----- - ------------------------------------- ----- 0 0.03919863 ryd = 4301.5518 cm-1 0.490 2 0.00444325 ryd = 487.5905 cm-1 0.949 - ------------------------------------- ----- - ------------------------------------- ----- 0 0.03919645 ryd = 4301.3129 cm-1 0.490 2 0.00445594 ryd = 488.9825 cm-1 0.949 1.00000 0.00446 0.00000 2.00000 2.00000 0.00000 -0.05347 0.00000 ag i d9 5s6d -d9 5s7d 2 0.0000 5 0.4889 5 18 19 19 0.555 0.063 229.563 sec sqrtdel= 1.0000 1.0000 0.0000 0.4473 0.1467 0.1169 0.1131 0.0851 0.0000 0.4889 rcn mod 32 ee,eee= -0.06554 -0.03277 ee,eee= -0.02853 -0.04703 slater integrals for ag i d9 5s6d nconf=18 z= 47 ion= 0 exf=0.650 irel= 1 ag i d9 5s8d nconf=20 kut=-1 corrf=0.000 class 11 k rdk( 4d, 6d, 4d, 8d) frac k rek( 4d, 6d, 4d, 8d) frac - ------------------------------------- ----- - ------------------------------------- ----- 0 0.02503188 ryd = 2746.9312 cm-1 0.438 0 0.00082891 ryd = 90.9625 cm-1 0.328 2 0.00305601 ryd = 335.3586 cm-1 0.968 2 0.00080375 ryd = 88.2016 cm-1 0.771 4 0.00103570 ryd = 113.6547 cm-1 0.999 4 0.00060512 ryd = 66.4039 cm-1 0.916 - ------------------------------------- ----- - ------------------------------------- ----- 0 0.02503183 ryd = 2746.9254 cm-1 0.438 0 0.00082878 ryd = 90.9486 cm-1 0.328 2 0.00305625 ryd = 335.3850 cm-1 0.968 2 0.00080389 ryd = 88.2169 cm-1 0.771 4 0.00103583 ryd = 113.6693 cm-1 0.999 4 0.00060522 ryd = 66.4149 cm-1 0.916 - ------------------------------------- ----- - ------------------------------------- ----- 0 0.02503193 ryd = 2746.9370 cm-1 0.438 0 0.00082904 ryd = 90.9767 cm-1 0.328 2 0.00305577 ryd = 335.3324 cm-1 0.968 2 0.00080362 ryd = 88.1873 cm-1 0.771 4 0.00103556 ryd = 113.6401 cm-1 0.999 4 0.00060502 ryd = 66.3932 cm-1 0.916 - ------------------------------------- ----- - ------------------------------------- ----- 0 0.02503188 ryd = 2746.9312 cm-1 0.438 0 0.00082891 ryd = 90.9627 cm-1 0.328 2 0.00305601 ryd = 335.3587 cm-1 0.968 2 0.00080376 ryd = 88.2021 cm-1 0.771 4 0.00103570 ryd = 113.6547 cm-1 0.999 4 0.00060512 ryd = 66.4040 cm-1 0.916 9.00000 0.00746 2.00000 0.00000 2.00000 0.00000 -0.04703 0.00000 9.00000 0.00723 2.00000 2.00000 2.00000 0.00000 -0.04703 0.00000 9.00000 0.00545 2.00000 4.00000 2.00000 0.00000 -0.04703 0.00000 ag i d9 5s6d -d9 5s8d 6 0.0000 5 0.3354 5 0.1137 5 0.0910 5 0.0882 5 0.0664 5 18 20 20 1.109 0.117 230.820 sec rcn mod 32 ee,eee= -0.06554 -0.03277 ee,eee= -0.02853 -0.04703 slater integrals for ag i d9 5s6d nconf=18 z= 47 ion= 0 exf=0.650 irel= 1 ag i d9 5s8d nconf=20 kut=-1 corrf=0.000 class 11 k rdk( 5s, 6d, 5s, 8d) frac k rek( 5s, 6d, 5s, 8d) frac - ------------------------------------- ----- - ------------------------------------- ----- 0 0.02403198 ryd = 2637.2050 cm-1 0.428 2 0.00343904 ryd = 377.3913 cm-1 0.948 - ------------------------------------- ----- - ------------------------------------- ----- 0 0.02402969 ryd = 2636.9539 cm-1 0.428 2 0.00345306 ryd = 378.9300 cm-1 0.949 - ------------------------------------- ----- - ------------------------------------- ----- 0 0.02403447 ryd = 2637.4778 cm-1 0.428 2 0.00342612 ryd = 375.9727 cm-1 0.948 - ------------------------------------- ----- - ------------------------------------- ----- 0 0.02403208 ryd = 2637.2159 cm-1 0.428 2 0.00343959 ryd = 377.4513 cm-1 0.948 1.00000 0.00344 0.00000 2.00000 2.00000 0.00000 -0.04703 0.00000 ag i d9 5s6d -d9 5s8d 2 0.0000 5 0.3774 5 18 20 20 0.883 0.188 231.891 sec sqrtdel= 1.0000 1.0000 0.0000 0.3354 0.1137 0.0910 0.0882 0.0664 0.0000 0.3774 rcn mod 32 ee,eee= -0.06554 -0.03277 ee,eee= -0.02086 -0.04320 slater integrals for ag i d9 5s6d nconf=18 z= 47 ion= 0 exf=0.650 irel= 1 ag i d9 5s9d nconf=21 kut=-1 corrf=0.000 class 11 k rdk( 4d, 6d, 4d, 9d) frac k rek( 4d, 6d, 4d, 9d) frac - ------------------------------------- ----- - ------------------------------------- ----- 0 0.01781072 ryd = 1954.5010 cm-1 0.408 0 0.00066640 ryd = 73.1291 cm-1 0.327 2 0.00240266 ryd = 263.6615 cm-1 0.962 2 0.00064694 ryd = 70.9929 cm-1 0.771 4 0.00083011 ryd = 91.0939 cm-1 0.999 4 0.00048725 ryd = 53.4691 cm-1 0.916 - ------------------------------------- ----- - ------------------------------------- ----- 0 0.01781067 ryd = 1954.4954 cm-1 0.408 0 0.00066628 ryd = 73.1158 cm-1 0.327 2 0.00240288 ryd = 263.6858 cm-1 0.962 2 0.00064707 ryd = 71.0074 cm-1 0.771 4 0.00083023 ryd = 91.1077 cm-1 0.999 4 0.00048734 ryd = 53.4796 cm-1 0.916 - ------------------------------------- ----- - ------------------------------------- ----- 0 0.01781078 ryd = 1954.5067 cm-1 0.408 0 0.00066653 ryd = 73.1428 cm-1 0.327 2 0.00240244 ryd = 263.6373 cm-1 0.962 2 0.00064681 ryd = 70.9795 cm-1 0.771 4 0.00082998 ryd = 91.0802 cm-1 0.999 4 0.00048715 ryd = 53.4590 cm-1 0.916 - ------------------------------------- ----- - ------------------------------------- ----- 0 0.01781072 ryd = 1954.5010 cm-1 0.408 0 0.00066640 ryd = 73.1293 cm-1 0.327 2 0.00240266 ryd = 263.6616 cm-1 0.962 2 0.00064694 ryd = 70.9934 cm-1 0.771 4 0.00083011 ryd = 91.0939 cm-1 0.999 4 0.00048725 ryd = 53.4693 cm-1 0.916 9.00000 0.00600 2.00000 0.00000 2.00000 0.00000 -0.04320 0.00000 9.00000 0.00582 2.00000 2.00000 2.00000 0.00000 -0.04320 0.00000 9.00000 0.00439 2.00000 4.00000 2.00000 0.00000 -0.04320 0.00000 ag i d9 5s6d -d9 5s9d 6 0.0000 5 0.2637 5 0.0911 5 0.0731 5 0.0710 5 0.0535 5 18 21 21 0.867 0.141 232.984 sec rcn mod 32 ee,eee= -0.06554 -0.03277 ee,eee= -0.02086 -0.04320 slater integrals for ag i d9 5s6d nconf=18 z= 47 ion= 0 exf=0.650 irel= 1 ag i d9 5s9d nconf=21 kut=-1 corrf=0.000 class 11 k rdk( 5s, 6d, 5s, 9d) frac k rek( 5s, 6d, 5s, 9d) frac - ------------------------------------- ----- - ------------------------------------- ----- 0 0.01700556 ryd = 1866.1449 cm-1 0.397 2 0.00275003 ryd = 301.7808 cm-1 0.948 - ------------------------------------- ----- - ------------------------------------- ----- 0 0.01700347 ryd = 1865.9155 cm-1 0.397 2 0.00276268 ryd = 303.1690 cm-1 0.948 - ------------------------------------- ----- - ------------------------------------- ----- 0 0.01700783 ryd = 1866.3937 cm-1 0.397 2 0.00273858 ryd = 300.5241 cm-1 0.948 - ------------------------------------- ----- - ------------------------------------- ----- 0 0.01700565 ryd = 1866.1546 cm-1 0.397 2 0.00275063 ryd = 301.8465 cm-1 0.948 1.00000 0.00275 0.00000 2.00000 2.00000 0.00000 -0.04320 0.00000 ag i d9 5s6d -d9 5s9d 2 0.0000 5 0.3018 5 18 21 21 0.711 0.055 233.750 sec sqrtdel= 1.0000 1.0000 0.0000 0.2637 0.0911 0.0731 0.0710 0.0535 0.0000 0.3018 rcn mod 32 ee,eee= -1.97456 -0.98728 ee,eee= -1.05985 -1.51721 slater integrals for ag i d9 5s6d nconf=18 z= 47 ion= 0 exf=0.650 irel= 1 ag i d8 5s2 5d nconf=22 kut=-1 corrf=0.000 class 0 k rdk( 4d, 4d, 4d, 5s) frac k rek( 4d, 4d, 4d, 5s) frac - ------------------------------------- ----- - ------------------------------------- ----- 2 0.00000000 ryd = 0.0000 cm-1 0.000 2 0.00000000 ryd = 0.0000 cm-1 0.000 ag i d9 5s6d -d8 5s2 5d 1 0.0000 5 18 22 22 0.625 0.016 234.492 sec rcn mod 32 ee,eee= -0.06554 -0.03277 ee,eee= -0.12522 -0.09538 slater integrals for ag i d9 5s6d nconf=18 z= 47 ion= 0 exf=0.650 irel= 1 ag i d8 5s2 5d nconf=22 kut=-1 corrf=0.000 class 0 k rdk( 4d, 6d, 5s, 5d) frac k rek( 4d, 6d, 5s, 5d) frac - ------------------------------------- ----- - ------------------------------------- ----- 2 -0.00752731 ryd = -826.0268 cm-1 -0.807 2 -0.00078376 ryd = -86.0081 cm-1 -0.281 ag i d9 5s6d -d8 5s2 5d 2 -0.8260 5 -0.0860 5 18 22 22 1.039 0.039 235.570 sec sqrtdel= 1.0000 1.0000 0.0000 -0.8260 -0.0860 rcn mod 32 ee,eee= -0.06554 -0.03277 ee,eee= -0.04001 -0.05278 slater integrals for ag i d9 5s6d nconf=18 z= 47 ion= 0 exf=0.650 irel= 1 ag i d10 5g nconf=23 kut=-1 corrf=0.000 class 0 k rdk( 5s, 6d, 4d, 5g) frac k rek( 5s, 6d, 4d, 5g) frac - ------------------------------------- ----- - ------------------------------------- ----- 2 0.00028167 ryd = 30.9100 cm-1 0.346 4 -0.00001401 ryd = -1.5369 cm-1 -0.928 ag i d9 5s6d -d10 5g 2 0.0309 5 -0.0015 5 18 23 23 0.766 0.016 236.352 sec sqrtdel= 1.0000 1.0000 0.0309 -0.0015 rcn mod 32 ee,eee= -0.02779 -0.04667 slater integrals for ag i d9 5s6d nconf=18 z= 47 ion= 0 exf=0.650 irel= 1 ag i d10 6g nconf=24 kut=-1 corrf=0.000 class 0 k rdk( 5s, 6d, 4d, 6g) frac k rek( 5s, 6d, 4d, 6g) frac - ------------------------------------- ----- - ------------------------------------- ----- 2 0.00007073 ryd = 7.7612 cm-1 0.112 4 -0.00001472 ryd = -1.6151 cm-1 -0.927 ag i d9 5s6d -d10 6g 2 0.0078 5 -0.0016 5 18 24 1 0.031 0.031 236.414 sec sqrtdel= 1.0000 1.0000 0.0078 -0.0016 rcn mod 32 ee,eee= -0.02042 -0.04298 slater integrals for ag i d9 5s6d nconf=18 z= 47 ion= 0 exf=0.650 irel= 1 ag i d10 7g nconf=25 kut=-1 corrf=0.000 class 0 k rdk( 5s, 6d, 4d, 7g) frac k rek( 5s, 6d, 4d, 7g) frac - ------------------------------------- ----- - ------------------------------------- ----- 2 -0.00001088 ryd = -1.1939 cm-1 -0.021 4 -0.00001363 ryd = -1.4960 cm-1 -0.926 ag i d9 5s6d -d10 7g 2 -0.0012 5 -0.0015 5 18 25 1 0.039 0.109 236.570 sec sqrtdel= 1.0000 1.0000 -0.0012 -0.0015 rcn mod 32 ee,eee= -0.01563 -0.04059 slater integrals for ag i d9 5s6d nconf=18 z= 47 ion= 0 exf=0.650 irel= 1 ag i d10 8g nconf=26 kut=-1 corrf=0.000 class 0 k rdk( 5s, 6d, 4d, 8g) frac k rek( 5s, 6d, 4d, 8g) frac - ------------------------------------- ----- - ------------------------------------- ----- 2 -0.00004314 ryd = -4.7345 cm-1 -0.102 4 -0.00001221 ryd = -1.3399 cm-1 -0.926 ag i d9 5s6d -d10 8g 2 -0.0047 5 -0.0013 5 18 26 1 0.016 0.023 236.656 sec sqrtdel= 1.0000 1.0000 -0.0047 -0.0013 rcn mod 32 ee,eee= -0.01235 -0.03895 slater integrals for ag i d9 5s6d nconf=18 z= 47 ion= 0 exf=0.650 irel= 1 ag i d10 9g nconf=27 kut=-1 corrf=0.000 class 0 k rdk( 5s, 6d, 4d, 9g) frac k rek( 5s, 6d, 4d, 9g) frac - ------------------------------------- ----- - ------------------------------------- ----- 2 -0.00005526 ryd = -6.0644 cm-1 -0.154 4 -0.00001085 ryd = -1.1904 cm-1 -0.925 ag i d9 5s6d -d10 9g 2 -0.0061 5 -0.0012 5 18 27 1 0.023 0.023 236.703 sec sqrtdel= 1.0000 1.0000 -0.0061 -0.0012 rcn mod 32 ee,eee= -0.06554 -0.03277 ee,eee= -0.04004 -0.05279 slater integrals for ag i d9 5s6d nconf=18 z= 47 ion= 0 exf=0.650 irel= 1 ag i d9 5s5g nconf=28 kut=-1 corrf=0.000 class 0 k rdk( 4d, 6d, 4d, 5g) frac k rek( 4d, 6d, 4d, 5g) frac - ------------------------------------- ----- - ------------------------------------- ----- 2 -0.00019027 ryd = -20.8794 cm-1 -0.353 2 0.00000203 ryd = 0.2226 cm-1 0.439 4 0.00001479 ryd = 1.6230 cm-1 0.613 4 0.00000169 ryd = 0.1853 cm-1 0.643 ag i d9 5s6d -d9 5s5g 4 -0.0209 5 0.0016 5 0.0002 5 0.0002 5 18 28 28 1.195 0.039 237.945 sec sqrtdel= 1.0000 1.0000 -0.0209 0.0016 0.0002 0.0002 rcn mod 32 ee,eee= -0.02782 -0.04668 slater integrals for ag i d9 5s6d nconf=18 z= 47 ion= 0 exf=0.650 irel= 1 ag i d9 5s6g nconf=29 kut=-1 corrf=0.000 class 0 k rdk( 4d, 6d, 4d, 6g) frac k rek( 4d, 6d, 4d, 6g) frac - ------------------------------------- ----- - ------------------------------------- ----- 2 -0.00004506 ryd = -4.9451 cm-1 -0.107 2 0.00000215 ryd = 0.2361 cm-1 0.433 4 0.00001678 ryd = 1.8410 cm-1 0.703 4 0.00000180 ryd = 0.1976 cm-1 0.636 ag i d9 5s6d -d9 5s6g 4 -0.0049 5 0.0018 5 0.0002 5 0.0002 5 18 29 1 0.031 0.039 238.023 sec sqrtdel= 1.0000 1.0000 -0.0049 0.0018 0.0002 0.0002 rcn mod 32 ee,eee= -0.02044 -0.04299 slater integrals for ag i d9 5s6d nconf=18 z= 47 ion= 0 exf=0.650 irel= 1 ag i d9 5s7g nconf=30 kut=-1 corrf=0.000 class 0 k rdk( 4d, 6d, 4d, 7g) frac k rek( 4d, 6d, 4d, 7g) frac - ------------------------------------- ----- - ------------------------------------- ----- 2 0.00001095 ryd = 1.2011 cm-1 0.032 2 0.00000201 ryd = 0.2201 cm-1 0.429 4 0.00001603 ryd = 1.7588 cm-1 0.746 4 0.00000168 ryd = 0.1848 cm-1 0.633 ag i d9 5s6d -d9 5s7g 4 0.0012 5 0.0018 5 0.0002 5 0.0002 5 18 30 1 0.063 0.039 238.125 sec sqrtdel= 1.0000 1.0000 0.0012 0.0018 0.0002 0.0002 rcn mod 32 ee,eee= -0.01565 -0.04060 slater integrals for ag i d9 5s6d nconf=18 z= 47 ion= 0 exf=0.650 irel= 1 ag i d9 5s8g nconf=31 kut=-1 corrf=0.000 class 0 k rdk( 4d, 6d, 4d, 8g) frac k rek( 4d, 6d, 4d, 8g) frac - ------------------------------------- ----- - ------------------------------------- ----- 2 0.00003293 ryd = 3.6137 cm-1 0.116 2 0.00000181 ryd = 0.1981 cm-1 0.427 4 0.00001459 ryd = 1.6011 cm-1 0.770 4 0.00000152 ryd = 0.1667 cm-1 0.631 ag i d9 5s6d -d9 5s8g 4 0.0036 5 0.0016 5 0.0002 5 0.0002 5 18 31 1 0.031 0.031 238.195 sec sqrtdel= 1.0000 1.0000 0.0036 0.0016 0.0002 0.0002 rcn mod 32 ee,eee= -0.01236 -0.03895 slater integrals for ag i d9 5s6d nconf=18 z= 47 ion= 0 exf=0.650 irel= 1 ag i d9 5s9g nconf=32 kut=-1 corrf=0.000 class 0 k rdk( 4d, 6d, 4d, 9g) frac k rek( 4d, 6d, 4d, 9g) frac - ------------------------------------- ----- - ------------------------------------- ----- 2 0.00004104 ryd = 4.5032 cm-1 0.171 2 0.00000161 ryd = 0.1767 cm-1 0.426 4 0.00001309 ryd = 1.4364 cm-1 0.785 4 0.00000136 ryd = 0.1489 cm-1 0.629 ag i d9 5s6d -d9 5s9g 4 0.0045 5 0.0014 5 0.0002 5 0.0001 5 18 32 1 0.023 0.047 238.273 sec sqrtdel= 1.0000 1.0000 0.0045 0.0014 0.0002 0.0001 rcn mod 32 ee,eee= -0.02041 -0.04298 slater integrals for ag i d9 5s6d nconf=18 z= 47 ion= 0 exf=0.650 irel= 1 ag i d9 5s7i nconf=36 kut=-1 corrf=0.000 class 0 k rdk( 4d, 6d, 4d, 7i) frac k rek( 4d, 6d, 4d, 7i) frac - ------------------------------------- ----- - ------------------------------------- ----- 4 -0.00000034 ryd = -0.0368 cm-1 -0.650 4 0.00000000 ryd = 0.0003 cm-1 0.902 ag i d9 5s6d -d9 5s7i 2 0.0000 5 0.0000 5 18 36 4 0.086 0.031 238.414 sec sqrtdel= 1.0000 1.0000 0.0000 0.0000 rcn mod 32 ee,eee= -0.01563 -0.04058 slater integrals for ag i d9 5s6d nconf=18 z= 47 ion= 0 exf=0.650 irel= 1 ag i d9 5s8i nconf=37 kut=-1 corrf=0.000 class 0 k rdk( 4d, 6d, 4d, 8i) frac k rek( 4d, 6d, 4d, 8i) frac - ------------------------------------- ----- - ------------------------------------- ----- 4 -0.00000037 ryd = -0.0405 cm-1 -0.616 4 0.00000000 ryd = 0.0004 cm-1 0.901 ag i d9 5s6d -d9 5s8i 2 0.0000 5 0.0000 5 18 37 1 0.031 0.063 238.516 sec sqrtdel= 1.0000 1.0000 0.0000 0.0000 rcn mod 32 ee,eee= -0.01234 -0.03894 slater integrals for ag i d9 5s6d nconf=18 z= 47 ion= 0 exf=0.650 irel= 1 ag i d9 5s9i nconf=38 kut=-1 corrf=0.000 class 0 k rdk( 4d, 6d, 4d, 9i) frac k rek( 4d, 6d, 4d, 9i) frac - ------------------------------------- ----- - ------------------------------------- ----- 4 -0.00000035 ryd = -0.0389 cm-1 -0.592 4 0.00000000 ryd = 0.0005 cm-1 0.901 ag i d9 5s6d -d9 5s9i 2 0.0000 5 0.0000 5 18 38 1 0.031 0.039 238.594 sec sqrtdel= 1.0000 1.0000 0.0000 0.0000 rcn mod 32 ee,eee= -0.06554 -0.03277 ee,eee= -0.38785 -0.22669 slater integrals for ag i d9 5s6d nconf=18 z= 47 ion= 0 exf=0.650 irel= 1 ag i d9 5p2 nconf=41 kut=-1 corrf=0.000 class 0 k rdk( 5s, 6d, 5p, 5p) frac k rek( 5s, 6d, 5p, 5p) frac - ------------------------------------- ----- - ------------------------------------- ----- 1 0.06410815 ryd = 7035.0555 cm-1 0.980 1 0.06410815 ryd = 7035.0555 cm-1 0.980 ag i d9 5s6d -d9 5p2 1 7.0351 5 18 41 41 1.883 0.047 240.531 sec sqrtdel= 1.0000 1.0000 7.0351 rcn mod 32 ee,eee= -0.04139 -0.02069 ee,eee= -0.02853 -0.03496 slater integrals for ag i d9 5s7d nconf=19 z= 47 ion= 0 exf=0.650 irel= 1 ag i d9 5s8d nconf=20 kut=-1 corrf=0.000 class 11 k rdk( 4d, 7d, 4d, 8d) frac k rek( 4d, 7d, 4d, 8d) frac - ------------------------------------- ----- - ------------------------------------- ----- 0 0.02836980 ryd = 3113.2261 cm-1 0.509 0 0.00062110 ryd = 68.1581 cm-1 0.326 2 0.00229856 ryd = 252.2383 cm-1 0.989 2 0.00060454 ryd = 66.3409 cm-1 0.770 4 0.00077420 ryd = 84.9582 cm-1 1.000 4 0.00045566 ryd = 50.0033 cm-1 0.916 - ------------------------------------- ----- - ------------------------------------- ----- 0 0.02836979 ryd = 3113.2245 cm-1 0.509 0 0.00062107 ryd = 68.1545 cm-1 0.326 2 0.00229863 ryd = 252.2453 cm-1 0.989 2 0.00060458 ryd = 66.3446 cm-1 0.770 4 0.00077423 ryd = 84.9619 cm-1 1.000 4 0.00045569 ryd = 50.0060 cm-1 0.916 - ------------------------------------- ----- - ------------------------------------- ----- 0 0.02836982 ryd = 3113.2276 cm-1 0.509 0 0.00062114 ryd = 68.1617 cm-1 0.326 2 0.00229850 ryd = 252.2313 cm-1 0.989 2 0.00060451 ryd = 66.3373 cm-1 0.770 4 0.00077416 ryd = 84.9545 cm-1 1.000 4 0.00045564 ryd = 50.0006 cm-1 0.916 - ------------------------------------- ----- - ------------------------------------- ----- 0 0.02836980 ryd = 3113.2261 cm-1 0.509 0 0.00062110 ryd = 68.1581 cm-1 0.326 2 0.00229856 ryd = 252.2383 cm-1 0.989 2 0.00060454 ryd = 66.3409 cm-1 0.770 4 0.00077420 ryd = 84.9582 cm-1 1.000 4 0.00045566 ryd = 50.0033 cm-1 0.916 9.00000 0.00559 2.00000 0.00000 2.00000 0.00000 -0.03496 0.00000 9.00000 0.00544 2.00000 2.00000 2.00000 0.00000 -0.03496 0.00000 9.00000 0.00410 2.00000 4.00000 2.00000 0.00000 -0.03496 0.00000 ag i d9 5s7d -d9 5s8d 6 0.0000 5 0.2522 5 0.0850 5 0.0682 5 0.0663 5 0.0500 5 19 20 20 0.586 0.117 241.250 sec rcn mod 32 ee,eee= -0.04139 -0.02069 ee,eee= -0.02853 -0.03496 slater integrals for ag i d9 5s7d nconf=19 z= 47 ion= 0 exf=0.650 irel= 1 ag i d9 5s8d nconf=20 kut=-1 corrf=0.000 class 11 k rdk( 5s, 7d, 5s, 8d) frac k rek( 5s, 7d, 5s, 8d) frac - ------------------------------------- ----- - ------------------------------------- ----- 0 0.02761732 ryd = 3030.6508 cm-1 0.502 2 0.00254528 ryd = 279.3126 cm-1 0.948 - ------------------------------------- ----- - ------------------------------------- ----- 0 0.02761681 ryd = 3030.5947 cm-1 0.502 2 0.00254812 ryd = 279.6241 cm-1 0.948 - ------------------------------------- ----- - ------------------------------------- ----- 0 0.02761785 ryd = 3030.7090 cm-1 0.502 2 0.00254253 ryd = 279.0099 cm-1 0.948 - ------------------------------------- ----- - ------------------------------------- ----- 0 0.02761733 ryd = 3030.6519 cm-1 0.502 2 0.00254532 ryd = 279.3170 cm-1 0.948 1.00000 0.00255 0.00000 2.00000 2.00000 0.00000 -0.03496 0.00000 ag i d9 5s7d -d9 5s8d 2 0.0000 5 0.2793 5 19 20 20 0.594 0.063 241.906 sec sqrtdel= 1.0000 1.0000 0.0000 0.2522 0.0850 0.0682 0.0663 0.0500 0.0000 0.2793 rcn mod 32 ee,eee= -0.04139 -0.02069 ee,eee= -0.02086 -0.03112 slater integrals for ag i d9 5s7d nconf=19 z= 47 ion= 0 exf=0.650 irel= 1 ag i d9 5s9d nconf=21 kut=-1 corrf=0.000 class 11 k rdk( 4d, 7d, 4d, 9d) frac k rek( 4d, 7d, 4d, 9d) frac - ------------------------------------- ----- - ------------------------------------- ----- 0 0.01850095 ryd = 2030.2446 cm-1 0.455 0 0.00049935 ryd = 54.7970 cm-1 0.326 2 0.00180970 ryd = 198.5911 cm-1 0.984 2 0.00048662 ryd = 53.3999 cm-1 0.769 4 0.00062104 ryd = 68.1514 cm-1 1.000 4 0.00036692 ryd = 40.2653 cm-1 0.915 - ------------------------------------- ----- - ------------------------------------- ----- 0 0.01850093 ryd = 2030.2427 cm-1 0.455 0 0.00049931 ryd = 54.7925 cm-1 0.325 2 0.00180977 ryd = 198.5995 cm-1 0.984 2 0.00048666 ryd = 53.4045 cm-1 0.769 4 0.00062108 ryd = 68.1560 cm-1 1.000 4 0.00036696 ryd = 40.2687 cm-1 0.915 - ------------------------------------- ----- - ------------------------------------- ----- 0 0.01850097 ryd = 2030.2466 cm-1 0.455 0 0.00049939 ryd = 54.8015 cm-1 0.326 2 0.00180962 ryd = 198.5827 cm-1 0.984 2 0.00048658 ryd = 53.3955 cm-1 0.769 4 0.00062100 ryd = 68.1468 cm-1 1.000 4 0.00036689 ryd = 40.2619 cm-1 0.915 - ------------------------------------- ----- - ------------------------------------- ----- 0 0.01850095 ryd = 2030.2446 cm-1 0.455 0 0.00049935 ryd = 54.7970 cm-1 0.326 2 0.00180970 ryd = 198.5911 cm-1 0.984 2 0.00048662 ryd = 53.4000 cm-1 0.769 4 0.00062104 ryd = 68.1514 cm-1 1.000 4 0.00036692 ryd = 40.2653 cm-1 0.915 9.00000 0.00449 2.00000 0.00000 2.00000 0.00000 -0.03112 0.00000 9.00000 0.00438 2.00000 2.00000 2.00000 0.00000 -0.03112 0.00000 9.00000 0.00330 2.00000 4.00000 2.00000 0.00000 -0.03112 0.00000 ag i d9 5s7d -d9 5s9d 6 0.0000 5 0.1986 5 0.0682 5 0.0548 5 0.0534 5 0.0403 5 19 21 21 0.961 0.188 243.063 sec rcn mod 32 ee,eee= -0.04139 -0.02069 ee,eee= -0.02086 -0.03112 slater integrals for ag i d9 5s7d nconf=19 z= 47 ion= 0 exf=0.650 irel= 1 ag i d9 5s9d nconf=21 kut=-1 corrf=0.000 class 11 k rdk( 5s, 7d, 5s, 9d) frac k rek( 5s, 7d, 5s, 9d) frac - ------------------------------------- ----- - ------------------------------------- ----- 0 0.01789498 ryd = 1963.7472 cm-1 0.446 2 0.00203608 ryd = 223.4342 cm-1 0.948 - ------------------------------------- ----- - ------------------------------------- ----- 0 0.01789438 ryd = 1963.6812 cm-1 0.446 2 0.00203940 ryd = 223.7982 cm-1 0.948 - ------------------------------------- ----- - ------------------------------------- ----- 0 0.01789561 ryd = 1963.8162 cm-1 0.446 2 0.00203292 ryd = 223.0866 cm-1 0.948 - ------------------------------------- ----- - ------------------------------------- ----- 0 0.01789500 ryd = 1963.7487 cm-1 0.446 2 0.00203616 ryd = 223.4424 cm-1 0.948 1.00000 0.00204 0.00000 2.00000 2.00000 0.00000 -0.03112 0.00000 ag i d9 5s7d -d9 5s9d 2 0.0000 5 0.2234 5 19 21 21 0.734 0.117 243.914 sec sqrtdel= 1.0000 1.0000 0.0000 0.1986 0.0682 0.0548 0.0534 0.0403 0.0000 0.2234 rcn mod 32 ee,eee= -2.02092 -1.01046 ee,eee= -1.05985 -1.54039 slater integrals for ag i d9 5s7d nconf=19 z= 47 ion= 0 exf=0.650 irel= 1 ag i d8 5s2 5d nconf=22 kut=-1 corrf=0.000 class 0 k rdk( 4d, 4d, 4d, 5s) frac k rek( 4d, 4d, 4d, 5s) frac - ------------------------------------- ----- - ------------------------------------- ----- 2 0.00000000 ryd = 0.0000 cm-1 0.000 2 0.00000000 ryd = 0.0000 cm-1 0.000 ag i d9 5s7d -d8 5s2 5d 1 0.0000 5 19 22 22 1.172 0.031 245.117 sec rcn mod 32 ee,eee= -0.04139 -0.02069 ee,eee= -0.12522 -0.08330 slater integrals for ag i d9 5s7d nconf=19 z= 47 ion= 0 exf=0.650 irel= 1 ag i d8 5s2 5d nconf=22 kut=-1 corrf=0.000 class 0 k rdk( 4d, 7d, 5s, 5d) frac k rek( 4d, 7d, 5s, 5d) frac - ------------------------------------- ----- - ------------------------------------- ----- 2 -0.00505219 ryd = -554.4133 cm-1 -0.772 2 -0.00057123 ryd = -62.6857 cm-1 -0.273 ag i d9 5s7d -d8 5s2 5d 2 -0.5544 5 -0.0627 5 19 22 22 0.648 0.016 245.781 sec sqrtdel= 1.0000 1.0000 0.0000 -0.5544 -0.0627 rcn mod 32 ee,eee= -0.04139 -0.02069 ee,eee= -0.04001 -0.04070 slater integrals for ag i d9 5s7d nconf=19 z= 47 ion= 0 exf=0.650 irel= 1 ag i d10 5g nconf=23 kut=-1 corrf=0.000 class 0 k rdk( 5s, 7d, 4d, 5g) frac k rek( 5s, 7d, 4d, 5g) frac - ------------------------------------- ----- - ------------------------------------- ----- 2 0.00001160 ryd = 1.2732 cm-1 0.022 4 -0.00001034 ryd = -1.1345 cm-1 -0.928 ag i d9 5s7d -d10 5g 2 0.0013 5 -0.0011 5 19 23 23 0.641 0.023 246.500 sec sqrtdel= 1.0000 1.0000 0.0013 -0.0011 rcn mod 32 ee,eee= -0.02779 -0.03459 slater integrals for ag i d9 5s7d nconf=19 z= 47 ion= 0 exf=0.650 irel= 1 ag i d10 6g nconf=24 kut=-1 corrf=0.000 class 0 k rdk( 5s, 7d, 4d, 6g) frac k rek( 5s, 7d, 4d, 6g) frac - ------------------------------------- ----- - ------------------------------------- ----- 2 0.00010687 ryd = 11.7282 cm-1 0.246 4 -0.00001087 ryd = -1.1927 cm-1 -0.927 ag i d9 5s7d -d10 6g 2 0.0117 5 -0.0012 5 19 24 1 0.031 0.039 246.570 sec sqrtdel= 1.0000 1.0000 0.0117 -0.0012 rcn mod 32 ee,eee= -0.02042 -0.03090 slater integrals for ag i d9 5s7d nconf=19 z= 47 ion= 0 exf=0.650 irel= 1 ag i d10 7g nconf=25 kut=-1 corrf=0.000 class 0 k rdk( 5s, 7d, 4d, 7g) frac k rek( 5s, 7d, 4d, 7g) frac - ------------------------------------- ----- - ------------------------------------- ----- 2 0.00007296 ryd = 8.0067 cm-1 0.201 4 -0.00001007 ryd = -1.1051 cm-1 -0.926 ag i d9 5s7d -d10 7g 2 0.0080 5 -0.0011 5 19 25 1 0.031 0.031 246.633 sec sqrtdel= 1.0000 1.0000 0.0080 -0.0011 rcn mod 32 ee,eee= -0.01563 -0.02851 slater integrals for ag i d9 5s7d nconf=19 z= 47 ion= 0 exf=0.650 irel= 1 ag i d10 8g nconf=26 kut=-1 corrf=0.000 class 0 k rdk( 5s, 7d, 4d, 8g) frac k rek( 5s, 7d, 4d, 8g) frac - ------------------------------------- ----- - ------------------------------------- ----- 2 0.00004715 ryd = 5.1741 cm-1 0.155 4 -0.00000902 ryd = -0.9900 cm-1 -0.926 ag i d9 5s7d -d10 8g 2 0.0052 5 -0.0010 5 19 26 1 0.023 0.016 246.711 sec sqrtdel= 1.0000 1.0000 0.0052 -0.0010 rcn mod 32 ee,eee= -0.01235 -0.02687 slater integrals for ag i d9 5s7d nconf=19 z= 47 ion= 0 exf=0.650 irel= 1 ag i d10 9g nconf=27 kut=-1 corrf=0.000 class 0 k rdk( 5s, 7d, 4d, 9g) frac k rek( 5s, 7d, 4d, 9g) frac - ------------------------------------- ----- - ------------------------------------- ----- 2 0.00003093 ryd = 3.3937 cm-1 0.119 4 -0.00000802 ryd = -0.8796 cm-1 -0.925 ag i d9 5s7d -d10 9g 2 0.0034 5 -0.0009 5 19 27 1 0.016 0.078 246.820 sec sqrtdel= 1.0000 1.0000 0.0034 -0.0009 rcn mod 32 ee,eee= -0.04139 -0.02069 ee,eee= -0.04004 -0.04072 slater integrals for ag i d9 5s7d nconf=19 z= 47 ion= 0 exf=0.650 irel= 1 ag i d9 5s5g nconf=28 kut=-1 corrf=0.000 class 0 k rdk( 4d, 7d, 4d, 5g) frac k rek( 4d, 7d, 4d, 5g) frac - ------------------------------------- ----- - ------------------------------------- ----- 2 -0.00000587 ryd = -0.6441 cm-1 -0.017 2 0.00000154 ryd = 0.1694 cm-1 0.444 4 0.00000976 ryd = 1.0715 cm-1 0.596 4 0.00000128 ryd = 0.1403 cm-1 0.647 ag i d9 5s7d -d9 5s5g 4 -0.0006 5 0.0011 5 0.0002 5 0.0001 5 19 28 28 1.375 0.125 248.336 sec sqrtdel= 1.0000 1.0000 -0.0006 0.0011 0.0002 0.0001 rcn mod 32 ee,eee= -0.02782 -0.03460 slater integrals for ag i d9 5s7d nconf=19 z= 47 ion= 0 exf=0.650 irel= 1 ag i d9 5s6g nconf=29 kut=-1 corrf=0.000 class 0 k rdk( 4d, 7d, 4d, 6g) frac k rek( 4d, 7d, 4d, 6g) frac - ------------------------------------- ----- - ------------------------------------- ----- 2 -0.00007076 ryd = -7.7651 cm-1 -0.245 2 0.00000164 ryd = 0.1797 cm-1 0.438 4 0.00001044 ryd = 1.1453 cm-1 0.637 4 0.00000136 ryd = 0.1497 cm-1 0.640 ag i d9 5s7d -d9 5s6g 4 -0.0078 5 0.0011 5 0.0002 5 0.0001 5 19 29 1 0.031 0.047 248.414 sec sqrtdel= 1.0000 1.0000 -0.0078 0.0011 0.0002 0.0001 rcn mod 32 ee,eee= -0.02044 -0.03091 slater integrals for ag i d9 5s7d nconf=19 z= 47 ion= 0 exf=0.650 irel= 1 ag i d9 5s7g nconf=30 kut=-1 corrf=0.000 class 0 k rdk( 4d, 7d, 4d, 7g) frac k rek( 4d, 7d, 4d, 7g) frac - ------------------------------------- ----- - ------------------------------------- ----- 2 -0.00004748 ryd = -5.2098 cm-1 -0.196 2 0.00000153 ryd = 0.1676 cm-1 0.434 4 0.00000990 ryd = 1.0862 cm-1 0.667 4 0.00000128 ryd = 0.1401 cm-1 0.637 ag i d9 5s7d -d9 5s7g 4 -0.0052 5 0.0011 5 0.0002 5 0.0001 5 19 30 1 0.023 0.039 248.484 sec sqrtdel= 1.0000 1.0000 -0.0052 0.0011 0.0002 0.0001 rcn mod 32 ee,eee= -0.01565 -0.02852 slater integrals for ag i d9 5s7d nconf=19 z= 47 ion= 0 exf=0.650 irel= 1 ag i d9 5s8g nconf=31 kut=-1 corrf=0.000 class 0 k rdk( 4d, 7d, 4d, 8g) frac k rek( 4d, 7d, 4d, 8g) frac - ------------------------------------- ----- - ------------------------------------- ----- 2 -0.00002988 ryd = -3.2795 cm-1 -0.147 2 0.00000137 ryd = 0.1508 cm-1 0.432 4 0.00000901 ryd = 0.9889 cm-1 0.686 4 0.00000115 ryd = 0.1264 cm-1 0.635 ag i d9 5s7d -d9 5s8g 4 -0.0033 5 0.0010 5 0.0002 5 0.0001 5 19 31 1 0.148 0.031 248.664 sec sqrtdel= 1.0000 1.0000 -0.0033 0.0010 0.0002 0.0001 rcn mod 32 ee,eee= -0.01236 -0.02687 slater integrals for ag i d9 5s7d nconf=19 z= 47 ion= 0 exf=0.650 irel= 1 ag i d9 5s9g nconf=32 kut=-1 corrf=0.000 class 0 k rdk( 4d, 7d, 4d, 9g) frac k rek( 4d, 7d, 4d, 9g) frac - ------------------------------------- ----- - ------------------------------------- ----- 2 -0.00001892 ryd = -2.0758 cm-1 -0.109 2 0.00000123 ryd = 0.1345 cm-1 0.431 4 0.00000810 ryd = 0.8884 cm-1 0.699 4 0.00000103 ryd = 0.1129 cm-1 0.633 ag i d9 5s7d -d9 5s9g 4 -0.0021 5 0.0009 5 0.0001 5 0.0001 5 19 32 1 0.023 0.047 248.742 sec sqrtdel= 1.0000 1.0000 -0.0021 0.0009 0.0001 0.0001 rcn mod 32 ee,eee= -0.02041 -0.03090 slater integrals for ag i d9 5s7d nconf=19 z= 47 ion= 0 exf=0.650 irel= 1 ag i d9 5s7i nconf=36 kut=-1 corrf=0.000 class 0 k rdk( 4d, 7d, 4d, 7i) frac k rek( 4d, 7d, 4d, 7i) frac - ------------------------------------- ----- - ------------------------------------- ----- 4 0.00000006 ryd = 0.0067 cm-1 0.165 4 0.00000000 ryd = 0.0002 cm-1 0.903 ag i d9 5s7d -d9 5s7i 2 0.0000 5 0.0000 5 19 36 4 0.094 0.047 248.891 sec sqrtdel= 1.0000 1.0000 0.0000 0.0000 rcn mod 32 ee,eee= -0.01563 -0.02851 slater integrals for ag i d9 5s7d nconf=19 z= 47 ion= 0 exf=0.650 irel= 1 ag i d9 5s8i nconf=37 kut=-1 corrf=0.000 class 0 k rdk( 4d, 7d, 4d, 8i) frac k rek( 4d, 7d, 4d, 8i) frac - ------------------------------------- ----- - ------------------------------------- ----- 4 0.00000002 ryd = 0.0023 cm-1 0.052 4 0.00000000 ryd = 0.0003 cm-1 0.901 ag i d9 5s7d -d9 5s8i 2 0.0000 5 0.0000 5 19 37 1 0.016 0.023 248.945 sec sqrtdel= 1.0000 1.0000 0.0000 0.0000 rcn mod 32 ee,eee= -0.01234 -0.02687 slater integrals for ag i d9 5s7d nconf=19 z= 47 ion= 0 exf=0.650 irel= 1 ag i d9 5s9i nconf=38 kut=-1 corrf=0.000 class 0 k rdk( 4d, 7d, 4d, 9i) frac k rek( 4d, 7d, 4d, 9i) frac - ------------------------------------- ----- - ------------------------------------- ----- 4 -0.00000001 ryd = -0.0007 cm-1 -0.017 4 0.00000000 ryd = 0.0003 cm-1 0.901 ag i d9 5s7d -d9 5s9i 2 0.0000 5 0.0000 5 19 38 1 0.039 0.031 249.031 sec sqrtdel= 1.0000 1.0000 0.0000 0.0000 rcn mod 32 ee,eee= -0.04139 -0.02069 ee,eee= -0.38785 -0.21462 slater integrals for ag i d9 5s7d nconf=19 z= 47 ion= 0 exf=0.650 irel= 1 ag i d9 5p2 nconf=41 kut=-1 corrf=0.000 class 0 k rdk( 5s, 7d, 5p, 5p) frac k rek( 5s, 7d, 5p, 5p) frac - ------------------------------------- ----- - ------------------------------------- ----- 1 0.04584712 ryd = 5031.1394 cm-1 0.974 1 0.04584712 ryd = 5031.1394 cm-1 0.974 ag i d9 5s7d -d9 5p2 1 5.0311 5 19 41 41 1.336 0.070 250.461 sec sqrtdel= 1.0000 1.0000 5.0311 rcn mod 32 ee,eee= -0.02853 -0.01426 ee,eee= -0.02086 -0.02469 slater integrals for ag i d9 5s8d nconf=20 z= 47 ion= 0 exf=0.650 irel= 1 ag i d9 5s9d nconf=21 kut=-1 corrf=0.000 class 11 k rdk( 4d, 8d, 4d, 9d) frac k rek( 4d, 8d, 4d, 9d) frac - ------------------------------------- ----- - ------------------------------------- ----- 0 0.02072875 ryd = 2274.7174 cm-1 0.513 0 0.00038862 ryd = 42.6456 cm-1 0.325 2 0.00140857 ryd = 154.5722 cm-1 0.994 2 0.00037948 ryd = 41.6430 cm-1 0.768 4 0.00048254 ryd = 52.9523 cm-1 1.000 4 0.00028632 ryd = 31.4204 cm-1 0.915 - ------------------------------------- ----- - ------------------------------------- ----- 0 0.02072875 ryd = 2274.7168 cm-1 0.513 0 0.00038860 ryd = 42.6443 cm-1 0.325 2 0.00140859 ryd = 154.5746 cm-1 0.994 2 0.00037949 ryd = 41.6443 cm-1 0.768 4 0.00048255 ryd = 52.9536 cm-1 1.000 4 0.00028633 ryd = 31.4214 cm-1 0.915 - ------------------------------------- ----- - ------------------------------------- ----- 0 0.02072876 ryd = 2274.7179 cm-1 0.513 0 0.00038863 ryd = 42.6468 cm-1 0.325 2 0.00140854 ryd = 154.5698 cm-1 0.994 2 0.00037947 ryd = 41.6418 cm-1 0.768 4 0.00048253 ryd = 52.9511 cm-1 1.000 4 0.00028632 ryd = 31.4195 cm-1 0.915 - ------------------------------------- ----- - ------------------------------------- ----- 0 0.02072875 ryd = 2274.7174 cm-1 0.513 0 0.00038862 ryd = 42.6456 cm-1 0.325 2 0.00140857 ryd = 154.5722 cm-1 0.994 2 0.00037948 ryd = 41.6430 cm-1 0.768 4 0.00048254 ryd = 52.9523 cm-1 1.000 4 0.00028632 ryd = 31.4204 cm-1 0.915 9.00000 0.00350 2.00000 0.00000 2.00000 0.00000 -0.02469 0.00000 9.00000 0.00342 2.00000 2.00000 2.00000 0.00000 -0.02469 0.00000 9.00000 0.00258 2.00000 4.00000 2.00000 0.00000 -0.02469 0.00000 ag i d9 5s8d -d9 5s9d 6 0.0000 5 0.1546 5 0.0530 5 0.0426 5 0.0416 5 0.0314 5 20 21 21 0.703 0.227 251.406 sec rcn mod 32 ee,eee= -0.02853 -0.01426 ee,eee= -0.02086 -0.02469 slater integrals for ag i d9 5s8d nconf=20 z= 47 ion= 0 exf=0.650 irel= 1 ag i d9 5s9d nconf=21 kut=-1 corrf=0.000 class 11 k rdk( 5s, 8d, 5s, 9d) frac k rek( 5s, 8d, 5s, 9d) frac - ------------------------------------- ----- - ------------------------------------- ----- 0 0.02025593 ryd = 2222.8308 cm-1 0.507 2 0.00157330 ryd = 172.6493 cm-1 0.947 - ------------------------------------- ----- - ------------------------------------- ----- 0 0.02025577 ryd = 2222.8142 cm-1 0.507 2 0.00157409 ryd = 172.7361 cm-1 0.947 - ------------------------------------- ----- - ------------------------------------- ----- 0 0.02025608 ryd = 2222.8478 cm-1 0.507 2 0.00157252 ryd = 172.5639 cm-1 0.947 - ------------------------------------- ----- - ------------------------------------- ----- 0 0.02025593 ryd = 2222.8310 cm-1 0.507 2 0.00157330 ryd = 172.6500 cm-1 0.947 1.00000 0.00157 0.00000 2.00000 2.00000 0.00000 -0.02469 0.00000 ag i d9 5s8d -d9 5s9d 2 0.0000 5 0.1726 5 20 21 21 1.164 0.086 252.672 sec sqrtdel= 1.0000 1.0000 0.0000 0.1546 0.0530 0.0426 0.0416 0.0314 0.0000 0.1726 rcn mod 32 ee,eee= -2.04618 -1.02309 ee,eee= -1.05985 -1.55302 slater integrals for ag i d9 5s8d nconf=20 z= 47 ion= 0 exf=0.650 irel= 1 ag i d8 5s2 5d nconf=22 kut=-1 corrf=0.000 class 0 k rdk( 4d, 4d, 4d, 5s) frac k rek( 4d, 4d, 4d, 5s) frac - ------------------------------------- ----- - ------------------------------------- ----- 2 0.00000000 ryd = 0.0000 cm-1 0.000 2 0.00000000 ryd = 0.0000 cm-1 0.000 ag i d9 5s8d -d8 5s2 5d 1 0.0000 5 20 22 22 0.672 0.039 253.391 sec rcn mod 32 ee,eee= -0.02853 -0.01426 ee,eee= -0.12522 -0.07687 slater integrals for ag i d9 5s8d nconf=20 z= 47 ion= 0 exf=0.650 irel= 1 ag i d8 5s2 5d nconf=22 kut=-1 corrf=0.000 class 0 k rdk( 4d, 8d, 5s, 5d) frac k rek( 4d, 8d, 5s, 5d) frac - ------------------------------------- ----- - ------------------------------------- ----- 2 -0.00370747 ryd = -406.8475 cm-1 -0.753 2 -0.00043711 ryd = -47.9678 cm-1 -0.269 ag i d9 5s8d -d8 5s2 5d 2 -0.4068 5 -0.0480 5 20 22 22 0.727 0.031 254.164 sec sqrtdel= 1.0000 1.0000 0.0000 -0.4068 -0.0480 rcn mod 32 ee,eee= -0.02853 -0.01426 ee,eee= -0.04001 -0.03427 slater integrals for ag i d9 5s8d nconf=20 z= 47 ion= 0 exf=0.650 irel= 1 ag i d10 5g nconf=23 kut=-1 corrf=0.000 class 0 k rdk( 5s, 8d, 4d, 5g) frac k rek( 5s, 8d, 4d, 5g) frac - ------------------------------------- ----- - ------------------------------------- ----- 2 0.00000712 ryd = 0.7816 cm-1 0.019 4 -0.00000798 ryd = -0.8756 cm-1 -0.928 ag i d9 5s8d -d10 5g 2 0.0008 5 -0.0009 5 20 23 23 0.883 0.039 255.102 sec sqrtdel= 1.0000 1.0000 0.0008 -0.0009 rcn mod 32 ee,eee= -0.02779 -0.02816 slater integrals for ag i d9 5s8d nconf=20 z= 47 ion= 0 exf=0.650 irel= 1 ag i d10 6g nconf=24 kut=-1 corrf=0.000 class 0 k rdk( 5s, 8d, 4d, 6g) frac k rek( 5s, 8d, 4d, 6g) frac - ------------------------------------- ----- - ------------------------------------- ----- 2 0.00001023 ryd = 1.1223 cm-1 0.032 4 -0.00000839 ryd = -0.9208 cm-1 -0.927 ag i d9 5s8d -d10 6g 2 0.0011 5 -0.0009 5 20 24 1 0.031 0.047 255.180 sec sqrtdel= 1.0000 1.0000 0.0011 -0.0009 rcn mod 32 ee,eee= -0.02042 -0.02447 slater integrals for ag i d9 5s8d nconf=20 z= 47 ion= 0 exf=0.650 irel= 1 ag i d10 7g nconf=25 kut=-1 corrf=0.000 class 0 k rdk( 5s, 8d, 4d, 7g) frac k rek( 5s, 8d, 4d, 7g) frac - ------------------------------------- ----- - ------------------------------------- ----- 2 0.00004642 ryd = 5.0937 cm-1 0.179 4 -0.00000778 ryd = -0.8532 cm-1 -0.926 ag i d9 5s8d -d10 7g 2 0.0051 5 -0.0009 5 20 25 1 0.031 0.109 255.320 sec sqrtdel= 1.0000 1.0000 0.0051 -0.0009 rcn mod 32 ee,eee= -0.01563 -0.02208 slater integrals for ag i d9 5s8d nconf=20 z= 47 ion= 0 exf=0.650 irel= 1 ag i d10 8g nconf=26 kut=-1 corrf=0.000 class 0 k rdk( 5s, 8d, 4d, 8g) frac k rek( 5s, 8d, 4d, 8g) frac - ------------------------------------- ----- - ------------------------------------- ----- 2 0.00004125 ryd = 4.5264 cm-1 0.187 4 -0.00000697 ryd = -0.7645 cm-1 -0.925 ag i d9 5s8d -d10 8g 2 0.0045 5 -0.0008 5 20 26 1 0.031 0.008 255.383 sec sqrtdel= 1.0000 1.0000 0.0045 -0.0008 rcn mod 32 ee,eee= -0.01235 -0.02044 slater integrals for ag i d9 5s8d nconf=20 z= 47 ion= 0 exf=0.650 irel= 1 ag i d10 9g nconf=27 kut=-1 corrf=0.000 class 0 k rdk( 5s, 8d, 4d, 9g) frac k rek( 5s, 8d, 4d, 9g) frac - ------------------------------------- ----- - ------------------------------------- ----- 2 0.00003343 ryd = 3.6685 cm-1 0.177 4 -0.00000619 ryd = -0.6793 cm-1 -0.925 ag i d9 5s8d -d10 9g 2 0.0037 5 -0.0007 5 20 27 1 0.031 0.047 255.461 sec sqrtdel= 1.0000 1.0000 0.0037 -0.0007 rcn mod 32 ee,eee= -0.02853 -0.01426 ee,eee= -0.04004 -0.03429 slater integrals for ag i d9 5s8d nconf=20 z= 47 ion= 0 exf=0.650 irel= 1 ag i d9 5s5g nconf=28 kut=-1 corrf=0.000 class 0 k rdk( 4d, 8d, 4d, 5g) frac k rek( 4d, 8d, 4d, 5g) frac - ------------------------------------- ----- - ------------------------------------- ----- 2 -0.00000327 ryd = -0.3588 cm-1 -0.013 2 0.00000121 ryd = 0.1328 cm-1 0.447 4 0.00000703 ryd = 0.7709 cm-1 0.578 4 0.00000100 ryd = 0.1098 cm-1 0.649 ag i d9 5s8d -d9 5s5g 4 -0.0004 5 0.0008 5 0.0001 5 0.0001 5 20 28 28 1.570 0.055 257.086 sec sqrtdel= 1.0000 1.0000 -0.0004 0.0008 0.0001 0.0001 rcn mod 32 ee,eee= -0.02782 -0.02817 slater integrals for ag i d9 5s8d nconf=20 z= 47 ion= 0 exf=0.650 irel= 1 ag i d9 5s6g nconf=29 kut=-1 corrf=0.000 class 0 k rdk( 4d, 8d, 4d, 6g) frac k rek( 4d, 8d, 4d, 6g) frac - ------------------------------------- ----- - ------------------------------------- ----- 2 -0.00000508 ryd = -0.5575 cm-1 -0.024 2 0.00000128 ryd = 0.1410 cm-1 0.440 4 0.00000755 ryd = 0.8285 cm-1 0.620 4 0.00000107 ryd = 0.1172 cm-1 0.642 ag i d9 5s8d -d9 5s6g 4 -0.0006 5 0.0008 5 0.0001 5 0.0001 5 20 29 1 0.031 0.023 257.141 sec sqrtdel= 1.0000 1.0000 -0.0006 0.0008 0.0001 0.0001 rcn mod 32 ee,eee= -0.02044 -0.02448 slater integrals for ag i d9 5s8d nconf=20 z= 47 ion= 0 exf=0.650 irel= 1 ag i d9 5s7g nconf=30 kut=-1 corrf=0.000 class 0 k rdk( 4d, 8d, 4d, 7g) frac k rek( 4d, 8d, 4d, 7g) frac - ------------------------------------- ----- - ------------------------------------- ----- 2 -0.00002987 ryd = -3.2780 cm-1 -0.173 2 0.00000120 ryd = 0.1315 cm-1 0.437 4 0.00000708 ryd = 0.7772 cm-1 0.642 4 0.00000100 ryd = 0.1096 cm-1 0.639 ag i d9 5s8d -d9 5s7g 4 -0.0033 5 0.0008 5 0.0001 5 0.0001 5 20 30 1 0.023 0.031 257.211 sec sqrtdel= 1.0000 1.0000 -0.0033 0.0008 0.0001 0.0001 rcn mod 32 ee,eee= -0.01565 -0.02209 slater integrals for ag i d9 5s8d nconf=20 z= 47 ion= 0 exf=0.650 irel= 1 ag i d9 5s8g nconf=31 kut=-1 corrf=0.000 class 0 k rdk( 4d, 8d, 4d, 8g) frac k rek( 4d, 8d, 4d, 8g) frac - ------------------------------------- ----- - ------------------------------------- ----- 2 -0.00002641 ryd = -2.8985 cm-1 -0.179 2 0.00000108 ryd = 0.1184 cm-1 0.435 4 0.00000642 ryd = 0.7046 cm-1 0.657 4 0.00000090 ryd = 0.0989 cm-1 0.637 ag i d9 5s8d -d9 5s8g 4 -0.0029 5 0.0007 5 0.0001 5 0.0001 5 20 31 1 0.031 0.039 257.281 sec sqrtdel= 1.0000 1.0000 -0.0029 0.0007 0.0001 0.0001 rcn mod 32 ee,eee= -0.01236 -0.02044 slater integrals for ag i d9 5s8d nconf=20 z= 47 ion= 0 exf=0.650 irel= 1 ag i d9 5s9g nconf=32 kut=-1 corrf=0.000 class 0 k rdk( 4d, 8d, 4d, 9g) frac k rek( 4d, 8d, 4d, 9g) frac - ------------------------------------- ----- - ------------------------------------- ----- 2 -0.00002117 ryd = -2.3236 cm-1 -0.167 2 0.00000096 ryd = 0.1056 cm-1 0.434 4 0.00000576 ryd = 0.6318 cm-1 0.667 4 0.00000081 ryd = 0.0884 cm-1 0.636 ag i d9 5s8d -d9 5s9g 4 -0.0023 5 0.0006 5 0.0001 5 0.0001 5 20 32 1 0.023 0.031 257.352 sec sqrtdel= 1.0000 1.0000 -0.0023 0.0006 0.0001 0.0001 rcn mod 32 ee,eee= -0.02041 -0.02447 slater integrals for ag i d9 5s8d nconf=20 z= 47 ion= 0 exf=0.650 irel= 1 ag i d9 5s7i nconf=36 kut=-1 corrf=0.000 class 0 k rdk( 4d, 8d, 4d, 7i) frac k rek( 4d, 8d, 4d, 7i) frac - ------------------------------------- ----- - ------------------------------------- ----- 4 0.00000000 ryd = -0.0004 cm-1 -0.016 4 0.00000000 ryd = 0.0002 cm-1 0.903 ag i d9 5s8d -d9 5s7i 2 0.0000 5 0.0000 5 20 36 4 0.094 0.023 257.484 sec sqrtdel= 1.0000 1.0000 0.0000 0.0000 rcn mod 32 ee,eee= -0.01563 -0.02208 slater integrals for ag i d9 5s8d nconf=20 z= 47 ion= 0 exf=0.650 irel= 1 ag i d9 5s8i nconf=37 kut=-1 corrf=0.000 class 0 k rdk( 4d, 8d, 4d, 8i) frac k rek( 4d, 8d, 4d, 8i) frac - ------------------------------------- ----- - ------------------------------------- ----- 4 0.00000001 ryd = 0.0013 cm-1 0.042 4 0.00000000 ryd = 0.0002 cm-1 0.902 ag i d9 5s8d -d9 5s8i 2 0.0000 5 0.0000 5 20 37 1 0.023 0.078 257.594 sec sqrtdel= 1.0000 1.0000 0.0000 0.0000 rcn mod 32 ee,eee= -0.01234 -0.02044 slater integrals for ag i d9 5s8d nconf=20 z= 47 ion= 0 exf=0.650 irel= 1 ag i d9 5s9i nconf=38 kut=-1 corrf=0.000 class 0 k rdk( 4d, 8d, 4d, 9i) frac k rek( 4d, 8d, 4d, 9i) frac - ------------------------------------- ----- - ------------------------------------- ----- 4 0.00000001 ryd = 0.0012 cm-1 0.041 4 0.00000000 ryd = 0.0003 cm-1 0.901 ag i d9 5s8d -d9 5s9i 2 0.0000 5 0.0000 5 20 38 1 0.063 0.016 257.672 sec sqrtdel= 1.0000 1.0000 0.0000 0.0000 rcn mod 32 ee,eee= -0.02853 -0.01426 ee,eee= -0.38785 -0.20819 slater integrals for ag i d9 5s8d nconf=20 z= 47 ion= 0 exf=0.650 irel= 1 ag i d9 5p2 nconf=41 kut=-1 corrf=0.000 class 0 k rdk( 5s, 8d, 5p, 5p) frac k rek( 5s, 8d, 5p, 5p) frac - ------------------------------------- ----- - ------------------------------------- ----- 1 0.03475221 ryd = 3813.6137 cm-1 0.970 1 0.03475221 ryd = 3813.6137 cm-1 0.970 ag i d9 5s8d -d9 5p2 1 3.8136 5 20 41 41 1.148 0.078 258.922 sec sqrtdel= 1.0000 1.0000 3.8136 rcn mod 32 ee,eee= -2.06141 -1.03070 ee,eee= -1.05985 -1.56063 slater integrals for ag i d9 5s9d nconf=21 z= 47 ion= 0 exf=0.650 irel= 1 ag i d8 5s2 5d nconf=22 kut=-1 corrf=0.000 class 0 k rdk( 4d, 4d, 4d, 5s) frac k rek( 4d, 4d, 4d, 5s) frac - ------------------------------------- ----- - ------------------------------------- ----- 2 0.00000000 ryd = 0.0000 cm-1 0.000 2 0.00000000 ryd = 0.0000 cm-1 0.000 ag i d9 5s9d -d8 5s2 5d 1 0.0000 5 21 22 22 1.242 0.031 260.203 sec rcn mod 32 ee,eee= -0.02086 -0.01043 ee,eee= -0.12522 -0.07304 slater integrals for ag i d9 5s9d nconf=21 z= 47 ion= 0 exf=0.650 irel= 1 ag i d8 5s2 5d nconf=22 kut=-1 corrf=0.000 class 0 k rdk( 4d, 9d, 5s, 5d) frac k rek( 4d, 9d, 5s, 5d) frac - ------------------------------------- ----- - ------------------------------------- ----- 2 -0.00287406 ryd = -315.3921 cm-1 -0.740 2 -0.00034753 ryd = -38.1370 cm-1 -0.266 ag i d9 5s9d -d8 5s2 5d 2 -0.3154 5 -0.0381 5 21 22 22 0.617 0.023 260.844 sec sqrtdel= 1.0000 1.0000 0.0000 -0.3154 -0.0381 rcn mod 32 ee,eee= -0.02086 -0.01043 ee,eee= -0.04001 -0.03044 slater integrals for ag i d9 5s9d nconf=21 z= 47 ion= 0 exf=0.650 irel= 1 ag i d10 5g nconf=23 kut=-1 corrf=0.000 class 0 k rdk( 5s, 9d, 4d, 5g) frac k rek( 5s, 9d, 4d, 5g) frac - ------------------------------------- ----- - ------------------------------------- ----- 2 0.00000469 ryd = 0.5141 cm-1 0.016 4 -0.00000638 ryd = -0.7002 cm-1 -0.928 ag i d9 5s9d -d10 5g 2 0.0005 5 -0.0007 5 21 23 23 0.984 0.031 261.867 sec sqrtdel= 1.0000 1.0000 0.0005 -0.0007 rcn mod 32 ee,eee= -0.02779 -0.02433 slater integrals for ag i d9 5s9d nconf=21 z= 47 ion= 0 exf=0.650 irel= 1 ag i d10 6g nconf=24 kut=-1 corrf=0.000 class 0 k rdk( 5s, 9d, 4d, 6g) frac k rek( 5s, 9d, 4d, 6g) frac - ------------------------------------- ----- - ------------------------------------- ----- 2 0.00000727 ryd = 0.7975 cm-1 0.030 4 -0.00000671 ryd = -0.7365 cm-1 -0.927 ag i d9 5s9d -d10 6g 2 0.0008 5 -0.0007 5 21 24 1 0.016 0.031 261.922 sec sqrtdel= 1.0000 1.0000 0.0008 -0.0007 rcn mod 32 ee,eee= -0.02042 -0.02064 slater integrals for ag i d9 5s9d nconf=21 z= 47 ion= 0 exf=0.650 irel= 1 ag i d10 7g nconf=25 kut=-1 corrf=0.000 class 0 k rdk( 5s, 9d, 4d, 7g) frac k rek( 5s, 9d, 4d, 7g) frac - ------------------------------------- ----- - ------------------------------------- ----- 2 0.00000809 ryd = 0.8876 cm-1 0.040 4 -0.00000622 ryd = -0.6825 cm-1 -0.926 ag i d9 5s9d -d10 7g 2 0.0009 5 -0.0007 5 21 25 1 0.031 0.031 261.992 sec sqrtdel= 1.0000 1.0000 0.0009 -0.0007 rcn mod 32 ee,eee= -0.01563 -0.01825 slater integrals for ag i d9 5s9d nconf=21 z= 47 ion= 0 exf=0.650 irel= 1 ag i d10 8g nconf=26 kut=-1 corrf=0.000 class 0 k rdk( 5s, 9d, 4d, 8g) frac k rek( 5s, 9d, 4d, 8g) frac - ------------------------------------- ----- - ------------------------------------- ----- 2 0.00002334 ryd = 2.5607 cm-1 0.139 4 -0.00000557 ryd = -0.6116 cm-1 -0.925 ag i d9 5s9d -d10 8g 2 0.0026 5 -0.0006 5 21 26 1 0.016 0.031 262.102 sec sqrtdel= 1.0000 1.0000 0.0026 -0.0006 rcn mod 32 ee,eee= -0.01235 -0.01660 slater integrals for ag i d9 5s9d nconf=21 z= 47 ion= 0 exf=0.650 irel= 1 ag i d10 9g nconf=27 kut=-1 corrf=0.000 class 0 k rdk( 5s, 9d, 4d, 9g) frac k rek( 5s, 9d, 4d, 9g) frac - ------------------------------------- ----- - ------------------------------------- ----- 2 0.00002319 ryd = 2.5445 cm-1 0.161 4 -0.00000495 ryd = -0.5434 cm-1 -0.925 ag i d9 5s9d -d10 9g 2 0.0025 5 -0.0005 5 21 27 1 0.031 0.023 262.156 sec sqrtdel= 1.0000 1.0000 0.0025 -0.0005 rcn mod 32 ee,eee= -0.02086 -0.01043 ee,eee= -0.04004 -0.03045 slater integrals for ag i d9 5s9d nconf=21 z= 47 ion= 0 exf=0.650 irel= 1 ag i d9 5s5g nconf=28 kut=-1 corrf=0.000 class 0 k rdk( 4d, 9d, 4d, 5g) frac k rek( 4d, 9d, 4d, 5g) frac - ------------------------------------- ----- - ------------------------------------- ----- 2 -0.00000192 ryd = -0.2107 cm-1 -0.010 2 0.00000098 ryd = 0.1073 cm-1 0.448 4 0.00000538 ryd = 0.5900 cm-1 0.565 4 0.00000081 ryd = 0.0885 cm-1 0.650 ag i d9 5s9d -d9 5s5g 4 -0.0002 5 0.0006 5 0.0001 5 0.0001 5 21 28 28 0.891 0.094 263.164 sec sqrtdel= 1.0000 1.0000 -0.0002 0.0006 0.0001 0.0001 rcn mod 32 ee,eee= -0.02782 -0.02434 slater integrals for ag i d9 5s9d nconf=21 z= 47 ion= 0 exf=0.650 irel= 1 ag i d9 5s6g nconf=29 kut=-1 corrf=0.000 class 0 k rdk( 4d, 9d, 4d, 6g) frac k rek( 4d, 9d, 4d, 6g) frac - ------------------------------------- ----- - ------------------------------------- ----- 2 -0.00000344 ryd = -0.3773 cm-1 -0.021 2 0.00000104 ryd = 0.1139 cm-1 0.442 4 0.00000578 ryd = 0.6345 cm-1 0.606 4 0.00000086 ryd = 0.0945 cm-1 0.644 ag i d9 5s9d -d9 5s6g 4 -0.0004 5 0.0006 5 0.0001 5 0.0001 5 21 29 1 0.031 0.023 263.234 sec sqrtdel= 1.0000 1.0000 -0.0004 0.0006 0.0001 0.0001 rcn mod 32 ee,eee= -0.02044 -0.02065 slater integrals for ag i d9 5s9d nconf=21 z= 47 ion= 0 exf=0.650 irel= 1 ag i d9 5s7g nconf=30 kut=-1 corrf=0.000 class 0 k rdk( 4d, 9d, 4d, 7g) frac k rek( 4d, 9d, 4d, 7g) frac - ------------------------------------- ----- - ------------------------------------- ----- 2 -0.00000399 ryd = -0.4377 cm-1 -0.030 2 0.00000097 ryd = 0.1062 cm-1 0.439 4 0.00000543 ryd = 0.5963 cm-1 0.629 4 0.00000081 ryd = 0.0884 cm-1 0.640 ag i d9 5s9d -d9 5s7g 4 -0.0004 5 0.0006 5 0.0001 5 0.0001 5 21 30 1 0.031 0.023 263.305 sec sqrtdel= 1.0000 1.0000 -0.0004 0.0006 0.0001 0.0001 rcn mod 32 ee,eee= -0.01565 -0.01825 slater integrals for ag i d9 5s9d nconf=21 z= 47 ion= 0 exf=0.650 irel= 1 ag i d9 5s8g nconf=31 kut=-1 corrf=0.000 class 0 k rdk( 4d, 9d, 4d, 8g) frac k rek( 4d, 9d, 4d, 8g) frac - ------------------------------------- ----- - ------------------------------------- ----- 2 -0.00001451 ryd = -1.5927 cm-1 -0.129 2 0.00000087 ryd = 0.0956 cm-1 0.436 4 0.00000491 ryd = 0.5392 cm-1 0.642 4 0.00000073 ryd = 0.0798 cm-1 0.638 ag i d9 5s9d -d9 5s8g 4 -0.0016 5 0.0005 5 0.0001 5 0.0001 5 21 31 1 0.023 0.023 263.367 sec sqrtdel= 1.0000 1.0000 -0.0016 0.0005 0.0001 0.0001 rcn mod 32 ee,eee= -0.01236 -0.01661 slater integrals for ag i d9 5s9d nconf=21 z= 47 ion= 0 exf=0.650 irel= 1 ag i d9 5s9g nconf=32 kut=-1 corrf=0.000 class 0 k rdk( 4d, 9d, 4d, 9g) frac k rek( 4d, 9d, 4d, 9g) frac - ------------------------------------- ----- - ------------------------------------- ----- 2 -0.00001451 ryd = -1.5923 cm-1 -0.150 2 0.00000078 ryd = 0.0853 cm-1 0.435 4 0.00000440 ryd = 0.4828 cm-1 0.651 4 0.00000065 ryd = 0.0713 cm-1 0.637 ag i d9 5s9d -d9 5s9g 4 -0.0016 5 0.0005 5 0.0001 5 0.0001 5 21 32 1 0.031 0.016 263.430 sec sqrtdel= 1.0000 1.0000 -0.0016 0.0005 0.0001 0.0001 rcn mod 32 ee,eee= -0.02041 -0.02063 slater integrals for ag i d9 5s9d nconf=21 z= 47 ion= 0 exf=0.650 irel= 1 ag i d9 5s7i nconf=36 kut=-1 corrf=0.000 class 0 k rdk( 4d, 9d, 4d, 7i) frac k rek( 4d, 9d, 4d, 7i) frac - ------------------------------------- ----- - ------------------------------------- ----- 4 0.00000000 ryd = -0.0002 cm-1 -0.010 4 0.00000000 ryd = 0.0002 cm-1 0.903 ag i d9 5s9d -d9 5s7i 2 0.0000 5 0.0000 5 21 36 4 0.344 0.031 263.836 sec sqrtdel= 1.0000 1.0000 0.0000 0.0000 rcn mod 32 ee,eee= -0.01563 -0.01824 slater integrals for ag i d9 5s9d nconf=21 z= 47 ion= 0 exf=0.650 irel= 1 ag i d9 5s8i nconf=37 kut=-1 corrf=0.000 class 0 k rdk( 4d, 9d, 4d, 8i) frac k rek( 4d, 9d, 4d, 8i) frac - ------------------------------------- ----- - ------------------------------------- ----- 4 0.00000000 ryd = -0.0003 cm-1 -0.015 4 0.00000000 ryd = 0.0002 cm-1 0.902 ag i d9 5s9d -d9 5s8i 2 0.0000 5 0.0000 5 21 37 1 0.023 0.039 263.906 sec sqrtdel= 1.0000 1.0000 0.0000 0.0000 rcn mod 32 ee,eee= -0.01234 -0.01660 slater integrals for ag i d9 5s9d nconf=21 z= 47 ion= 0 exf=0.650 irel= 1 ag i d9 5s9i nconf=38 kut=-1 corrf=0.000 class 0 k rdk( 4d, 9d, 4d, 9i) frac k rek( 4d, 9d, 4d, 9i) frac - ------------------------------------- ----- - ------------------------------------- ----- 4 0.00000000 ryd = 0.0001 cm-1 0.005 4 0.00000000 ryd = 0.0002 cm-1 0.901 ag i d9 5s9d -d9 5s9i 2 0.0000 5 0.0000 5 21 38 1 0.023 0.023 263.953 sec sqrtdel= 1.0000 1.0000 0.0000 0.0000 rcn mod 32 ee,eee= -0.02086 -0.01043 ee,eee= -0.38785 -0.20435 slater integrals for ag i d9 5s9d nconf=21 z= 47 ion= 0 exf=0.650 irel= 1 ag i d9 5p2 nconf=41 kut=-1 corrf=0.000 class 0 k rdk( 5s, 9d, 5p, 5p) frac k rek( 5s, 9d, 5p, 5p) frac - ------------------------------------- ----- - ------------------------------------- ----- 1 0.02747469 ryd = 3014.9986 cm-1 0.966 1 0.02747469 ryd = 3014.9986 cm-1 0.966 ag i d9 5s9d -d9 5p2 1 3.0150 5 21 41 41 1.625 0.031 265.672 sec sqrtdel= 1.0000 1.0000 3.0150 rcn mod 32 ee,eee= -0.12522 -0.06261 ee,eee= -0.04004 -0.08263 slater integrals for ag i d8 5s2 5d nconf=22 z= 47 ion= 0 exf=0.650 irel= 1 ag i d9 5s5g nconf=28 kut=-1 corrf=0.000 class 0 k rdk( 5s, 5d, 4d, 5g) frac k rek( 5s, 5d, 4d, 5g) frac - ------------------------------------- ----- - ------------------------------------- ----- 2 -0.00088278 ryd = -96.8740 cm-1 -0.953 4 -0.00001292 ryd = -1.4175 cm-1 -0.832 ag i d8 5s2 5d -d9 5s5g 2 -0.0969 5 -0.0014 5 22 28 28 1.234 0.070 267.000 sec sqrtdel= 1.0000 1.0000 -0.0969 -0.0014 rcn mod 32 ee,eee= -0.02782 -0.07652 slater integrals for ag i d8 5s2 5d nconf=22 z= 47 ion= 0 exf=0.650 irel= 1 ag i d9 5s6g nconf=29 kut=-1 corrf=0.000 class 0 k rdk( 5s, 5d, 4d, 6g) frac k rek( 5s, 5d, 4d, 6g) frac - ------------------------------------- ----- - ------------------------------------- ----- 2 -0.00083132 ryd = -91.2267 cm-1 -0.953 4 -0.00001366 ryd = -1.4992 cm-1 -0.828 ag i d8 5s2 5d -d9 5s6g 2 -0.0912 5 -0.0015 5 22 29 1 0.016 0.039 267.070 sec sqrtdel= 1.0000 1.0000 -0.0912 -0.0015 rcn mod 32 ee,eee= -0.02044 -0.07283 slater integrals for ag i d8 5s2 5d nconf=22 z= 47 ion= 0 exf=0.650 irel= 1 ag i d9 5s7g nconf=30 kut=-1 corrf=0.000 class 0 k rdk( 5s, 5d, 4d, 7g) frac k rek( 5s, 5d, 4d, 7g) frac - ------------------------------------- ----- - ------------------------------------- ----- 2 -0.00072368 ryd = -79.4152 cm-1 -0.951 4 -0.00001271 ryd = -1.3950 cm-1 -0.826 ag i d8 5s2 5d -d9 5s7g 2 -0.0794 5 -0.0014 5 22 30 1 0.016 0.023 267.125 sec sqrtdel= 1.0000 1.0000 -0.0794 -0.0014 rcn mod 32 ee,eee= -0.01565 -0.07043 slater integrals for ag i d8 5s2 5d nconf=22 z= 47 ion= 0 exf=0.650 irel= 1 ag i d9 5s8g nconf=31 kut=-1 corrf=0.000 class 0 k rdk( 5s, 5d, 4d, 8g) frac k rek( 5s, 5d, 4d, 8g) frac - ------------------------------------- ----- - ------------------------------------- ----- 2 -0.00062342 ryd = -68.4121 cm-1 -0.950 4 -0.00001143 ryd = -1.2540 cm-1 -0.825 ag i d8 5s2 5d -d9 5s8g 2 -0.0684 5 -0.0013 5 22 31 1 0.070 0.016 267.211 sec sqrtdel= 1.0000 1.0000 -0.0684 -0.0013 rcn mod 32 ee,eee= -0.01236 -0.06879 slater integrals for ag i d8 5s2 5d nconf=22 z= 47 ion= 0 exf=0.650 irel= 1 ag i d9 5s9g nconf=32 kut=-1 corrf=0.000 class 0 k rdk( 5s, 5d, 4d, 9g) frac k rek( 5s, 5d, 4d, 9g) frac - ------------------------------------- ----- - ------------------------------------- ----- 2 -0.00053945 ryd = -59.1974 cm-1 -0.949 4 -0.00001018 ryd = -1.1172 cm-1 -0.824 ag i d8 5s2 5d -d9 5s9g 2 -0.0592 5 -0.0011 5 22 32 1 0.031 0.031 267.273 sec sqrtdel= 1.0000 1.0000 -0.0592 -0.0011 rcn mod 32 ee,eee= -1.72935 -0.86467 ee,eee= -1.13103 -1.43019 slater integrals for ag i d10 5g nconf=23 z= 47 ion= 0 exf=0.650 irel= 1 ag i d9 5s5g nconf=28 kut=-1 corrf=0.000 class 0 k rdk( 4d, 4d, 4d, 5s) frac k rek( 4d, 4d, 4d, 5s) frac - ------------------------------------- ----- - ------------------------------------- ----- 2 -0.13771307 ryd = -15112.2616 cm-1 -0.475 2 -0.13771333 ryd = -15112.2907 cm-1 -0.475 ag i d10 5g -d9 5s5g 1 -15.1123 5 23 28 28 1.031 0.188 268.531 sec rcn mod 32 ee,eee= -0.04001 -0.02001 ee,eee= -0.04004 -0.04003 slater integrals for ag i d10 5g nconf=23 z= 47 ion= 0 exf=0.650 irel= 1 ag i d9 5s5g nconf=28 kut=-1 corrf=0.000 class 0 k rdk( 4d, 5g, 5s, 5g) frac k rek( 4d, 5g, 5s, 5g) frac - ------------------------------------- ----- - ------------------------------------- ----- 2 -0.00056276 ryd = -61.7561 cm-1 -0.961 4 -0.00000025 ryd = -0.0272 cm-1 -1.000 ag i d10 5g -d9 5s5g 2 -0.0618 5 0.0000 5 23 28 28 0.922 0.023 269.477 sec sqrtdel= 1.0000 1.0000 -15.1123 -0.0618 0.0000 rcn mod 32 ee,eee= -1.72935 -0.86467 ee,eee= -1.15548 -1.44241 slater integrals for ag i d10 5g nconf=23 z= 47 ion= 0 exf=0.650 irel= 1 ag i d9 5s6g nconf=29 kut=-1 corrf=0.000 class 0 k rdk( 4d, 4d, 4d, 5s) frac k rek( 4d, 4d, 4d, 5s) frac - ------------------------------------- ----- - ------------------------------------- ----- 2 0.00000000 ryd = 0.0000 cm-1 0.000 2 0.00000000 ryd = 0.0000 cm-1 0.000 ag i d10 5g -d9 5s6g 1 0.0000 5 23 29 29 0.820 0.023 270.320 sec rcn mod 32 ee,eee= -0.04001 -0.02001 ee,eee= -0.02782 -0.03392 slater integrals for ag i d10 5g nconf=23 z= 47 ion= 0 exf=0.650 irel= 1 ag i d9 5s6g nconf=29 kut=-1 corrf=0.000 class 0 k rdk( 4d, 5g, 5s, 6g) frac k rek( 4d, 5g, 5s, 6g) frac - ------------------------------------- ----- - ------------------------------------- ----- 2 -0.00032610 ryd = -35.7851 cm-1 -0.810 4 -0.00000026 ryd = -0.0286 cm-1 -1.000 ag i d10 5g -d9 5s6g 2 -0.0358 5 0.0000 5 23 29 29 1.164 0.031 271.516 sec sqrtdel= 1.0000 1.0000 0.0000 -0.0358 0.0000 rcn mod 32 ee,eee= -1.72935 -0.86467 ee,eee= -1.17021 -1.44978 slater integrals for ag i d10 5g nconf=23 z= 47 ion= 0 exf=0.650 irel= 1 ag i d9 5s7g nconf=30 kut=-1 corrf=0.000 class 0 k rdk( 4d, 4d, 4d, 5s) frac k rek( 4d, 4d, 4d, 5s) frac - ------------------------------------- ----- - ------------------------------------- ----- 2 0.00000000 ryd = 0.0000 cm-1 0.000 2 0.00000000 ryd = 0.0000 cm-1 0.000 ag i d10 5g -d9 5s7g 1 0.0000 5 23 30 30 1.047 0.023 272.594 sec rcn mod 32 ee,eee= -0.04001 -0.02001 ee,eee= -0.02044 -0.03023 slater integrals for ag i d10 5g nconf=23 z= 47 ion= 0 exf=0.650 irel= 1 ag i d9 5s7g nconf=30 kut=-1 corrf=0.000 class 0 k rdk( 4d, 5g, 5s, 7g) frac k rek( 4d, 5g, 5s, 7g) frac - ------------------------------------- ----- - ------------------------------------- ----- 2 -0.00023068 ryd = -25.3140 cm-1 -0.748 4 -0.00000024 ryd = -0.0266 cm-1 -1.000 ag i d10 5g -d9 5s7g 2 -0.0253 5 0.0000 5 23 30 30 1.578 0.078 274.250 sec sqrtdel= 1.0000 1.0000 0.0000 -0.0253 0.0000 rcn mod 32 ee,eee= -1.72935 -0.86467 ee,eee= -1.17978 -1.45456 slater integrals for ag i d10 5g nconf=23 z= 47 ion= 0 exf=0.650 irel= 1 ag i d9 5s8g nconf=31 kut=-1 corrf=0.000 class 0 k rdk( 4d, 4d, 4d, 5s) frac k rek( 4d, 4d, 4d, 5s) frac - ------------------------------------- ----- - ------------------------------------- ----- 2 0.00000000 ryd = 0.0000 cm-1 0.000 2 0.00000000 ryd = 0.0000 cm-1 0.000 ag i d10 5g -d9 5s8g 1 0.0000 5 23 31 31 0.828 0.023 275.117 sec rcn mod 32 ee,eee= -0.04001 -0.02001 ee,eee= -0.01565 -0.02783 slater integrals for ag i d10 5g nconf=23 z= 47 ion= 0 exf=0.650 irel= 1 ag i d9 5s8g nconf=31 kut=-1 corrf=0.000 class 0 k rdk( 4d, 5g, 5s, 8g) frac k rek( 4d, 5g, 5s, 8g) frac - ------------------------------------- ----- - ------------------------------------- ----- 2 -0.00017688 ryd = -19.4104 cm-1 -0.714 4 -0.00000022 ryd = -0.0238 cm-1 -1.000 ag i d10 5g -d9 5s8g 2 -0.0194 5 0.0000 5 23 31 31 1.289 0.008 276.414 sec sqrtdel= 1.0000 1.0000 0.0000 -0.0194 0.0000 rcn mod 32 ee,eee= -1.72935 -0.86467 ee,eee= -1.18634 -1.45784 slater integrals for ag i d10 5g nconf=23 z= 47 ion= 0 exf=0.650 irel= 1 ag i d9 5s9g nconf=32 kut=-1 corrf=0.000 class 0 k rdk( 4d, 4d, 4d, 5s) frac k rek( 4d, 4d, 4d, 5s) frac - ------------------------------------- ----- - ------------------------------------- ----- 2 0.00000000 ryd = 0.0000 cm-1 0.000 2 0.00000000 ryd = 0.0000 cm-1 0.000 ag i d10 5g -d9 5s9g 1 0.0000 5 23 32 32 1.055 0.016 277.492 sec rcn mod 32 ee,eee= -0.04001 -0.02001 ee,eee= -0.01236 -0.02619 slater integrals for ag i d10 5g nconf=23 z= 47 ion= 0 exf=0.650 irel= 1 ag i d9 5s9g nconf=32 kut=-1 corrf=0.000 class 0 k rdk( 4d, 5g, 5s, 9g) frac k rek( 4d, 5g, 5s, 9g) frac - ------------------------------------- ----- - ------------------------------------- ----- 2 -0.00014220 ryd = -15.6049 cm-1 -0.693 4 -0.00000019 ryd = -0.0212 cm-1 -1.000 ag i d10 5g -d9 5s9g 2 -0.0156 5 0.0000 5 23 32 32 1.125 0.023 278.641 sec sqrtdel= 1.0000 1.0000 0.0000 -0.0156 0.0000 rcn mod 32 ee,eee= -0.02041 -0.03021 slater integrals for ag i d10 5g nconf=23 z= 47 ion= 0 exf=0.650 irel= 1 ag i d9 5s7i nconf=36 kut=-1 corrf=0.000 class 0 k rdk( 4d, 5g, 5s, 7i) frac k rek( 4d, 5g, 5s, 7i) frac - ------------------------------------- ----- - ------------------------------------- ----- 2 -0.00009790 ryd = -10.7437 cm-1 -0.961 4 0.00000000 ryd = -0.0001 cm-1 -1.000 ag i d10 5g -d9 5s7i 2 -0.0107 5 0.0000 5 23 36 4 0.133 0.016 278.820 sec sqrtdel= 1.0000 1.0000 -0.0107 0.0000 rcn mod 32 ee,eee= -0.01563 -0.02782 slater integrals for ag i d10 5g nconf=23 z= 47 ion= 0 exf=0.650 irel= 1 ag i d9 5s8i nconf=37 kut=-1 corrf=0.000 class 0 k rdk( 4d, 5g, 5s, 8i) frac k rek( 4d, 5g, 5s, 8i) frac - ------------------------------------- ----- - ------------------------------------- ----- 2 -0.00009682 ryd = -10.6249 cm-1 -0.956 4 0.00000000 ryd = -0.0001 cm-1 -1.000 ag i d10 5g -d9 5s8i 2 -0.0106 5 0.0000 5 23 37 1 0.031 0.016 278.883 sec sqrtdel= 1.0000 1.0000 -0.0106 0.0000 rcn mod 32 ee,eee= -0.01234 -0.02618 slater integrals for ag i d10 5g nconf=23 z= 47 ion= 0 exf=0.650 irel= 1 ag i d9 5s9i nconf=38 kut=-1 corrf=0.000 class 0 k rdk( 4d, 5g, 5s, 9i) frac k rek( 4d, 5g, 5s, 9i) frac - ------------------------------------- ----- - ------------------------------------- ----- 2 -0.00008763 ryd = -9.6159 cm-1 -0.948 4 0.00000000 ryd = -0.0001 cm-1 -1.000 ag i d10 5g -d9 5s9i 2 -0.0096 5 0.0000 5 23 38 1 0.023 0.016 278.930 sec sqrtdel= 1.0000 1.0000 -0.0096 0.0000 rcn mod 32 ee,eee= -0.38785 -0.21393 slater integrals for ag i d10 5g nconf=23 z= 47 ion= 0 exf=0.650 irel= 1 ag i d9 5p2 nconf=41 kut=-1 corrf=0.000 class 0 k rdk( 4d, 5g, 5p, 5p) frac k rek( 4d, 5g, 5p, 5p) frac - ------------------------------------- ----- - ------------------------------------- ----- 3 -0.00021589 ryd = -23.6917 cm-1 -0.982 3 -0.00021589 ryd = -23.6917 cm-1 -0.982 ag i d10 5g -d9 5p2 1 -0.0237 5 23 41 3 0.078 0.023 279.055 sec sqrtdel= 1.0000 1.0000 -0.0237 rcn mod 32 ee,eee= -1.75379 -0.87690 ee,eee= -1.13103 -1.44241 slater integrals for ag i d10 6g nconf=24 z= 47 ion= 0 exf=0.650 irel= 1 ag i d9 5s5g nconf=28 kut=-1 corrf=0.000 class 0 k rdk( 4d, 4d, 4d, 5s) frac k rek( 4d, 4d, 4d, 5s) frac - ------------------------------------- ----- - ------------------------------------- ----- 2 0.00000000 ryd = 0.0000 cm-1 0.000 2 0.00000000 ryd = 0.0000 cm-1 0.000 ag i d10 6g -d9 5s5g 1 0.0000 5 24 28 28 0.805 0.047 279.922 sec rcn mod 32 ee,eee= -0.02779 -0.01390 ee,eee= -0.04004 -0.03392 slater integrals for ag i d10 6g nconf=24 z= 47 ion= 0 exf=0.650 irel= 1 ag i d9 5s5g nconf=28 kut=-1 corrf=0.000 class 0 k rdk( 4d, 6g, 5s, 5g) frac k rek( 4d, 6g, 5s, 5g) frac - ------------------------------------- ----- - ------------------------------------- ----- 2 -0.00032608 ryd = -35.7827 cm-1 -0.810 4 -0.00000026 ryd = -0.0284 cm-1 -1.000 ag i d10 6g -d9 5s5g 2 -0.0358 5 0.0000 5 24 28 28 1.711 0.031 281.664 sec sqrtdel= 1.0000 1.0000 0.0000 -0.0358 0.0000 rcn mod 32 ee,eee= -1.75379 -0.87690 ee,eee= -1.15548 -1.45463 slater integrals for ag i d10 6g nconf=24 z= 47 ion= 0 exf=0.650 irel= 1 ag i d9 5s6g nconf=29 kut=-1 corrf=0.000 class 0 k rdk( 4d, 4d, 4d, 5s) frac k rek( 4d, 4d, 4d, 5s) frac - ------------------------------------- ----- - ------------------------------------- ----- 2 -0.13771304 ryd = -15112.2589 cm-1 -0.475 2 -0.13771331 ryd = -15112.2880 cm-1 -0.475 ag i d10 6g -d9 5s6g 1 -15.1123 5 24 29 29 0.789 0.039 282.570 sec rcn mod 32 ee,eee= -0.02779 -0.01390 ee,eee= -0.02782 -0.02781 slater integrals for ag i d10 6g nconf=24 z= 47 ion= 0 exf=0.650 irel= 1 ag i d9 5s6g nconf=29 kut=-1 corrf=0.000 class 0 k rdk( 4d, 6g, 5s, 6g) frac k rek( 4d, 6g, 5s, 6g) frac - ------------------------------------- ----- - ------------------------------------- ----- 2 -0.00032575 ryd = -35.7472 cm-1 -0.961 4 -0.00000027 ryd = -0.0299 cm-1 -1.000 ag i d10 6g -d9 5s6g 2 -0.0357 5 0.0000 5 24 29 29 1.109 0.031 283.727 sec sqrtdel= 1.0000 1.0000 -15.1123 -0.0357 0.0000 rcn mod 32 ee,eee= -1.75379 -0.87690 ee,eee= -1.17021 -1.46200 slater integrals for ag i d10 6g nconf=24 z= 47 ion= 0 exf=0.650 irel= 1 ag i d9 5s7g nconf=30 kut=-1 corrf=0.000 class 0 k rdk( 4d, 4d, 4d, 5s) frac k rek( 4d, 4d, 4d, 5s) frac - ------------------------------------- ----- - ------------------------------------- ----- 2 0.00000000 ryd = 0.0000 cm-1 0.000 2 0.00000000 ryd = 0.0000 cm-1 0.000 ag i d10 6g -d9 5s7g 1 0.0000 5 24 30 30 0.992 0.016 284.742 sec rcn mod 32 ee,eee= -0.02779 -0.01390 ee,eee= -0.02044 -0.02412 slater integrals for ag i d10 6g nconf=24 z= 47 ion= 0 exf=0.650 irel= 1 ag i d9 5s7g nconf=30 kut=-1 corrf=0.000 class 0 k rdk( 4d, 6g, 5s, 7g) frac k rek( 4d, 6g, 5s, 7g) frac - ------------------------------------- ----- - ------------------------------------- ----- 2 -0.00022896 ryd = -25.1250 cm-1 -0.893 4 -0.00000025 ryd = -0.0277 cm-1 -1.000 ag i d10 6g -d9 5s7g 2 -0.0251 5 0.0000 5 24 30 30 1.258 0.031 286.031 sec sqrtdel= 1.0000 1.0000 0.0000 -0.0251 0.0000 rcn mod 32 ee,eee= -1.75379 -0.87690 ee,eee= -1.17978 -1.46679 slater integrals for ag i d10 6g nconf=24 z= 47 ion= 0 exf=0.650 irel= 1 ag i d9 5s8g nconf=31 kut=-1 corrf=0.000 class 0 k rdk( 4d, 4d, 4d, 5s) frac k rek( 4d, 4d, 4d, 5s) frac - ------------------------------------- ----- - ------------------------------------- ----- 2 0.00000000 ryd = 0.0000 cm-1 0.000 2 0.00000000 ryd = 0.0000 cm-1 0.000 ag i d10 6g -d9 5s8g 1 0.0000 5 24 31 31 0.836 0.023 286.891 sec rcn mod 32 ee,eee= -0.02779 -0.01390 ee,eee= -0.01565 -0.02172 slater integrals for ag i d10 6g nconf=24 z= 47 ion= 0 exf=0.650 irel= 1 ag i d9 5s8g nconf=31 kut=-1 corrf=0.000 class 0 k rdk( 4d, 6g, 5s, 8g) frac k rek( 4d, 6g, 5s, 8g) frac - ------------------------------------- ----- - ------------------------------------- ----- 2 -0.00017629 ryd = -19.3460 cm-1 -0.863 4 -0.00000023 ryd = -0.0249 cm-1 -1.000 ag i d10 6g -d9 5s8g 2 -0.0193 5 0.0000 5 24 31 31 1.289 0.055 288.234 sec sqrtdel= 1.0000 1.0000 0.0000 -0.0193 0.0000 rcn mod 32 ee,eee= -1.75379 -0.87690 ee,eee= -1.18634 -1.47006 slater integrals for ag i d10 6g nconf=24 z= 47 ion= 0 exf=0.650 irel= 1 ag i d9 5s9g nconf=32 kut=-1 corrf=0.000 class 0 k rdk( 4d, 4d, 4d, 5s) frac k rek( 4d, 4d, 4d, 5s) frac - ------------------------------------- ----- - ------------------------------------- ----- 2 0.00000000 ryd = 0.0000 cm-1 0.000 2 0.00000000 ryd = 0.0000 cm-1 0.000 ag i d10 6g -d9 5s9g 1 0.0000 5 24 32 32 1.375 0.031 289.656 sec rcn mod 32 ee,eee= -0.02779 -0.01390 ee,eee= -0.01236 -0.02008 slater integrals for ag i d10 6g nconf=24 z= 47 ion= 0 exf=0.650 irel= 1 ag i d9 5s9g nconf=32 kut=-1 corrf=0.000 class 0 k rdk( 4d, 6g, 5s, 9g) frac k rek( 4d, 6g, 5s, 9g) frac - ------------------------------------- ----- - ------------------------------------- ----- 2 -0.00014216 ryd = -15.6007 cm-1 -0.843 4 -0.00000020 ryd = -0.0221 cm-1 -1.000 ag i d10 6g -d9 5s9g 2 -0.0156 5 0.0000 5 24 32 32 1.141 0.039 290.836 sec sqrtdel= 1.0000 1.0000 0.0000 -0.0156 0.0000 rcn mod 32 ee,eee= -0.02041 -0.02410 slater integrals for ag i d10 6g nconf=24 z= 47 ion= 0 exf=0.650 irel= 1 ag i d9 5s7i nconf=36 kut=-1 corrf=0.000 class 0 k rdk( 4d, 6g, 5s, 7i) frac k rek( 4d, 6g, 5s, 7i) frac - ------------------------------------- ----- - ------------------------------------- ----- 2 0.00002218 ryd = 2.4341 cm-1 0.274 4 0.00000000 ryd = -0.0001 cm-1 -1.000 ag i d10 6g -d9 5s7i 2 0.0024 5 0.0000 5 24 36 4 0.094 0.031 290.977 sec sqrtdel= 1.0000 1.0000 0.0024 0.0000 rcn mod 32 ee,eee= -0.01563 -0.02171 slater integrals for ag i d10 6g nconf=24 z= 47 ion= 0 exf=0.650 irel= 1 ag i d9 5s8i nconf=37 kut=-1 corrf=0.000 class 0 k rdk( 4d, 6g, 5s, 8i) frac k rek( 4d, 6g, 5s, 8i) frac - ------------------------------------- ----- - ------------------------------------- ----- 2 -0.00000979 ryd = -1.0742 cm-1 -0.151 4 0.00000000 ryd = -0.0001 cm-1 -1.000 ag i d10 6g -d9 5s8i 2 -0.0011 5 0.0000 5 24 37 1 0.023 0.016 291.031 sec sqrtdel= 1.0000 1.0000 -0.0011 0.0000 rcn mod 32 ee,eee= -0.01234 -0.02007 slater integrals for ag i d10 6g nconf=24 z= 47 ion= 0 exf=0.650 irel= 1 ag i d9 5s9i nconf=38 kut=-1 corrf=0.000 class 0 k rdk( 4d, 6g, 5s, 9i) frac k rek( 4d, 6g, 5s, 9i) frac - ------------------------------------- ----- - ------------------------------------- ----- 2 -0.00002126 ryd = -2.3332 cm-1 -0.380 4 0.00000000 ryd = -0.0001 cm-1 -1.000 ag i d10 6g -d9 5s9i 2 -0.0023 5 0.0000 5 24 38 1 0.023 0.109 291.180 sec sqrtdel= 1.0000 1.0000 -0.0023 0.0000 rcn mod 32 ee,eee= -0.38785 -0.20782 slater integrals for ag i d10 6g nconf=24 z= 47 ion= 0 exf=0.650 irel= 1 ag i d9 5p2 nconf=41 kut=-1 corrf=0.000 class 0 k rdk( 4d, 6g, 5p, 5p) frac k rek( 4d, 6g, 5p, 5p) frac - ------------------------------------- ----- - ------------------------------------- ----- 3 -0.00022395 ryd = -24.5756 cm-1 -0.982 3 -0.00022395 ryd = -24.5756 cm-1 -0.982 ag i d10 6g -d9 5p2 1 -0.0246 5 24 41 3 0.109 0.016 291.320 sec sqrtdel= 1.0000 1.0000 -0.0246 rcn mod 32 ee,eee= -1.76853 -0.88427 ee,eee= -1.13103 -1.44978 slater integrals for ag i d10 7g nconf=25 z= 47 ion= 0 exf=0.650 irel= 1 ag i d9 5s5g nconf=28 kut=-1 corrf=0.000 class 0 k rdk( 4d, 4d, 4d, 5s) frac k rek( 4d, 4d, 4d, 5s) frac - ------------------------------------- ----- - ------------------------------------- ----- 2 0.00000000 ryd = 0.0000 cm-1 0.000 2 0.00000000 ryd = 0.0000 cm-1 0.000 ag i d10 7g -d9 5s5g 1 0.0000 5 25 28 28 1.078 0.031 292.461 sec rcn mod 32 ee,eee= -0.02042 -0.01021 ee,eee= -0.04004 -0.03023 slater integrals for ag i d10 7g nconf=25 z= 47 ion= 0 exf=0.650 irel= 1 ag i d9 5s5g nconf=28 kut=-1 corrf=0.000 class 0 k rdk( 4d, 7g, 5s, 5g) frac k rek( 4d, 7g, 5s, 5g) frac - ------------------------------------- ----- - ------------------------------------- ----- 2 -0.00023064 ryd = -25.3099 cm-1 -0.748 4 -0.00000024 ryd = -0.0262 cm-1 -1.000 ag i d10 7g -d9 5s5g 2 -0.0253 5 0.0000 5 25 28 28 0.953 0.063 293.477 sec sqrtdel= 1.0000 1.0000 0.0000 -0.0253 0.0000 rcn mod 32 ee,eee= -1.76853 -0.88427 ee,eee= -1.15548 -1.46200 slater integrals for ag i d10 7g nconf=25 z= 47 ion= 0 exf=0.650 irel= 1 ag i d9 5s6g nconf=29 kut=-1 corrf=0.000 class 0 k rdk( 4d, 4d, 4d, 5s) frac k rek( 4d, 4d, 4d, 5s) frac - ------------------------------------- ----- - ------------------------------------- ----- 2 0.00000000 ryd = 0.0000 cm-1 0.000 2 0.00000000 ryd = 0.0000 cm-1 0.000 ag i d10 7g -d9 5s6g 1 0.0000 5 25 29 29 1.000 0.023 294.500 sec rcn mod 32 ee,eee= -0.02042 -0.01021 ee,eee= -0.02782 -0.02412 slater integrals for ag i d10 7g nconf=25 z= 47 ion= 0 exf=0.650 irel= 1 ag i d9 5s6g nconf=29 kut=-1 corrf=0.000 class 0 k rdk( 4d, 7g, 5s, 6g) frac k rek( 4d, 7g, 5s, 6g) frac - ------------------------------------- ----- - ------------------------------------- ----- 2 -0.00022894 ryd = -25.1234 cm-1 -0.894 4 -0.00000025 ryd = -0.0276 cm-1 -1.000 ag i d10 7g -d9 5s6g 2 -0.0251 5 0.0000 5 25 29 29 1.164 0.023 295.703 sec sqrtdel= 1.0000 1.0000 0.0000 -0.0251 0.0000 rcn mod 32 ee,eee= -1.76853 -0.88427 ee,eee= -1.17021 -1.46937 slater integrals for ag i d10 7g nconf=25 z= 47 ion= 0 exf=0.650 irel= 1 ag i d9 5s7g nconf=30 kut=-1 corrf=0.000 class 0 k rdk( 4d, 4d, 4d, 5s) frac k rek( 4d, 4d, 4d, 5s) frac - ------------------------------------- ----- - ------------------------------------- ----- 2 -0.13771306 ryd = -15112.2604 cm-1 -0.475 2 -0.13771332 ryd = -15112.2894 cm-1 -0.475 ag i d10 7g -d9 5s7g 1 -15.1123 5 25 30 30 0.844 0.039 296.586 sec rcn mod 32 ee,eee= -0.02042 -0.01021 ee,eee= -0.02044 -0.02043 slater integrals for ag i d10 7g nconf=25 z= 47 ion= 0 exf=0.650 irel= 1 ag i d9 5s7g nconf=30 kut=-1 corrf=0.000 class 0 k rdk( 4d, 7g, 5s, 7g) frac k rek( 4d, 7g, 5s, 7g) frac - ------------------------------------- ----- - ------------------------------------- ----- 2 -0.00020520 ryd = -22.5178 cm-1 -0.961 4 -0.00000023 ryd = -0.0256 cm-1 -1.000 ag i d10 7g -d9 5s7g 2 -0.0225 5 0.0000 5 25 30 30 1.609 0.055 298.250 sec sqrtdel= 1.0000 1.0000 -15.1123 -0.0225 0.0000 rcn mod 32 ee,eee= -1.76853 -0.88427 ee,eee= -1.17978 -1.47415 slater integrals for ag i d10 7g nconf=25 z= 47 ion= 0 exf=0.650 irel= 1 ag i d9 5s8g nconf=31 kut=-1 corrf=0.000 class 0 k rdk( 4d, 4d, 4d, 5s) frac k rek( 4d, 4d, 4d, 5s) frac - ------------------------------------- ----- - ------------------------------------- ----- 2 0.00000000 ryd = 0.0000 cm-1 0.000 2 0.00000000 ryd = 0.0000 cm-1 0.000 ag i d10 7g -d9 5s8g 1 0.0000 5 25 31 31 0.859 0.055 299.195 sec rcn mod 32 ee,eee= -0.02042 -0.01021 ee,eee= -0.01565 -0.01803 slater integrals for ag i d10 7g nconf=25 z= 47 ion= 0 exf=0.650 irel= 1 ag i d9 5s8g nconf=31 kut=-1 corrf=0.000 class 0 k rdk( 4d, 7g, 5s, 8g) frac k rek( 4d, 7g, 5s, 8g) frac - ------------------------------------- ----- - ------------------------------------- ----- 2 -0.00015704 ryd = -17.2336 cm-1 -0.923 4 -0.00000021 ryd = -0.0230 cm-1 -1.000 ag i d10 7g -d9 5s8g 2 -0.0172 5 0.0000 5 25 31 31 1.211 0.023 300.430 sec sqrtdel= 1.0000 1.0000 0.0000 -0.0172 0.0000 rcn mod 32 ee,eee= -1.76853 -0.88427 ee,eee= -1.18634 -1.47743 slater integrals for ag i d10 7g nconf=25 z= 47 ion= 0 exf=0.650 irel= 1 ag i d9 5s9g nconf=32 kut=-1 corrf=0.000 class 0 k rdk( 4d, 4d, 4d, 5s) frac k rek( 4d, 4d, 4d, 5s) frac - ------------------------------------- ----- - ------------------------------------- ----- 2 0.00000000 ryd = 0.0000 cm-1 0.000 2 0.00000000 ryd = 0.0000 cm-1 0.000 ag i d10 7g -d9 5s9g 1 0.0000 5 25 32 32 1.023 0.063 301.516 sec rcn mod 32 ee,eee= -0.02042 -0.01021 ee,eee= -0.01236 -0.01639 slater integrals for ag i d10 7g nconf=25 z= 47 ion= 0 exf=0.650 irel= 1 ag i d9 5s9g nconf=32 kut=-1 corrf=0.000 class 0 k rdk( 4d, 7g, 5s, 9g) frac k rek( 4d, 7g, 5s, 9g) frac - ------------------------------------- ----- - ------------------------------------- ----- 2 -0.00012689 ryd = -13.9242 cm-1 -0.906 4 -0.00000019 ryd = -0.0204 cm-1 -1.000 ag i d10 7g -d9 5s9g 2 -0.0139 5 0.0000 5 25 32 32 1.453 0.023 303.000 sec sqrtdel= 1.0000 1.0000 0.0000 -0.0139 0.0000 rcn mod 32 ee,eee= -0.02041 -0.02041 slater integrals for ag i d10 7g nconf=25 z= 47 ion= 0 exf=0.650 irel= 1 ag i d9 5s7i nconf=36 kut=-1 corrf=0.000 class 0 k rdk( 4d, 7g, 5s, 7i) frac k rek( 4d, 7g, 5s, 7i) frac - ------------------------------------- ----- - ------------------------------------- ----- 2 0.00000000 ryd = 0.0000 cm-1 0.000 4 0.00000000 ryd = -0.0001 cm-1 -1.000 ag i d10 7g -d9 5s7i 2 0.0000 5 0.0000 5 25 36 4 0.102 0.086 303.211 sec sqrtdel= 1.0000 1.0000 0.0000 0.0000 rcn mod 32 ee,eee= -0.01563 -0.01802 slater integrals for ag i d10 7g nconf=25 z= 47 ion= 0 exf=0.650 irel= 1 ag i d9 5s8i nconf=37 kut=-1 corrf=0.000 class 0 k rdk( 4d, 7g, 5s, 8i) frac k rek( 4d, 7g, 5s, 8i) frac - ------------------------------------- ----- - ------------------------------------- ----- 2 0.00001171 ryd = 1.2851 cm-1 0.221 4 0.00000000 ryd = -0.0001 cm-1 -1.000 ag i d10 7g -d9 5s8i 2 0.0013 5 0.0000 5 25 37 1 0.063 0.016 303.313 sec sqrtdel= 1.0000 1.0000 0.0013 0.0000 rcn mod 32 ee,eee= -0.01234 -0.01638 slater integrals for ag i d10 7g nconf=25 z= 47 ion= 0 exf=0.650 irel= 1 ag i d9 5s9i nconf=38 kut=-1 corrf=0.000 class 0 k rdk( 4d, 7g, 5s, 9i) frac k rek( 4d, 7g, 5s, 9i) frac - ------------------------------------- ----- - ------------------------------------- ----- 2 0.00000269 ryd = 0.2948 cm-1 0.059 4 0.00000000 ryd = -0.0001 cm-1 -1.000 ag i d10 7g -d9 5s9i 2 0.0003 5 0.0000 5 25 38 1 0.031 0.031 303.383 sec sqrtdel= 1.0000 1.0000 0.0003 0.0000 rcn mod 32 ee,eee= -0.38785 -0.20413 slater integrals for ag i d10 7g nconf=25 z= 47 ion= 0 exf=0.650 irel= 1 ag i d9 5p2 nconf=41 kut=-1 corrf=0.000 class 0 k rdk( 4d, 7g, 5p, 5p) frac k rek( 4d, 7g, 5p, 5p) frac - ------------------------------------- ----- - ------------------------------------- ----- 3 -0.00020582 ryd = -22.5864 cm-1 -0.982 3 -0.00020582 ryd = -22.5864 cm-1 -0.982 ag i d10 7g -d9 5p2 1 -0.0226 5 25 41 3 0.070 0.039 303.500 sec sqrtdel= 1.0000 1.0000 -0.0226 rcn mod 32 ee,eee= -1.77810 -0.88905 ee,eee= -1.13103 -1.45457 slater integrals for ag i d10 8g nconf=26 z= 47 ion= 0 exf=0.650 irel= 1 ag i d9 5s5g nconf=28 kut=-1 corrf=0.000 class 0 k rdk( 4d, 4d, 4d, 5s) frac k rek( 4d, 4d, 4d, 5s) frac - ------------------------------------- ----- - ------------------------------------- ----- 2 0.00000000 ryd = 0.0000 cm-1 0.000 2 0.00000000 ryd = 0.0000 cm-1 0.000 ag i d10 8g -d9 5s5g 1 0.0000 5 26 28 28 0.750 0.031 304.297 sec rcn mod 32 ee,eee= -0.01563 -0.00782 ee,eee= -0.04004 -0.02784 slater integrals for ag i d10 8g nconf=26 z= 47 ion= 0 exf=0.650 irel= 1 ag i d9 5s5g nconf=28 kut=-1 corrf=0.000 class 0 k rdk( 4d, 8g, 5s, 5g) frac k rek( 4d, 8g, 5s, 5g) frac - ------------------------------------- ----- - ------------------------------------- ----- 2 -0.00017683 ryd = -19.4054 cm-1 -0.714 4 -0.00000021 ryd = -0.0234 cm-1 -1.000 ag i d10 8g -d9 5s5g 2 -0.0194 5 0.0000 5 26 28 28 1.383 0.023 305.703 sec sqrtdel= 1.0000 1.0000 0.0000 -0.0194 0.0000 rcn mod 32 ee,eee= -1.77810 -0.88905 ee,eee= -1.15548 -1.46679 slater integrals for ag i d10 8g nconf=26 z= 47 ion= 0 exf=0.650 irel= 1 ag i d9 5s6g nconf=29 kut=-1 corrf=0.000 class 0 k rdk( 4d, 4d, 4d, 5s) frac k rek( 4d, 4d, 4d, 5s) frac - ------------------------------------- ----- - ------------------------------------- ----- 2 0.00000000 ryd = 0.0000 cm-1 0.000 2 0.00000000 ryd = 0.0000 cm-1 0.000 ag i d10 8g -d9 5s6g 1 0.0000 5 26 29 29 1.273 0.039 307.023 sec rcn mod 32 ee,eee= -0.01563 -0.00782 ee,eee= -0.02782 -0.02173 slater integrals for ag i d10 8g nconf=26 z= 47 ion= 0 exf=0.650 irel= 1 ag i d9 5s6g nconf=29 kut=-1 corrf=0.000 class 0 k rdk( 4d, 8g, 5s, 6g) frac k rek( 4d, 8g, 5s, 6g) frac - ------------------------------------- ----- - ------------------------------------- ----- 2 -0.00017627 ryd = -19.3432 cm-1 -0.863 4 -0.00000022 ryd = -0.0246 cm-1 -1.000 ag i d10 8g -d9 5s6g 2 -0.0193 5 0.0000 5 26 29 29 0.813 0.031 307.867 sec sqrtdel= 1.0000 1.0000 0.0000 -0.0193 0.0000 rcn mod 32 ee,eee= -1.77810 -0.88905 ee,eee= -1.17021 -1.47416 slater integrals for ag i d10 8g nconf=26 z= 47 ion= 0 exf=0.650 irel= 1 ag i d9 5s7g nconf=30 kut=-1 corrf=0.000 class 0 k rdk( 4d, 4d, 4d, 5s) frac k rek( 4d, 4d, 4d, 5s) frac - ------------------------------------- ----- - ------------------------------------- ----- 2 0.00000000 ryd = 0.0000 cm-1 0.000 2 0.00000000 ryd = 0.0000 cm-1 0.000 ag i d10 8g -d9 5s7g 1 0.0000 5 26 30 30 0.875 0.094 308.844 sec rcn mod 32 ee,eee= -0.01563 -0.00782 ee,eee= -0.02044 -0.01804 slater integrals for ag i d10 8g nconf=26 z= 47 ion= 0 exf=0.650 irel= 1 ag i d9 5s7g nconf=30 kut=-1 corrf=0.000 class 0 k rdk( 4d, 8g, 5s, 7g) frac k rek( 4d, 8g, 5s, 7g) frac - ------------------------------------- ----- - ------------------------------------- ----- 2 -0.00015704 ryd = -17.2326 cm-1 -0.924 4 -0.00000021 ryd = -0.0229 cm-1 -1.000 ag i d10 8g -d9 5s7g 2 -0.0172 5 0.0000 5 26 30 30 1.492 0.047 310.391 sec sqrtdel= 1.0000 1.0000 0.0000 -0.0172 0.0000 rcn mod 32 ee,eee= -1.77810 -0.88905 ee,eee= -1.17978 -1.47894 slater integrals for ag i d10 8g nconf=26 z= 47 ion= 0 exf=0.650 irel= 1 ag i d9 5s8g nconf=31 kut=-1 corrf=0.000 class 0 k rdk( 4d, 4d, 4d, 5s) frac k rek( 4d, 4d, 4d, 5s) frac - ------------------------------------- ----- - ------------------------------------- ----- 2 -0.13771307 ryd = -15112.2619 cm-1 -0.475 2 -0.13771334 ryd = -15112.2910 cm-1 -0.475 ag i d10 8g -d9 5s8g 1 -15.1123 5 26 31 31 0.859 0.031 311.281 sec rcn mod 32 ee,eee= -0.01563 -0.00782 ee,eee= -0.01565 -0.01564 slater integrals for ag i d10 8g nconf=26 z= 47 ion= 0 exf=0.650 irel= 1 ag i d9 5s8g nconf=31 kut=-1 corrf=0.000 class 0 k rdk( 4d, 8g, 5s, 8g) frac k rek( 4d, 8g, 5s, 8g) frac - ------------------------------------- ----- - ------------------------------------- ----- 2 -0.00013751 ryd = -15.0895 cm-1 -0.961 4 -0.00000019 ryd = -0.0205 cm-1 -1.000 ag i d10 8g -d9 5s8g 2 -0.0151 5 0.0000 5 26 31 31 1.234 0.016 312.531 sec sqrtdel= 1.0000 1.0000 -15.1123 -0.0151 0.0000 rcn mod 32 ee,eee= -1.77810 -0.88905 ee,eee= -1.18634 -1.48222 slater integrals for ag i d10 8g nconf=26 z= 47 ion= 0 exf=0.650 irel= 1 ag i d9 5s9g nconf=32 kut=-1 corrf=0.000 class 0 k rdk( 4d, 4d, 4d, 5s) frac k rek( 4d, 4d, 4d, 5s) frac - ------------------------------------- ----- - ------------------------------------- ----- 2 0.00000000 ryd = 0.0000 cm-1 0.000 2 0.00000000 ryd = 0.0000 cm-1 0.000 ag i d10 8g -d9 5s9g 1 0.0000 5 26 32 32 1.195 0.031 313.773 sec rcn mod 32 ee,eee= -0.01563 -0.00782 ee,eee= -0.01236 -0.01400 slater integrals for ag i d10 8g nconf=26 z= 47 ion= 0 exf=0.650 irel= 1 ag i d9 5s9g nconf=32 kut=-1 corrf=0.000 class 0 k rdk( 4d, 8g, 5s, 9g) frac k rek( 4d, 8g, 5s, 9g) frac - ------------------------------------- ----- - ------------------------------------- ----- 2 -0.00011054 ryd = -12.1301 cm-1 -0.938 4 -0.00000017 ryd = -0.0183 cm-1 -1.000 ag i d10 8g -d9 5s9g 2 -0.0121 5 0.0000 5 26 32 32 1.344 0.047 315.164 sec sqrtdel= 1.0000 1.0000 0.0000 -0.0121 0.0000 rcn mod 32 ee,eee= -0.02041 -0.01802 slater integrals for ag i d10 8g nconf=26 z= 47 ion= 0 exf=0.650 irel= 1 ag i d9 5s7i nconf=36 kut=-1 corrf=0.000 class 0 k rdk( 4d, 8g, 5s, 7i) frac k rek( 4d, 8g, 5s, 7i) frac - ------------------------------------- ----- - ------------------------------------- ----- 2 -0.00000030 ryd = -0.0332 cm-1 -0.007 4 0.00000000 ryd = -0.0001 cm-1 -1.000 ag i d10 8g -d9 5s7i 2 0.0000 5 0.0000 5 26 36 4 0.094 0.047 315.320 sec sqrtdel= 1.0000 1.0000 0.0000 0.0000 rcn mod 32 ee,eee= -0.01563 -0.01563 slater integrals for ag i d10 8g nconf=26 z= 47 ion= 0 exf=0.650 irel= 1 ag i d9 5s8i nconf=37 kut=-1 corrf=0.000 class 0 k rdk( 4d, 8g, 5s, 8i) frac k rek( 4d, 8g, 5s, 8i) frac - ------------------------------------- ----- - ------------------------------------- ----- 2 0.00000000 ryd = 0.0000 cm-1 0.000 4 0.00000000 ryd = -0.0001 cm-1 -1.000 ag i d10 8g -d9 5s8i 2 0.0000 5 0.0000 5 26 37 1 0.031 0.023 315.375 sec sqrtdel= 1.0000 1.0000 0.0000 0.0000 rcn mod 32 ee,eee= -0.01234 -0.01399 slater integrals for ag i d10 8g nconf=26 z= 47 ion= 0 exf=0.650 irel= 1 ag i d9 5s9i nconf=38 kut=-1 corrf=0.000 class 0 k rdk( 4d, 8g, 5s, 9i) frac k rek( 4d, 8g, 5s, 9i) frac - ------------------------------------- ----- - ------------------------------------- ----- 2 0.00000612 ryd = 0.6714 cm-1 0.169 4 0.00000000 ryd = -0.0001 cm-1 -1.000 ag i d10 8g -d9 5s9i 2 0.0007 5 0.0000 5 26 38 1 0.023 0.039 315.445 sec sqrtdel= 1.0000 1.0000 0.0007 0.0000 rcn mod 32 ee,eee= -0.38785 -0.20174 slater integrals for ag i d10 8g nconf=26 z= 47 ion= 0 exf=0.650 irel= 1 ag i d9 5p2 nconf=41 kut=-1 corrf=0.000 class 0 k rdk( 4d, 8g, 5p, 5p) frac k rek( 4d, 8g, 5p, 5p) frac - ------------------------------------- ----- - ------------------------------------- ----- 3 -0.00018341 ryd = -20.1272 cm-1 -0.982 3 -0.00018341 ryd = -20.1272 cm-1 -0.982 ag i d10 8g -d9 5p2 1 -0.0201 5 26 41 3 0.070 0.016 315.547 sec sqrtdel= 1.0000 1.0000 -0.0201 rcn mod 32 ee,eee= -1.78466 -0.89233 ee,eee= -1.13103 -1.45785 slater integrals for ag i d10 9g nconf=27 z= 47 ion= 0 exf=0.650 irel= 1 ag i d9 5s5g nconf=28 kut=-1 corrf=0.000 class 0 k rdk( 4d, 4d, 4d, 5s) frac k rek( 4d, 4d, 4d, 5s) frac - ------------------------------------- ----- - ------------------------------------- ----- 2 0.00000000 ryd = 0.0000 cm-1 0.000 2 0.00000000 ryd = 0.0000 cm-1 0.000 ag i d10 9g -d9 5s5g 1 0.0000 5 27 28 28 1.219 0.055 316.820 sec rcn mod 32 ee,eee= -0.01235 -0.00617 ee,eee= -0.04004 -0.02620 slater integrals for ag i d10 9g nconf=27 z= 47 ion= 0 exf=0.650 irel= 1 ag i d9 5s5g nconf=28 kut=-1 corrf=0.000 class 0 k rdk( 4d, 9g, 5s, 5g) frac k rek( 4d, 9g, 5s, 5g) frac - ------------------------------------- ----- - ------------------------------------- ----- 2 -0.00014215 ryd = -15.5994 cm-1 -0.693 4 -0.00000019 ryd = -0.0207 cm-1 -1.000 ag i d10 9g -d9 5s5g 2 -0.0156 5 0.0000 5 27 28 28 1.055 0.031 317.906 sec sqrtdel= 1.0000 1.0000 0.0000 -0.0156 0.0000 rcn mod 32 ee,eee= -1.78466 -0.89233 ee,eee= -1.15548 -1.47007 slater integrals for ag i d10 9g nconf=27 z= 47 ion= 0 exf=0.650 irel= 1 ag i d9 5s6g nconf=29 kut=-1 corrf=0.000 class 0 k rdk( 4d, 4d, 4d, 5s) frac k rek( 4d, 4d, 4d, 5s) frac - ------------------------------------- ----- - ------------------------------------- ----- 2 0.00000000 ryd = 0.0000 cm-1 0.000 2 0.00000000 ryd = 0.0000 cm-1 0.000 ag i d10 9g -d9 5s6g 1 0.0000 5 27 29 29 1.102 0.023 319.047 sec rcn mod 32 ee,eee= -0.01235 -0.00617 ee,eee= -0.02782 -0.02008 slater integrals for ag i d10 9g nconf=27 z= 47 ion= 0 exf=0.650 irel= 1 ag i d9 5s6g nconf=29 kut=-1 corrf=0.000 class 0 k rdk( 4d, 9g, 5s, 6g) frac k rek( 4d, 9g, 5s, 6g) frac - ------------------------------------- ----- - ------------------------------------- ----- 2 -0.00014213 ryd = -15.5971 cm-1 -0.843 4 -0.00000020 ryd = -0.0218 cm-1 -1.000 ag i d10 9g -d9 5s6g 2 -0.0156 5 0.0000 5 27 29 29 0.805 0.055 319.906 sec sqrtdel= 1.0000 1.0000 0.0000 -0.0156 0.0000 rcn mod 32 ee,eee= -1.78466 -0.89233 ee,eee= -1.17021 -1.47744 slater integrals for ag i d10 9g nconf=27 z= 47 ion= 0 exf=0.650 irel= 1 ag i d9 5s7g nconf=30 kut=-1 corrf=0.000 class 0 k rdk( 4d, 4d, 4d, 5s) frac k rek( 4d, 4d, 4d, 5s) frac - ------------------------------------- ----- - ------------------------------------- ----- 2 0.00000000 ryd = 0.0000 cm-1 0.000 2 0.00000000 ryd = 0.0000 cm-1 0.000 ag i d10 9g -d9 5s7g 1 0.0000 5 27 30 30 0.930 0.023 320.867 sec rcn mod 32 ee,eee= -0.01235 -0.00617 ee,eee= -0.02044 -0.01639 slater integrals for ag i d10 9g nconf=27 z= 47 ion= 0 exf=0.650 irel= 1 ag i d9 5s7g nconf=30 kut=-1 corrf=0.000 class 0 k rdk( 4d, 9g, 5s, 7g) frac k rek( 4d, 9g, 5s, 7g) frac - ------------------------------------- ----- - ------------------------------------- ----- 2 -0.00012687 ryd = -13.9224 cm-1 -0.906 4 -0.00000018 ryd = -0.0203 cm-1 -1.000 ag i d10 9g -d9 5s7g 2 -0.0139 5 0.0000 5 27 30 30 1.547 0.039 322.453 sec sqrtdel= 1.0000 1.0000 0.0000 -0.0139 0.0000 rcn mod 32 ee,eee= -1.78466 -0.89233 ee,eee= -1.17978 -1.48222 slater integrals for ag i d10 9g nconf=27 z= 47 ion= 0 exf=0.650 irel= 1 ag i d9 5s8g nconf=31 kut=-1 corrf=0.000 class 0 k rdk( 4d, 4d, 4d, 5s) frac k rek( 4d, 4d, 4d, 5s) frac - ------------------------------------- ----- - ------------------------------------- ----- 2 0.00000000 ryd = 0.0000 cm-1 0.000 2 0.00000000 ryd = 0.0000 cm-1 0.000 ag i d10 9g -d9 5s8g 1 0.0000 5 27 31 31 1.383 0.031 323.867 sec rcn mod 32 ee,eee= -0.01235 -0.00617 ee,eee= -0.01565 -0.01400 slater integrals for ag i d10 9g nconf=27 z= 47 ion= 0 exf=0.650 irel= 1 ag i d9 5s8g nconf=31 kut=-1 corrf=0.000 class 0 k rdk( 4d, 9g, 5s, 8g) frac k rek( 4d, 9g, 5s, 8g) frac - ------------------------------------- ----- - ------------------------------------- ----- 2 -0.00011053 ryd = -12.1294 cm-1 -0.938 4 -0.00000017 ryd = -0.0182 cm-1 -1.000 ag i d10 9g -d9 5s8g 2 -0.0121 5 0.0000 5 27 31 31 0.828 0.031 324.727 sec sqrtdel= 1.0000 1.0000 0.0000 -0.0121 0.0000 rcn mod 32 ee,eee= -1.78466 -0.89233 ee,eee= -1.18634 -1.48550 slater integrals for ag i d10 9g nconf=27 z= 47 ion= 0 exf=0.650 irel= 1 ag i d9 5s9g nconf=32 kut=-1 corrf=0.000 class 0 k rdk( 4d, 4d, 4d, 5s) frac k rek( 4d, 4d, 4d, 5s) frac - ------------------------------------- ----- - ------------------------------------- ----- 2 -0.13771308 ryd = -15112.2628 cm-1 -0.475 2 -0.13771334 ryd = -15112.2919 cm-1 -0.475 ag i d10 9g -d9 5s9g 1 -15.1123 5 27 32 32 1.047 0.180 325.961 sec rcn mod 32 ee,eee= -0.01235 -0.00617 ee,eee= -0.01236 -0.01235 slater integrals for ag i d10 9g nconf=27 z= 47 ion= 0 exf=0.650 irel= 1 ag i d9 5s9g nconf=32 kut=-1 corrf=0.000 class 0 k rdk( 4d, 9g, 5s, 9g) frac k rek( 4d, 9g, 5s, 9g) frac - ------------------------------------- ----- - ------------------------------------- ----- 2 -0.00009660 ryd = -10.6007 cm-1 -0.961 4 -0.00000015 ryd = -0.0162 cm-1 -1.000 ag i d10 9g -d9 5s9g 2 -0.0106 5 0.0000 5 27 32 32 1.117 0.039 327.133 sec sqrtdel= 1.0000 1.0000 -15.1123 -0.0106 0.0000 rcn mod 32 ee,eee= -0.02041 -0.01638 slater integrals for ag i d10 9g nconf=27 z= 47 ion= 0 exf=0.650 irel= 1 ag i d9 5s7i nconf=36 kut=-1 corrf=0.000 class 0 k rdk( 4d, 9g, 5s, 7i) frac k rek( 4d, 9g, 5s, 7i) frac - ------------------------------------- ----- - ------------------------------------- ----- 2 -0.00000038 ryd = -0.0414 cm-1 -0.011 4 0.00000000 ryd = -0.0001 cm-1 -1.000 ag i d10 9g -d9 5s7i 2 0.0000 5 0.0000 5 27 36 4 0.102 0.023 327.266 sec sqrtdel= 1.0000 1.0000 0.0000 0.0000 rcn mod 32 ee,eee= -0.01563 -0.01399 slater integrals for ag i d10 9g nconf=27 z= 47 ion= 0 exf=0.650 irel= 1 ag i d9 5s8i nconf=37 kut=-1 corrf=0.000 class 0 k rdk( 4d, 9g, 5s, 8i) frac k rek( 4d, 9g, 5s, 8i) frac - ------------------------------------- ----- - ------------------------------------- ----- 2 -0.00000025 ryd = -0.0275 cm-1 -0.008 4 0.00000000 ryd = -0.0001 cm-1 -1.000 ag i d10 9g -d9 5s8i 2 0.0000 5 0.0000 5 27 37 1 0.023 0.078 327.414 sec sqrtdel= 1.0000 1.0000 0.0000 0.0000 rcn mod 32 ee,eee= -0.01234 -0.01235 slater integrals for ag i d10 9g nconf=27 z= 47 ion= 0 exf=0.650 irel= 1 ag i d9 5s9i nconf=38 kut=-1 corrf=0.000 class 0 k rdk( 4d, 9g, 5s, 9i) frac k rek( 4d, 9g, 5s, 9i) frac - ------------------------------------- ----- - ------------------------------------- ----- 2 0.00000000 ryd = 0.0000 cm-1 0.000 4 0.00000000 ryd = -0.0001 cm-1 -1.000 ag i d10 9g -d9 5s9i 2 0.0000 5 0.0000 5 27 38 1 0.023 0.039 327.484 sec sqrtdel= 1.0000 1.0000 0.0000 0.0000 rcn mod 32 ee,eee= -0.38785 -0.20010 slater integrals for ag i d10 9g nconf=27 z= 47 ion= 0 exf=0.650 irel= 1 ag i d9 5p2 nconf=41 kut=-1 corrf=0.000 class 0 k rdk( 4d, 9g, 5p, 5p) frac k rek( 4d, 9g, 5p, 5p) frac - ------------------------------------- ----- - ------------------------------------- ----- 3 -0.00016235 ryd = -17.8161 cm-1 -0.982 3 -0.00016235 ryd = -17.8161 cm-1 -0.982 ag i d10 9g -d9 5p2 1 -0.0178 5 27 41 3 0.070 0.023 327.586 sec sqrtdel= 1.0000 1.0000 -0.0178 rcn mod 32 ee,eee= -0.04004 -0.02002 ee,eee= -0.02782 -0.03393 slater integrals for ag i d9 5s5g nconf=28 z= 47 ion= 0 exf=0.650 irel= 1 ag i d9 5s6g nconf=29 kut=-1 corrf=0.000 class 11 k rdk( 4d, 5g, 4d, 6g) frac k rek( 4d, 5g, 4d, 6g) frac - ------------------------------------- ----- - ------------------------------------- ----- 0 0.01838798 ryd = 2017.8475 cm-1 0.369 2 0.00000004 ryd = 0.0046 cm-1 1.000 2 0.00022362 ryd = 24.5394 cm-1 0.842 4 0.00000003 ryd = 0.0029 cm-1 1.000 4 0.00000502 ryd = 0.5512 cm-1 0.977 6 0.00000002 ryd = 0.0021 cm-1 1.000 - ------------------------------------- ----- - ------------------------------------- ----- 0 0.01838798 ryd = 2017.8475 cm-1 0.369 2 0.00000004 ryd = 0.0046 cm-1 1.000 2 0.00022362 ryd = 24.5394 cm-1 0.842 4 0.00000003 ryd = 0.0029 cm-1 1.000 4 0.00000502 ryd = 0.5512 cm-1 0.977 6 0.00000002 ryd = 0.0021 cm-1 1.000 - ------------------------------------- ----- - ------------------------------------- ----- 0 0.01838798 ryd = 2017.8475 cm-1 0.369 2 0.00000004 ryd = 0.0046 cm-1 1.000 2 0.00022362 ryd = 24.5394 cm-1 0.842 4 0.00000003 ryd = 0.0029 cm-1 1.000 4 0.00000502 ryd = 0.5512 cm-1 0.977 6 0.00000002 ryd = 0.0021 cm-1 1.000 - ------------------------------------- ----- - ------------------------------------- ----- 0 0.01838798 ryd = 2017.8475 cm-1 0.369 2 0.00000004 ryd = 0.0046 cm-1 1.000 2 0.00022362 ryd = 24.5394 cm-1 0.842 4 0.00000003 ryd = 0.0029 cm-1 1.000 4 0.00000502 ryd = 0.5512 cm-1 0.977 6 0.00000002 ryd = 0.0021 cm-1 1.000 9.00000 0.00000 2.00000 2.00000 4.00000 0.00000 -0.03393 0.00000 9.00000 0.00000 2.00000 4.00000 4.00000 0.00000 -0.03393 0.00000 9.00000 0.00000 2.00000 6.00000 4.00000 0.00000 -0.03393 0.00000 ag i d9 5s5g -d9 5s6g 6 0.0000 5 0.0245 5 0.0006 5 0.0000 5 0.0000 5 0.0000 5 28 29 29 1.070 0.109 328.773 sec rcn mod 32 ee,eee= -0.04004 -0.02002 ee,eee= -0.02782 -0.03393 slater integrals for ag i d9 5s5g nconf=28 z= 47 ion= 0 exf=0.650 irel= 1 ag i d9 5s6g nconf=29 kut=-1 corrf=0.000 class 11 k rdk( 5s, 5g, 5s, 6g) frac k rek( 5s, 5g, 5s, 6g) frac - ------------------------------------- ----- - ------------------------------------- ----- 0 0.01838791 ryd = 2017.8401 cm-1 0.369 4 0.00000177 ryd = 0.1945 cm-1 1.000 - ------------------------------------- ----- - ------------------------------------- ----- 0 0.01838791 ryd = 2017.8401 cm-1 0.369 4 0.00000177 ryd = 0.1945 cm-1 1.000 - ------------------------------------- ----- - ------------------------------------- ----- 0 0.01838791 ryd = 2017.8401 cm-1 0.369 4 0.00000177 ryd = 0.1945 cm-1 1.000 - ------------------------------------- ----- - ------------------------------------- ----- 0 0.01838791 ryd = 2017.8401 cm-1 0.369 4 0.00000177 ryd = 0.1945 cm-1 1.000 1.00000 0.00000 0.00000 4.00000 4.00000 0.00000 -0.03393 0.00000 ag i d9 5s5g -d9 5s6g 2 0.0000 5 0.0002 5 28 29 29 1.148 0.141 330.070 sec sqrtdel= 1.0000 1.0000 0.0000 0.0245 0.0006 0.0000 0.0000 0.0000 0.0000 0.0002 rcn mod 32 ee,eee= -0.04004 -0.02002 ee,eee= -0.02044 -0.03024 slater integrals for ag i d9 5s5g nconf=28 z= 47 ion= 0 exf=0.650 irel= 1 ag i d9 5s7g nconf=30 kut=-1 corrf=0.000 class 11 k rdk( 4d, 5g, 4d, 7g) frac k rek( 4d, 5g, 4d, 7g) frac - ------------------------------------- ----- - ------------------------------------- ----- 0 0.01022607 ryd = 1122.1819 cm-1 0.285 2 0.00000004 ryd = 0.0043 cm-1 1.000 2 0.00015820 ryd = 17.3604 cm-1 0.778 4 0.00000003 ryd = 0.0028 cm-1 1.000 4 0.00000408 ryd = 0.4478 cm-1 0.961 6 0.00000002 ryd = 0.0020 cm-1 1.000 - ------------------------------------- ----- - ------------------------------------- ----- 0 0.01022607 ryd = 1122.1819 cm-1 0.285 2 0.00000004 ryd = 0.0043 cm-1 1.000 2 0.00015820 ryd = 17.3604 cm-1 0.778 4 0.00000003 ryd = 0.0028 cm-1 1.000 4 0.00000408 ryd = 0.4478 cm-1 0.961 6 0.00000002 ryd = 0.0020 cm-1 1.000 - ------------------------------------- ----- - ------------------------------------- ----- 0 0.01022607 ryd = 1122.1819 cm-1 0.285 2 0.00000004 ryd = 0.0043 cm-1 1.000 2 0.00015820 ryd = 17.3604 cm-1 0.778 4 0.00000003 ryd = 0.0028 cm-1 1.000 4 0.00000408 ryd = 0.4478 cm-1 0.961 6 0.00000002 ryd = 0.0020 cm-1 1.000 - ------------------------------------- ----- - ------------------------------------- ----- 0 0.01022607 ryd = 1122.1819 cm-1 0.285 2 0.00000004 ryd = 0.0043 cm-1 1.000 2 0.00015820 ryd = 17.3604 cm-1 0.778 4 0.00000003 ryd = 0.0028 cm-1 1.000 4 0.00000408 ryd = 0.4478 cm-1 0.961 6 0.00000002 ryd = 0.0020 cm-1 1.000 9.00000 0.00000 2.00000 2.00000 4.00000 0.00000 -0.03024 0.00000 9.00000 0.00000 2.00000 4.00000 4.00000 0.00000 -0.03024 0.00000 9.00000 0.00000 2.00000 6.00000 4.00000 0.00000 -0.03024 0.00000 ag i d9 5s5g -d9 5s7g 6 0.0000 5 0.0174 5 0.0004 5 0.0000 5 0.0000 5 0.0000 5 28 30 30 1.375 0.203 331.695 sec rcn mod 32 ee,eee= -0.04004 -0.02002 ee,eee= -0.02044 -0.03024 slater integrals for ag i d9 5s5g nconf=28 z= 47 ion= 0 exf=0.650 irel= 1 ag i d9 5s7g nconf=30 kut=-1 corrf=0.000 class 11 k rdk( 5s, 5g, 5s, 7g) frac k rek( 5s, 5g, 5s, 7g) frac - ------------------------------------- ----- - ------------------------------------- ----- 0 0.01022601 ryd = 1122.1751 cm-1 0.285 4 0.00000163 ryd = 0.1794 cm-1 1.000 - ------------------------------------- ----- - ------------------------------------- ----- 0 0.01022601 ryd = 1122.1751 cm-1 0.285 4 0.00000163 ryd = 0.1794 cm-1 1.000 - ------------------------------------- ----- - ------------------------------------- ----- 0 0.01022601 ryd = 1122.1751 cm-1 0.285 4 0.00000163 ryd = 0.1794 cm-1 1.000 - ------------------------------------- ----- - ------------------------------------- ----- 0 0.01022601 ryd = 1122.1751 cm-1 0.285 4 0.00000163 ryd = 0.1794 cm-1 1.000 1.00000 0.00000 0.00000 4.00000 4.00000 0.00000 -0.03024 0.00000 ag i d9 5s5g -d9 5s7g 2 0.0000 5 0.0002 5 28 30 30 0.938 0.070 332.711 sec sqrtdel= 1.0000 1.0000 0.0000 0.0174 0.0004 0.0000 0.0000 0.0000 0.0000 0.0002 rcn mod 32 ee,eee= -0.04004 -0.02002 ee,eee= -0.01565 -0.02785 slater integrals for ag i d9 5s5g nconf=28 z= 47 ion= 0 exf=0.650 irel= 1 ag i d9 5s8g nconf=31 kut=-1 corrf=0.000 class 11 k rdk( 4d, 5g, 4d, 8g) frac k rek( 4d, 5g, 4d, 8g) frac - ------------------------------------- ----- - ------------------------------------- ----- 0 0.00693289 ryd = 760.7970 cm-1 0.247 2 0.00000004 ryd = 0.0039 cm-1 1.000 2 0.00012131 ryd = 13.3125 cm-1 0.743 4 0.00000002 ryd = 0.0025 cm-1 1.000 4 0.00000338 ryd = 0.3707 cm-1 0.952 6 0.00000002 ryd = 0.0018 cm-1 1.000 - ------------------------------------- ----- - ------------------------------------- ----- 0 0.00693289 ryd = 760.7970 cm-1 0.247 2 0.00000004 ryd = 0.0039 cm-1 1.000 2 0.00012131 ryd = 13.3125 cm-1 0.743 4 0.00000002 ryd = 0.0025 cm-1 1.000 4 0.00000338 ryd = 0.3707 cm-1 0.952 6 0.00000002 ryd = 0.0018 cm-1 1.000 - ------------------------------------- ----- - ------------------------------------- ----- 0 0.00693289 ryd = 760.7970 cm-1 0.247 2 0.00000004 ryd = 0.0039 cm-1 1.000 2 0.00012131 ryd = 13.3125 cm-1 0.743 4 0.00000002 ryd = 0.0025 cm-1 1.000 4 0.00000338 ryd = 0.3707 cm-1 0.952 6 0.00000002 ryd = 0.0018 cm-1 1.000 - ------------------------------------- ----- - ------------------------------------- ----- 0 0.00693289 ryd = 760.7970 cm-1 0.247 2 0.00000004 ryd = 0.0039 cm-1 1.000 2 0.00012131 ryd = 13.3125 cm-1 0.743 4 0.00000002 ryd = 0.0025 cm-1 1.000 4 0.00000338 ryd = 0.3707 cm-1 0.952 6 0.00000002 ryd = 0.0018 cm-1 1.000 9.00000 0.00000 2.00000 2.00000 4.00000 0.00000 -0.02785 0.00000 9.00000 0.00000 2.00000 4.00000 4.00000 0.00000 -0.02785 0.00000 9.00000 0.00000 2.00000 6.00000 4.00000 0.00000 -0.02785 0.00000 ag i d9 5s5g -d9 5s8g 6 0.0000 5 0.0133 5 0.0004 5 0.0000 5 0.0000 5 0.0000 5 28 31 31 1.266 0.172 334.164 sec rcn mod 32 ee,eee= -0.04004 -0.02002 ee,eee= -0.01565 -0.02785 slater integrals for ag i d9 5s5g nconf=28 z= 47 ion= 0 exf=0.650 irel= 1 ag i d9 5s8g nconf=31 kut=-1 corrf=0.000 class 11 k rdk( 5s, 5g, 5s, 8g) frac k rek( 5s, 5g, 5s, 8g) frac - ------------------------------------- ----- - ------------------------------------- ----- 0 0.00693284 ryd = 760.7909 cm-1 0.247 4 0.00000146 ryd = 0.1603 cm-1 1.000 - ------------------------------------- ----- - ------------------------------------- ----- 0 0.00693284 ryd = 760.7909 cm-1 0.247 4 0.00000146 ryd = 0.1603 cm-1 1.000 - ------------------------------------- ----- - ------------------------------------- ----- 0 0.00693284 ryd = 760.7909 cm-1 0.247 4 0.00000146 ryd = 0.1603 cm-1 1.000 - ------------------------------------- ----- - ------------------------------------- ----- 0 0.00693284 ryd = 760.7909 cm-1 0.247 4 0.00000146 ryd = 0.1603 cm-1 1.000 1.00000 0.00000 0.00000 4.00000 4.00000 0.00000 -0.02785 0.00000 ag i d9 5s5g -d9 5s8g 2 0.0000 5 0.0002 5 28 31 31 1.008 0.328 335.500 sec sqrtdel= 1.0000 1.0000 0.0000 0.0133 0.0004 0.0000 0.0000 0.0000 0.0000 0.0002 rcn mod 32 ee,eee= -0.04004 -0.02002 ee,eee= -0.01236 -0.02620 slater integrals for ag i d9 5s5g nconf=28 z= 47 ion= 0 exf=0.650 irel= 1 ag i d9 5s9g nconf=32 kut=-1 corrf=0.000 class 11 k rdk( 4d, 5g, 4d, 9g) frac k rek( 4d, 5g, 4d, 9g) frac - ------------------------------------- ----- - ------------------------------------- ----- 0 0.00517372 ryd = 567.7504 cm-1 0.226 2 0.00000003 ryd = 0.0034 cm-1 1.000 2 0.00009753 ryd = 10.7030 cm-1 0.721 4 0.00000002 ryd = 0.0022 cm-1 1.000 4 0.00000285 ryd = 0.3128 cm-1 0.945 6 0.00000001 ryd = 0.0016 cm-1 1.000 - ------------------------------------- ----- - ------------------------------------- ----- 0 0.00517372 ryd = 567.7504 cm-1 0.226 2 0.00000003 ryd = 0.0034 cm-1 1.000 2 0.00009753 ryd = 10.7030 cm-1 0.721 4 0.00000002 ryd = 0.0022 cm-1 1.000 4 0.00000285 ryd = 0.3128 cm-1 0.945 6 0.00000001 ryd = 0.0016 cm-1 1.000 - ------------------------------------- ----- - ------------------------------------- ----- 0 0.00517372 ryd = 567.7504 cm-1 0.226 2 0.00000003 ryd = 0.0034 cm-1 1.000 2 0.00009753 ryd = 10.7030 cm-1 0.721 4 0.00000002 ryd = 0.0022 cm-1 1.000 4 0.00000285 ryd = 0.3128 cm-1 0.945 6 0.00000001 ryd = 0.0016 cm-1 1.000 - ------------------------------------- ----- - ------------------------------------- ----- 0 0.00517372 ryd = 567.7504 cm-1 0.226 2 0.00000003 ryd = 0.0034 cm-1 1.000 2 0.00009753 ryd = 10.7030 cm-1 0.721 4 0.00000002 ryd = 0.0022 cm-1 1.000 4 0.00000285 ryd = 0.3128 cm-1 0.945 6 0.00000001 ryd = 0.0016 cm-1 1.000 9.00000 0.00000 2.00000 2.00000 4.00000 0.00000 -0.02620 0.00000 9.00000 0.00000 2.00000 4.00000 4.00000 0.00000 -0.02620 0.00000 9.00000 0.00000 2.00000 6.00000 4.00000 0.00000 -0.02620 0.00000 ag i d9 5s5g -d9 5s9g 6 0.0000 5 0.0107 5 0.0003 5 0.0000 5 0.0000 5 0.0000 5 28 32 32 0.906 0.203 336.625 sec rcn mod 32 ee,eee= -0.04004 -0.02002 ee,eee= -0.01236 -0.02620 slater integrals for ag i d9 5s5g nconf=28 z= 47 ion= 0 exf=0.650 irel= 1 ag i d9 5s9g nconf=32 kut=-1 corrf=0.000 class 11 k rdk( 5s, 5g, 5s, 9g) frac k rek( 5s, 5g, 5s, 9g) frac - ------------------------------------- ----- - ------------------------------------- ----- 0 0.00517367 ryd = 567.7449 cm-1 0.226 4 0.00000130 ryd = 0.1422 cm-1 1.000 - ------------------------------------- ----- - ------------------------------------- ----- 0 0.00517367 ryd = 567.7449 cm-1 0.226 4 0.00000130 ryd = 0.1422 cm-1 1.000 - ------------------------------------- ----- - ------------------------------------- ----- 0 0.00517367 ryd = 567.7449 cm-1 0.226 4 0.00000130 ryd = 0.1422 cm-1 1.000 - ------------------------------------- ----- - ------------------------------------- ----- 0 0.00517367 ryd = 567.7449 cm-1 0.226 4 0.00000130 ryd = 0.1422 cm-1 1.000 1.00000 0.00000 0.00000 4.00000 4.00000 0.00000 -0.02620 0.00000 ag i d9 5s5g -d9 5s9g 2 0.0000 5 0.0001 5 28 32 32 1.016 0.203 337.844 sec sqrtdel= 1.0000 1.0000 0.0000 0.0107 0.0003 0.0000 0.0000 0.0000 0.0000 0.0001 rcn mod 32 ee,eee= -0.02041 -0.03023 slater integrals for ag i d9 5s5g nconf=28 z= 47 ion= 0 exf=0.650 irel= 1 ag i d10 7i nconf=33 kut=-1 corrf=0.000 class 0 k rdk( 5s, 5g, 4d, 7i) frac k rek( 5s, 5g, 4d, 7i) frac - ------------------------------------- ----- - ------------------------------------- ----- 2 -0.00009790 ryd = -10.7437 cm-1 -0.961 6 0.00000000 ryd = -0.0001 cm-1 -1.000 ag i d9 5s5g -d10 7i 2 -0.0107 5 0.0000 5 28 33 1 0.320 0.164 338.414 sec sqrtdel= 1.0000 1.0000 -0.0107 0.0000 rcn mod 32 ee,eee= -0.01563 -0.02783 slater integrals for ag i d9 5s5g nconf=28 z= 47 ion= 0 exf=0.650 irel= 1 ag i d10 8i nconf=34 kut=-1 corrf=0.000 class 0 k rdk( 5s, 5g, 4d, 8i) frac k rek( 5s, 5g, 4d, 8i) frac - ------------------------------------- ----- - ------------------------------------- ----- 2 -0.00009682 ryd = -10.6249 cm-1 -0.956 6 0.00000000 ryd = -0.0001 cm-1 -1.000 ag i d9 5s5g -d10 8i 2 -0.0106 5 0.0000 5 28 34 1 0.031 0.102 338.555 sec sqrtdel= 1.0000 1.0000 -0.0106 0.0000 rcn mod 32 ee,eee= -0.01234 -0.02619 slater integrals for ag i d9 5s5g nconf=28 z= 47 ion= 0 exf=0.650 irel= 1 ag i d10 9i nconf=35 kut=-1 corrf=0.000 class 0 k rdk( 5s, 5g, 4d, 9i) frac k rek( 5s, 5g, 4d, 9i) frac - ------------------------------------- ----- - ------------------------------------- ----- 2 -0.00008763 ryd = -9.6160 cm-1 -0.948 6 0.00000000 ryd = -0.0001 cm-1 -1.000 ag i d9 5s5g -d10 9i 2 -0.0096 5 0.0000 5 28 35 1 0.023 0.016 338.656 sec sqrtdel= 1.0000 1.0000 -0.0096 0.0000 rcn mod 32 ee,eee= -0.04004 -0.02002 ee,eee= -0.02041 -0.03023 slater integrals for ag i d9 5s5g nconf=28 z= 47 ion= 0 exf=0.650 irel= 1 ag i d9 5s7i nconf=36 kut=-1 corrf=0.000 class 0 k rdk( 4d, 5g, 4d, 7i) frac k rek( 4d, 5g, 4d, 7i) frac - ------------------------------------- ----- - ------------------------------------- ----- 2 0.00006712 ryd = 7.3652 cm-1 1.000 4 0.00000000 ryd = 0.0000 cm-1 1.000 4 0.00000046 ryd = 0.0506 cm-1 1.000 6 0.00000000 ryd = 0.0000 cm-1 1.000 ag i d9 5s5g -d9 5s7i 4 0.0074 5 0.0001 5 0.0000 5 0.0000 5 28 36 36 1.102 0.039 339.805 sec sqrtdel= 1.0000 1.0000 0.0074 0.0001 0.0000 0.0000 rcn mod 32 ee,eee= -0.01563 -0.02783 slater integrals for ag i d9 5s5g nconf=28 z= 47 ion= 0 exf=0.650 irel= 1 ag i d9 5s8i nconf=37 kut=-1 corrf=0.000 class 0 k rdk( 4d, 5g, 4d, 8i) frac k rek( 4d, 5g, 4d, 8i) frac - ------------------------------------- ----- - ------------------------------------- ----- 2 0.00006637 ryd = 7.2838 cm-1 0.994 4 0.00000000 ryd = 0.0000 cm-1 1.000 4 0.00000051 ryd = 0.0559 cm-1 0.999 6 0.00000000 ryd = 0.0000 cm-1 1.000 ag i d9 5s5g -d9 5s8i 4 0.0073 5 0.0001 5 0.0000 5 0.0000 5 28 37 1 0.031 0.031 339.875 sec sqrtdel= 1.0000 1.0000 0.0073 0.0001 0.0000 0.0000 rcn mod 32 ee,eee= -0.01234 -0.02619 slater integrals for ag i d9 5s5g nconf=28 z= 47 ion= 0 exf=0.650 irel= 1 ag i d9 5s9i nconf=38 kut=-1 corrf=0.000 class 0 k rdk( 4d, 5g, 4d, 9i) frac k rek( 4d, 5g, 4d, 9i) frac - ------------------------------------- ----- - ------------------------------------- ----- 2 0.00006007 ryd = 6.5921 cm-1 0.986 4 0.00000000 ryd = 0.0000 cm-1 1.000 4 0.00000049 ryd = 0.0541 cm-1 0.998 6 0.00000000 ryd = 0.0000 cm-1 1.000 ag i d9 5s5g -d9 5s9i 4 0.0066 5 0.0001 5 0.0000 5 0.0000 5 28 38 1 0.031 0.047 339.992 sec sqrtdel= 1.0000 1.0000 0.0066 0.0001 0.0000 0.0000 rcn mod 32 ee,eee= -0.01000 -0.02502 slater integrals for ag i d9 5s5g nconf=28 z= 47 ion= 0 exf=0.650 irel= 1 ag i d9 5s9l nconf=40 kut=-1 corrf=0.000 class 0 k rdk( 4d, 5g, 4d,10l) frac k rek( 4d, 5g, 4d,10l) frac - ------------------------------------- ----- - ------------------------------------- ----- 4 0.00000003 ryd = 0.0030 cm-1 1.000 6 0.00000000 ryd = 0.0000 cm-1 1.000 ag i d9 5s5g -d9 5s9l 2 0.0000 5 0.0000 5 28 40 2 0.055 0.016 340.070 sec sqrtdel= 1.0000 1.0000 0.0000 0.0000 rcn mod 32 ee,eee= -0.02782 -0.01391 ee,eee= -0.02044 -0.02413 slater integrals for ag i d9 5s6g nconf=29 z= 47 ion= 0 exf=0.650 irel= 1 ag i d9 5s7g nconf=30 kut=-1 corrf=0.000 class 11 k rdk( 4d, 6g, 4d, 7g) frac k rek( 4d, 6g, 4d, 7g) frac - ------------------------------------- ----- - ------------------------------------- ----- 0 0.01608956 ryd = 1765.6250 cm-1 0.429 2 0.00000004 ryd = 0.0046 cm-1 1.000 2 0.00015704 ryd = 17.2335 cm-1 0.929 4 0.00000003 ryd = 0.0029 cm-1 1.000 4 0.00000380 ryd = 0.4175 cm-1 0.996 6 0.00000002 ryd = 0.0021 cm-1 1.000 - ------------------------------------- ----- - ------------------------------------- ----- 0 0.01608956 ryd = 1765.6250 cm-1 0.429 2 0.00000004 ryd = 0.0046 cm-1 1.000 2 0.00015704 ryd = 17.2335 cm-1 0.929 4 0.00000003 ryd = 0.0029 cm-1 1.000 4 0.00000380 ryd = 0.4175 cm-1 0.996 6 0.00000002 ryd = 0.0021 cm-1 1.000 - ------------------------------------- ----- - ------------------------------------- ----- 0 0.01608956 ryd = 1765.6250 cm-1 0.429 2 0.00000004 ryd = 0.0046 cm-1 1.000 2 0.00015704 ryd = 17.2335 cm-1 0.929 4 0.00000003 ryd = 0.0029 cm-1 1.000 4 0.00000380 ryd = 0.4175 cm-1 0.996 6 0.00000002 ryd = 0.0021 cm-1 1.000 - ------------------------------------- ----- - ------------------------------------- ----- 0 0.01608956 ryd = 1765.6250 cm-1 0.429 2 0.00000004 ryd = 0.0046 cm-1 1.000 2 0.00015704 ryd = 17.2335 cm-1 0.929 4 0.00000003 ryd = 0.0029 cm-1 1.000 4 0.00000380 ryd = 0.4175 cm-1 0.996 6 0.00000002 ryd = 0.0021 cm-1 1.000 9.00000 0.00000 2.00000 2.00000 4.00000 0.00000 -0.02413 0.00000 9.00000 0.00000 2.00000 4.00000 4.00000 0.00000 -0.02413 0.00000 9.00000 0.00000 2.00000 6.00000 4.00000 0.00000 -0.02413 0.00000 ag i d9 5s6g -d9 5s7g 6 0.0000 5 0.0172 5 0.0004 5 0.0000 5 0.0000 5 0.0000 5 29 30 30 1.211 0.133 341.414 sec rcn mod 32 ee,eee= -0.02782 -0.01391 ee,eee= -0.02044 -0.02413 slater integrals for ag i d9 5s6g nconf=29 z= 47 ion= 0 exf=0.650 irel= 1 ag i d9 5s7g nconf=30 kut=-1 corrf=0.000 class 11 k rdk( 5s, 6g, 5s, 7g) frac k rek( 5s, 6g, 5s, 7g) frac - ------------------------------------- ----- - ------------------------------------- ----- 0 0.01608949 ryd = 1765.6178 cm-1 0.429 4 0.00000170 ryd = 0.1871 cm-1 1.000 - ------------------------------------- ----- - ------------------------------------- ----- 0 0.01608949 ryd = 1765.6178 cm-1 0.429 4 0.00000170 ryd = 0.1871 cm-1 1.000 - ------------------------------------- ----- - ------------------------------------- ----- 0 0.01608949 ryd = 1765.6178 cm-1 0.429 4 0.00000170 ryd = 0.1871 cm-1 1.000 - ------------------------------------- ----- - ------------------------------------- ----- 0 0.01608949 ryd = 1765.6178 cm-1 0.429 4 0.00000170 ryd = 0.1871 cm-1 1.000 1.00000 0.00000 0.00000 4.00000 4.00000 0.00000 -0.02413 0.00000 ag i d9 5s6g -d9 5s7g 2 0.0000 5 0.0002 5 29 30 30 1.000 0.078 342.492 sec sqrtdel= 1.0000 1.0000 0.0000 0.0172 0.0004 0.0000 0.0000 0.0000 0.0000 0.0002 rcn mod 32 ee,eee= -0.02782 -0.01391 ee,eee= -0.01565 -0.02173 slater integrals for ag i d9 5s6g nconf=29 z= 47 ion= 0 exf=0.650 irel= 1 ag i d9 5s8g nconf=31 kut=-1 corrf=0.000 class 11 k rdk( 4d, 6g, 4d, 8g) frac k rek( 4d, 6g, 4d, 8g) frac - ------------------------------------- ----- - ------------------------------------- ----- 0 0.00984080 ryd = 1079.9031 cm-1 0.354 2 0.00000004 ryd = 0.0041 cm-1 1.000 2 0.00012093 ryd = 13.2708 cm-1 0.897 4 0.00000002 ryd = 0.0026 cm-1 1.000 4 0.00000319 ryd = 0.3498 cm-1 0.992 6 0.00000002 ryd = 0.0019 cm-1 1.000 - ------------------------------------- ----- - ------------------------------------- ----- 0 0.00984080 ryd = 1079.9031 cm-1 0.354 2 0.00000004 ryd = 0.0041 cm-1 1.000 2 0.00012093 ryd = 13.2708 cm-1 0.897 4 0.00000002 ryd = 0.0026 cm-1 1.000 4 0.00000319 ryd = 0.3498 cm-1 0.992 6 0.00000002 ryd = 0.0019 cm-1 1.000 - ------------------------------------- ----- - ------------------------------------- ----- 0 0.00984080 ryd = 1079.9031 cm-1 0.354 2 0.00000004 ryd = 0.0041 cm-1 1.000 2 0.00012093 ryd = 13.2708 cm-1 0.897 4 0.00000002 ryd = 0.0026 cm-1 1.000 4 0.00000319 ryd = 0.3498 cm-1 0.992 6 0.00000002 ryd = 0.0019 cm-1 1.000 - ------------------------------------- ----- - ------------------------------------- ----- 0 0.00984080 ryd = 1079.9031 cm-1 0.354 2 0.00000004 ryd = 0.0041 cm-1 1.000 2 0.00012093 ryd = 13.2708 cm-1 0.897 4 0.00000002 ryd = 0.0026 cm-1 1.000 4 0.00000319 ryd = 0.3498 cm-1 0.992 6 0.00000002 ryd = 0.0019 cm-1 1.000 9.00000 0.00000 2.00000 2.00000 4.00000 0.00000 -0.02173 0.00000 9.00000 0.00000 2.00000 4.00000 4.00000 0.00000 -0.02173 0.00000 9.00000 0.00000 2.00000 6.00000 4.00000 0.00000 -0.02173 0.00000 ag i d9 5s6g -d9 5s8g 6 0.0000 5 0.0133 5 0.0003 5 0.0000 5 0.0000 5 0.0000 5 29 31 31 1.266 0.180 343.961 sec rcn mod 32 ee,eee= -0.02782 -0.01391 ee,eee= -0.01565 -0.02173 slater integrals for ag i d9 5s6g nconf=29 z= 47 ion= 0 exf=0.650 irel= 1 ag i d9 5s8g nconf=31 kut=-1 corrf=0.000 class 11 k rdk( 5s, 6g, 5s, 8g) frac k rek( 5s, 6g, 5s, 8g) frac - ------------------------------------- ----- - ------------------------------------- ----- 0 0.00984074 ryd = 1079.8967 cm-1 0.354 4 0.00000152 ryd = 0.1672 cm-1 1.000 - ------------------------------------- ----- - ------------------------------------- ----- 0 0.00984074 ryd = 1079.8967 cm-1 0.354 4 0.00000152 ryd = 0.1672 cm-1 1.000 - ------------------------------------- ----- - ------------------------------------- ----- 0 0.00984074 ryd = 1079.8967 cm-1 0.354 4 0.00000152 ryd = 0.1672 cm-1 1.000 - ------------------------------------- ----- - ------------------------------------- ----- 0 0.00984074 ryd = 1079.8967 cm-1 0.354 4 0.00000152 ryd = 0.1672 cm-1 1.000 1.00000 0.00000 0.00000 4.00000 4.00000 0.00000 -0.02173 0.00000 ag i d9 5s6g -d9 5s8g 2 0.0000 5 0.0002 5 29 31 31 0.891 0.102 344.953 sec sqrtdel= 1.0000 1.0000 0.0000 0.0133 0.0003 0.0000 0.0000 0.0000 0.0000 0.0002 rcn mod 32 ee,eee= -0.02782 -0.01391 ee,eee= -0.01236 -0.02009 slater integrals for ag i d9 5s6g nconf=29 z= 47 ion= 0 exf=0.650 irel= 1 ag i d9 5s9g nconf=32 kut=-1 corrf=0.000 class 11 k rdk( 4d, 6g, 4d, 9g) frac k rek( 4d, 6g, 4d, 9g) frac - ------------------------------------- ----- - ------------------------------------- ----- 0 0.00702892 ryd = 771.3344 cm-1 0.317 2 0.00000003 ryd = 0.0037 cm-1 1.000 2 0.00009753 ryd = 10.7023 cm-1 0.877 4 0.00000002 ryd = 0.0024 cm-1 1.000 4 0.00000271 ryd = 0.2971 cm-1 0.988 6 0.00000002 ryd = 0.0017 cm-1 1.000 - ------------------------------------- ----- - ------------------------------------- ----- 0 0.00702892 ryd = 771.3344 cm-1 0.317 2 0.00000003 ryd = 0.0037 cm-1 1.000 2 0.00009753 ryd = 10.7023 cm-1 0.877 4 0.00000002 ryd = 0.0024 cm-1 1.000 4 0.00000271 ryd = 0.2971 cm-1 0.988 6 0.00000002 ryd = 0.0017 cm-1 1.000 - ------------------------------------- ----- - ------------------------------------- ----- 0 0.00702892 ryd = 771.3344 cm-1 0.317 2 0.00000003 ryd = 0.0037 cm-1 1.000 2 0.00009753 ryd = 10.7023 cm-1 0.877 4 0.00000002 ryd = 0.0024 cm-1 1.000 4 0.00000271 ryd = 0.2971 cm-1 0.988 6 0.00000002 ryd = 0.0017 cm-1 1.000 - ------------------------------------- ----- - ------------------------------------- ----- 0 0.00702892 ryd = 771.3344 cm-1 0.317 2 0.00000003 ryd = 0.0037 cm-1 1.000 2 0.00009753 ryd = 10.7023 cm-1 0.877 4 0.00000002 ryd = 0.0024 cm-1 1.000 4 0.00000271 ryd = 0.2971 cm-1 0.988 6 0.00000002 ryd = 0.0017 cm-1 1.000 9.00000 0.00000 2.00000 2.00000 4.00000 0.00000 -0.02009 0.00000 9.00000 0.00000 2.00000 4.00000 4.00000 0.00000 -0.02009 0.00000 9.00000 0.00000 2.00000 6.00000 4.00000 0.00000 -0.02009 0.00000 ag i d9 5s6g -d9 5s9g 6 0.0000 5 0.0107 5 0.0003 5 0.0000 5 0.0000 5 0.0000 5 29 32 32 1.602 0.461 347.016 sec rcn mod 32 ee,eee= -0.02782 -0.01391 ee,eee= -0.01236 -0.02009 slater integrals for ag i d9 5s6g nconf=29 z= 47 ion= 0 exf=0.650 irel= 1 ag i d9 5s9g nconf=32 kut=-1 corrf=0.000 class 11 k rdk( 5s, 6g, 5s, 9g) frac k rek( 5s, 6g, 5s, 9g) frac - ------------------------------------- ----- - ------------------------------------- ----- 0 0.00702886 ryd = 771.3287 cm-1 0.317 4 0.00000135 ryd = 0.1483 cm-1 1.000 - ------------------------------------- ----- - ------------------------------------- ----- 0 0.00702886 ryd = 771.3287 cm-1 0.317 4 0.00000135 ryd = 0.1483 cm-1 1.000 - ------------------------------------- ----- - ------------------------------------- ----- 0 0.00702886 ryd = 771.3287 cm-1 0.317 4 0.00000135 ryd = 0.1483 cm-1 1.000 - ------------------------------------- ----- - ------------------------------------- ----- 0 0.00702886 ryd = 771.3287 cm-1 0.317 4 0.00000135 ryd = 0.1483 cm-1 1.000 1.00000 0.00000 0.00000 4.00000 4.00000 0.00000 -0.02009 0.00000 ag i d9 5s6g -d9 5s9g 2 0.0000 5 0.0001 5 29 32 32 1.141 0.070 348.227 sec sqrtdel= 1.0000 1.0000 0.0000 0.0107 0.0003 0.0000 0.0000 0.0000 0.0000 0.0001 rcn mod 32 ee,eee= -0.02041 -0.02411 slater integrals for ag i d9 5s6g nconf=29 z= 47 ion= 0 exf=0.650 irel= 1 ag i d10 7i nconf=33 kut=-1 corrf=0.000 class 0 k rdk( 5s, 6g, 4d, 7i) frac k rek( 5s, 6g, 4d, 7i) frac - ------------------------------------- ----- - ------------------------------------- ----- 2 0.00002218 ryd = 2.4344 cm-1 0.274 6 0.00000000 ryd = -0.0001 cm-1 -1.000 ag i d9 5s6g -d10 7i 2 0.0024 5 0.0000 5 29 33 1 0.031 0.016 348.281 sec sqrtdel= 1.0000 1.0000 0.0024 0.0000 rcn mod 32 ee,eee= -0.01563 -0.02172 slater integrals for ag i d9 5s6g nconf=29 z= 47 ion= 0 exf=0.650 irel= 1 ag i d10 8i nconf=34 kut=-1 corrf=0.000 class 0 k rdk( 5s, 6g, 4d, 8i) frac k rek( 5s, 6g, 4d, 8i) frac - ------------------------------------- ----- - ------------------------------------- ----- 2 -0.00000979 ryd = -1.0738 cm-1 -0.151 6 0.00000000 ryd = -0.0001 cm-1 -1.000 ag i d9 5s6g -d10 8i 2 -0.0011 5 0.0000 5 29 34 1 0.031 0.078 348.391 sec sqrtdel= 1.0000 1.0000 -0.0011 0.0000 rcn mod 32 ee,eee= -0.01234 -0.02008 slater integrals for ag i d9 5s6g nconf=29 z= 47 ion= 0 exf=0.650 irel= 1 ag i d10 9i nconf=35 kut=-1 corrf=0.000 class 0 k rdk( 5s, 6g, 4d, 9i) frac k rek( 5s, 6g, 4d, 9i) frac - ------------------------------------- ----- - ------------------------------------- ----- 2 -0.00002126 ryd = -2.3328 cm-1 -0.380 6 0.00000000 ryd = -0.0001 cm-1 -1.000 ag i d9 5s6g -d10 9i 2 -0.0023 5 0.0000 5 29 35 1 0.031 0.039 348.492 sec sqrtdel= 1.0000 1.0000 -0.0023 0.0000 rcn mod 32 ee,eee= -0.02782 -0.01391 ee,eee= -0.02041 -0.02411 slater integrals for ag i d9 5s6g nconf=29 z= 47 ion= 0 exf=0.650 irel= 1 ag i d9 5s7i nconf=36 kut=-1 corrf=0.000 class 0 k rdk( 4d, 6g, 4d, 7i) frac k rek( 4d, 6g, 4d, 7i) frac - ------------------------------------- ----- - ------------------------------------- ----- 2 -0.00001521 ryd = -1.6689 cm-1 -0.285 4 0.00000000 ryd = 0.0000 cm-1 1.000 4 0.00000015 ryd = 0.0168 cm-1 0.500 6 0.00000000 ryd = 0.0000 cm-1 1.000 ag i d9 5s6g -d9 5s7i 4 -0.0017 5 0.0000 5 0.0000 5 0.0000 5 29 36 36 1.078 0.055 349.625 sec sqrtdel= 1.0000 1.0000 -0.0017 0.0000 0.0000 0.0000 rcn mod 32 ee,eee= -0.01563 -0.02172 slater integrals for ag i d9 5s6g nconf=29 z= 47 ion= 0 exf=0.650 irel= 1 ag i d9 5s8i nconf=37 kut=-1 corrf=0.000 class 0 k rdk( 4d, 6g, 4d, 8i) frac k rek( 4d, 6g, 4d, 8i) frac - ------------------------------------- ----- - ------------------------------------- ----- 2 0.00000671 ryd = 0.7362 cm-1 0.157 4 0.00000000 ryd = 0.0000 cm-1 1.000 4 0.00000023 ryd = 0.0250 cm-1 0.703 6 0.00000000 ryd = 0.0000 cm-1 1.000 ag i d9 5s6g -d9 5s8i 4 0.0007 5 0.0000 5 0.0000 5 0.0000 5 29 37 1 0.031 0.297 349.953 sec sqrtdel= 1.0000 1.0000 0.0007 0.0000 0.0000 0.0000 rcn mod 32 ee,eee= -0.01234 -0.02008 slater integrals for ag i d9 5s6g nconf=29 z= 47 ion= 0 exf=0.650 irel= 1 ag i d9 5s9i nconf=38 kut=-1 corrf=0.000 class 0 k rdk( 4d, 6g, 4d, 9i) frac k rek( 4d, 6g, 4d, 9i) frac - ------------------------------------- ----- - ------------------------------------- ----- 2 0.00001457 ryd = 1.5993 cm-1 0.395 4 0.00000000 ryd = 0.0000 cm-1 1.000 4 0.00000025 ryd = 0.0274 cm-1 0.794 6 0.00000000 ryd = 0.0000 cm-1 1.000 ag i d9 5s6g -d9 5s9i 4 0.0016 5 0.0000 5 0.0000 5 0.0000 5 29 38 1 0.180 0.039 350.180 sec sqrtdel= 1.0000 1.0000 0.0016 0.0000 0.0000 0.0000 rcn mod 32 ee,eee= -0.01000 -0.01891 slater integrals for ag i d9 5s6g nconf=29 z= 47 ion= 0 exf=0.650 irel= 1 ag i d9 5s9l nconf=40 kut=-1 corrf=0.000 class 0 k rdk( 4d, 6g, 4d,10l) frac k rek( 4d, 6g, 4d,10l) frac - ------------------------------------- ----- - ------------------------------------- ----- 4 -0.00000001 ryd = -0.0016 cm-1 -0.535 6 0.00000000 ryd = 0.0000 cm-1 1.000 ag i d9 5s6g -d9 5s9l 2 0.0000 5 0.0000 5 29 40 2 0.047 0.031 350.273 sec sqrtdel= 1.0000 1.0000 0.0000 0.0000 rcn mod 32 ee,eee= -0.02044 -0.01022 ee,eee= -0.01565 -0.01804 slater integrals for ag i d9 5s7g nconf=30 z= 47 ion= 0 exf=0.650 irel= 1 ag i d9 5s8g nconf=31 kut=-1 corrf=0.000 class 11 k rdk( 4d, 7g, 4d, 8g) frac k rek( 4d, 7g, 4d, 8g) frac - ------------------------------------- ----- - ------------------------------------- ----- 0 0.01317575 ryd = 1445.8713 cm-1 0.456 2 0.00000004 ryd = 0.0038 cm-1 1.000 2 0.00010774 ryd = 11.8234 cm-1 0.961 4 0.00000002 ryd = 0.0025 cm-1 1.000 4 0.00000275 ryd = 0.3018 cm-1 0.999 6 0.00000002 ryd = 0.0018 cm-1 1.000 - ------------------------------------- ----- - ------------------------------------- ----- 0 0.01317575 ryd = 1445.8713 cm-1 0.456 2 0.00000004 ryd = 0.0038 cm-1 1.000 2 0.00010774 ryd = 11.8234 cm-1 0.961 4 0.00000002 ryd = 0.0025 cm-1 1.000 4 0.00000275 ryd = 0.3018 cm-1 0.999 6 0.00000002 ryd = 0.0018 cm-1 1.000 - ------------------------------------- ----- - ------------------------------------- ----- 0 0.01317575 ryd = 1445.8713 cm-1 0.456 2 0.00000004 ryd = 0.0038 cm-1 1.000 2 0.00010774 ryd = 11.8234 cm-1 0.961 4 0.00000002 ryd = 0.0025 cm-1 1.000 4 0.00000275 ryd = 0.3018 cm-1 0.999 6 0.00000002 ryd = 0.0018 cm-1 1.000 - ------------------------------------- ----- - ------------------------------------- ----- 0 0.01317575 ryd = 1445.8713 cm-1 0.456 2 0.00000004 ryd = 0.0038 cm-1 1.000 2 0.00010774 ryd = 11.8234 cm-1 0.961 4 0.00000002 ryd = 0.0025 cm-1 1.000 4 0.00000275 ryd = 0.3018 cm-1 0.999 6 0.00000002 ryd = 0.0018 cm-1 1.000 9.00000 0.00000 2.00000 2.00000 4.00000 0.00000 -0.01804 0.00000 9.00000 0.00000 2.00000 4.00000 4.00000 0.00000 -0.01804 0.00000 9.00000 0.00000 2.00000 6.00000 4.00000 0.00000 -0.01804 0.00000 ag i d9 5s7g -d9 5s8g 6 0.0000 5 0.0118 5 0.0003 5 0.0000 5 0.0000 5 0.0000 5 30 31 31 0.930 0.133 351.344 sec rcn mod 32 ee,eee= -0.02044 -0.01022 ee,eee= -0.01565 -0.01804 slater integrals for ag i d9 5s7g nconf=30 z= 47 ion= 0 exf=0.650 irel= 1 ag i d9 5s8g nconf=31 kut=-1 corrf=0.000 class 11 k rdk( 5s, 7g, 5s, 8g) frac k rek( 5s, 7g, 5s, 8g) frac - ------------------------------------- ----- - ------------------------------------- ----- 0 0.01317569 ryd = 1445.8653 cm-1 0.456 4 0.00000141 ryd = 0.1542 cm-1 1.000 - ------------------------------------- ----- - ------------------------------------- ----- 0 0.01317569 ryd = 1445.8653 cm-1 0.456 4 0.00000141 ryd = 0.1542 cm-1 1.000 - ------------------------------------- ----- - ------------------------------------- ----- 0 0.01317569 ryd = 1445.8653 cm-1 0.456 4 0.00000141 ryd = 0.1542 cm-1 1.000 - ------------------------------------- ----- - ------------------------------------- ----- 0 0.01317569 ryd = 1445.8653 cm-1 0.456 4 0.00000141 ryd = 0.1542 cm-1 1.000 1.00000 0.00000 0.00000 4.00000 4.00000 0.00000 -0.01804 0.00000 ag i d9 5s7g -d9 5s8g 2 0.0000 5 0.0002 5 30 31 31 1.383 0.148 352.875 sec sqrtdel= 1.0000 1.0000 0.0000 0.0118 0.0003 0.0000 0.0000 0.0000 0.0000 0.0002 rcn mod 32 ee,eee= -0.02044 -0.01022 ee,eee= -0.01236 -0.01640 slater integrals for ag i d9 5s7g nconf=30 z= 47 ion= 0 exf=0.650 irel= 1 ag i d9 5s9g nconf=32 kut=-1 corrf=0.000 class 11 k rdk( 4d, 7g, 4d, 9g) frac k rek( 4d, 7g, 4d, 9g) frac - ------------------------------------- ----- - ------------------------------------- ----- 0 0.00851685 ryd = 934.6162 cm-1 0.388 2 0.00000003 ryd = 0.0034 cm-1 1.000 2 0.00008706 ryd = 9.5537 cm-1 0.943 4 0.00000002 ryd = 0.0022 cm-1 1.000 4 0.00000235 ryd = 0.2577 cm-1 0.998 6 0.00000001 ryd = 0.0016 cm-1 1.000 - ------------------------------------- ----- - ------------------------------------- ----- 0 0.00851685 ryd = 934.6162 cm-1 0.388 2 0.00000003 ryd = 0.0034 cm-1 1.000 2 0.00008706 ryd = 9.5537 cm-1 0.943 4 0.00000002 ryd = 0.0022 cm-1 1.000 4 0.00000235 ryd = 0.2577 cm-1 0.998 6 0.00000001 ryd = 0.0016 cm-1 1.000 - ------------------------------------- ----- - ------------------------------------- ----- 0 0.00851685 ryd = 934.6162 cm-1 0.388 2 0.00000003 ryd = 0.0034 cm-1 1.000 2 0.00008706 ryd = 9.5537 cm-1 0.943 4 0.00000002 ryd = 0.0022 cm-1 1.000 4 0.00000235 ryd = 0.2577 cm-1 0.998 6 0.00000001 ryd = 0.0016 cm-1 1.000 - ------------------------------------- ----- - ------------------------------------- ----- 0 0.00851685 ryd = 934.6162 cm-1 0.388 2 0.00000003 ryd = 0.0034 cm-1 1.000 2 0.00008706 ryd = 9.5537 cm-1 0.943 4 0.00000002 ryd = 0.0022 cm-1 1.000 4 0.00000235 ryd = 0.2577 cm-1 0.998 6 0.00000001 ryd = 0.0016 cm-1 1.000 9.00000 0.00000 2.00000 2.00000 4.00000 0.00000 -0.01640 0.00000 9.00000 0.00000 2.00000 4.00000 4.00000 0.00000 -0.01640 0.00000 9.00000 0.00000 2.00000 6.00000 4.00000 0.00000 -0.01640 0.00000 ag i d9 5s7g -d9 5s9g 6 0.0000 5 0.0096 5 0.0003 5 0.0000 5 0.0000 5 0.0000 5 30 32 32 0.898 0.180 353.953 sec rcn mod 32 ee,eee= -0.02044 -0.01022 ee,eee= -0.01236 -0.01640 slater integrals for ag i d9 5s7g nconf=30 z= 47 ion= 0 exf=0.650 irel= 1 ag i d9 5s9g nconf=32 kut=-1 corrf=0.000 class 11 k rdk( 5s, 7g, 5s, 9g) frac k rek( 5s, 7g, 5s, 9g) frac - ------------------------------------- ----- - ------------------------------------- ----- 0 0.00851680 ryd = 934.6109 cm-1 0.388 4 0.00000125 ryd = 0.1368 cm-1 1.000 - ------------------------------------- ----- - ------------------------------------- ----- 0 0.00851680 ryd = 934.6109 cm-1 0.388 4 0.00000125 ryd = 0.1368 cm-1 1.000 - ------------------------------------- ----- - ------------------------------------- ----- 0 0.00851680 ryd = 934.6109 cm-1 0.388 4 0.00000125 ryd = 0.1368 cm-1 1.000 - ------------------------------------- ----- - ------------------------------------- ----- 0 0.00851680 ryd = 934.6109 cm-1 0.388 4 0.00000125 ryd = 0.1368 cm-1 1.000 1.00000 0.00000 0.00000 4.00000 4.00000 0.00000 -0.01640 0.00000 ag i d9 5s7g -d9 5s9g 2 0.0000 5 0.0001 5 30 32 32 1.703 0.148 355.805 sec sqrtdel= 1.0000 1.0000 0.0000 0.0096 0.0003 0.0000 0.0000 0.0000 0.0000 0.0001 rcn mod 32 ee,eee= -0.02041 -0.02042 slater integrals for ag i d9 5s7g nconf=30 z= 47 ion= 0 exf=0.650 irel= 1 ag i d10 7i nconf=33 kut=-1 corrf=0.000 class 0 k rdk( 5s, 7g, 4d, 7i) frac k rek( 5s, 7g, 4d, 7i) frac - ------------------------------------- ----- - ------------------------------------- ----- 2 0.00000000 ryd = 0.0001 cm-1 0.000 6 0.00000000 ryd = -0.0001 cm-1 -1.000 ag i d9 5s7g -d10 7i 2 0.0000 5 0.0000 5 30 33 1 0.031 0.016 355.883 sec sqrtdel= 1.0000 1.0000 0.0000 0.0000 rcn mod 32 ee,eee= -0.01563 -0.01803 slater integrals for ag i d9 5s7g nconf=30 z= 47 ion= 0 exf=0.650 irel= 1 ag i d10 8i nconf=34 kut=-1 corrf=0.000 class 0 k rdk( 5s, 7g, 4d, 8i) frac k rek( 5s, 7g, 4d, 8i) frac - ------------------------------------- ----- - ------------------------------------- ----- 2 0.00001171 ryd = 1.2853 cm-1 0.221 6 0.00000000 ryd = -0.0001 cm-1 -1.000 ag i d9 5s7g -d10 8i 2 0.0013 5 0.0000 5 30 34 1 0.023 0.031 355.945 sec sqrtdel= 1.0000 1.0000 0.0013 0.0000 rcn mod 32 ee,eee= -0.01234 -0.01639 slater integrals for ag i d9 5s7g nconf=30 z= 47 ion= 0 exf=0.650 irel= 1 ag i d10 9i nconf=35 kut=-1 corrf=0.000 class 0 k rdk( 5s, 7g, 4d, 9i) frac k rek( 5s, 7g, 4d, 9i) frac - ------------------------------------- ----- - ------------------------------------- ----- 2 0.00000269 ryd = 0.2952 cm-1 0.059 6 0.00000000 ryd = -0.0001 cm-1 -1.000 ag i d9 5s7g -d10 9i 2 0.0003 5 0.0000 5 30 35 1 0.031 0.016 355.992 sec sqrtdel= 1.0000 1.0000 0.0003 0.0000 rcn mod 32 ee,eee= -0.02044 -0.01022 ee,eee= -0.02041 -0.02042 slater integrals for ag i d9 5s7g nconf=30 z= 47 ion= 0 exf=0.650 irel= 1 ag i d9 5s7i nconf=36 kut=-1 corrf=0.000 class 0 k rdk( 4d, 7g, 4d, 7i) frac k rek( 4d, 7g, 4d, 7i) frac - ------------------------------------- ----- - ------------------------------------- ----- 2 0.00000000 ryd = -0.0001 cm-1 0.000 4 0.00000000 ryd = 0.0000 cm-1 1.000 4 0.00000011 ryd = 0.0117 cm-1 0.473 6 0.00000000 ryd = 0.0000 cm-1 1.000 ag i d9 5s7g -d9 5s7i 4 0.0000 5 0.0000 5 0.0000 5 0.0000 5 30 36 36 1.234 0.031 357.352 sec sqrtdel= 1.0000 1.0000 0.0000 0.0000 0.0000 0.0000 rcn mod 32 ee,eee= -0.01563 -0.01803 slater integrals for ag i d9 5s7g nconf=30 z= 47 ion= 0 exf=0.650 irel= 1 ag i d9 5s8i nconf=37 kut=-1 corrf=0.000 class 0 k rdk( 4d, 7g, 4d, 8i) frac k rek( 4d, 7g, 4d, 8i) frac - ------------------------------------- ----- - ------------------------------------- ----- 2 -0.00000803 ryd = -0.8811 cm-1 -0.229 4 0.00000000 ryd = 0.0000 cm-1 1.000 4 0.00000014 ryd = 0.0149 cm-1 0.549 6 0.00000000 ryd = 0.0000 cm-1 1.000 ag i d9 5s7g -d9 5s8i 4 -0.0009 5 0.0000 5 0.0000 5 0.0000 5 30 37 1 0.031 0.031 357.516 sec sqrtdel= 1.0000 1.0000 -0.0009 0.0000 0.0000 0.0000 rcn mod 32 ee,eee= -0.01234 -0.01639 slater integrals for ag i d9 5s7g nconf=30 z= 47 ion= 0 exf=0.650 irel= 1 ag i d9 5s9i nconf=38 kut=-1 corrf=0.000 class 0 k rdk( 4d, 7g, 4d, 9i) frac k rek( 4d, 7g, 4d, 9i) frac - ------------------------------------- ----- - ------------------------------------- ----- 2 -0.00000184 ryd = -0.2023 cm-1 -0.061 4 0.00000000 ryd = 0.0000 cm-1 1.000 4 0.00000015 ryd = 0.0166 cm-1 0.629 6 0.00000000 ryd = 0.0000 cm-1 1.000 ag i d9 5s7g -d9 5s9i 4 -0.0002 5 0.0000 5 0.0000 5 0.0000 5 30 38 1 0.031 0.031 357.586 sec sqrtdel= 1.0000 1.0000 -0.0002 0.0000 0.0000 0.0000 rcn mod 32 ee,eee= -0.01000 -0.01522 slater integrals for ag i d9 5s7g nconf=30 z= 47 ion= 0 exf=0.650 irel= 1 ag i d9 5s9l nconf=40 kut=-1 corrf=0.000 class 0 k rdk( 4d, 7g, 4d,10l) frac k rek( 4d, 7g, 4d,10l) frac - ------------------------------------- ----- - ------------------------------------- ----- 4 0.00000000 ryd = -0.0001 cm-1 -0.041 6 0.00000000 ryd = 0.0000 cm-1 1.000 ag i d9 5s7g -d9 5s9l 2 0.0000 5 0.0000 5 30 40 2 0.063 0.016 357.672 sec sqrtdel= 1.0000 1.0000 0.0000 0.0000 rcn mod 32 ee,eee= -0.01565 -0.00782 ee,eee= -0.01236 -0.01400 slater integrals for ag i d9 5s8g nconf=31 z= 47 ion= 0 exf=0.650 irel= 1 ag i d9 5s9g nconf=32 kut=-1 corrf=0.000 class 11 k rdk( 4d, 8g, 4d, 9g) frac k rek( 4d, 8g, 4d, 9g) frac - ------------------------------------- ----- - ------------------------------------- ----- 0 0.01075692 ryd = 1180.4358 cm-1 0.471 2 0.00000003 ryd = 0.0031 cm-1 1.000 2 0.00007585 ryd = 8.3238 cm-1 0.975 4 0.00000002 ryd = 0.0020 cm-1 1.000 4 0.00000201 ryd = 0.2206 cm-1 1.000 6 0.00000001 ryd = 0.0015 cm-1 1.000 - ------------------------------------- ----- - ------------------------------------- ----- 0 0.01075692 ryd = 1180.4358 cm-1 0.471 2 0.00000003 ryd = 0.0031 cm-1 1.000 2 0.00007585 ryd = 8.3238 cm-1 0.975 4 0.00000002 ryd = 0.0020 cm-1 1.000 4 0.00000201 ryd = 0.2206 cm-1 1.000 6 0.00000001 ryd = 0.0015 cm-1 1.000 - ------------------------------------- ----- - ------------------------------------- ----- 0 0.01075692 ryd = 1180.4358 cm-1 0.471 2 0.00000003 ryd = 0.0031 cm-1 1.000 2 0.00007585 ryd = 8.3238 cm-1 0.975 4 0.00000002 ryd = 0.0020 cm-1 1.000 4 0.00000201 ryd = 0.2206 cm-1 1.000 6 0.00000001 ryd = 0.0015 cm-1 1.000 - ------------------------------------- ----- - ------------------------------------- ----- 0 0.01075692 ryd = 1180.4358 cm-1 0.471 2 0.00000003 ryd = 0.0031 cm-1 1.000 2 0.00007585 ryd = 8.3238 cm-1 0.975 4 0.00000002 ryd = 0.0020 cm-1 1.000 4 0.00000201 ryd = 0.2206 cm-1 1.000 6 0.00000001 ryd = 0.0015 cm-1 1.000 9.00000 0.00000 2.00000 2.00000 4.00000 0.00000 -0.01400 0.00000 9.00000 0.00000 2.00000 4.00000 4.00000 0.00000 -0.01400 0.00000 9.00000 0.00000 2.00000 6.00000 4.00000 0.00000 -0.01400 0.00000 ag i d9 5s8g -d9 5s9g 6 0.0000 5 0.0083 5 0.0002 5 0.0000 5 0.0000 5 0.0000 5 31 32 32 1.156 0.141 358.977 sec rcn mod 32 ee,eee= -0.01565 -0.00782 ee,eee= -0.01236 -0.01400 slater integrals for ag i d9 5s8g nconf=31 z= 47 ion= 0 exf=0.650 irel= 1 ag i d9 5s9g nconf=32 kut=-1 corrf=0.000 class 11 k rdk( 5s, 8g, 5s, 9g) frac k rek( 5s, 8g, 5s, 9g) frac - ------------------------------------- ----- - ------------------------------------- ----- 0 0.01075688 ryd = 1180.4310 cm-1 0.471 4 0.00000111 ryd = 0.1223 cm-1 1.000 - ------------------------------------- ----- - ------------------------------------- ----- 0 0.01075688 ryd = 1180.4310 cm-1 0.471 4 0.00000111 ryd = 0.1223 cm-1 1.000 - ------------------------------------- ----- - ------------------------------------- ----- 0 0.01075688 ryd = 1180.4310 cm-1 0.471 4 0.00000111 ryd = 0.1223 cm-1 1.000 - ------------------------------------- ----- - ------------------------------------- ----- 0 0.01075688 ryd = 1180.4310 cm-1 0.471 4 0.00000111 ryd = 0.1223 cm-1 1.000 1.00000 0.00000 0.00000 4.00000 4.00000 0.00000 -0.01400 0.00000 ag i d9 5s8g -d9 5s9g 2 0.0000 5 0.0001 5 31 32 32 1.367 0.070 360.414 sec sqrtdel= 1.0000 1.0000 0.0000 0.0083 0.0002 0.0000 0.0000 0.0000 0.0000 0.0001 rcn mod 32 ee,eee= -0.02041 -0.01803 slater integrals for ag i d9 5s8g nconf=31 z= 47 ion= 0 exf=0.650 irel= 1 ag i d10 7i nconf=33 kut=-1 corrf=0.000 class 0 k rdk( 5s, 8g, 4d, 7i) frac k rek( 5s, 8g, 4d, 7i) frac - ------------------------------------- ----- - ------------------------------------- ----- 2 -0.00000030 ryd = -0.0331 cm-1 -0.007 6 0.00000000 ryd = -0.0001 cm-1 -1.000 ag i d9 5s8g -d10 7i 2 0.0000 5 0.0000 5 31 33 1 0.031 0.063 360.586 sec sqrtdel= 1.0000 1.0000 0.0000 0.0000 rcn mod 32 ee,eee= -0.01563 -0.01564 slater integrals for ag i d9 5s8g nconf=31 z= 47 ion= 0 exf=0.650 irel= 1 ag i d10 8i nconf=34 kut=-1 corrf=0.000 class 0 k rdk( 5s, 8g, 4d, 8i) frac k rek( 5s, 8g, 4d, 8i) frac - ------------------------------------- ----- - ------------------------------------- ----- 2 0.00000000 ryd = 0.0001 cm-1 0.000 6 0.00000000 ryd = -0.0001 cm-1 -1.000 ag i d9 5s8g -d10 8i 2 0.0000 5 0.0000 5 31 34 1 0.016 0.039 360.641 sec sqrtdel= 1.0000 1.0000 0.0000 0.0000 rcn mod 32 ee,eee= -0.01234 -0.01400 slater integrals for ag i d9 5s8g nconf=31 z= 47 ion= 0 exf=0.650 irel= 1 ag i d10 9i nconf=35 kut=-1 corrf=0.000 class 0 k rdk( 5s, 8g, 4d, 9i) frac k rek( 5s, 8g, 4d, 9i) frac - ------------------------------------- ----- - ------------------------------------- ----- 2 0.00000612 ryd = 0.6716 cm-1 0.169 6 0.00000000 ryd = -0.0001 cm-1 -1.000 ag i d9 5s8g -d10 9i 2 0.0007 5 0.0000 5 31 35 1 0.031 0.023 360.695 sec sqrtdel= 1.0000 1.0000 0.0007 0.0000 rcn mod 32 ee,eee= -0.01565 -0.00782 ee,eee= -0.02041 -0.01803 slater integrals for ag i d9 5s8g nconf=31 z= 47 ion= 0 exf=0.650 irel= 1 ag i d9 5s7i nconf=36 kut=-1 corrf=0.000 class 0 k rdk( 4d, 8g, 4d, 7i) frac k rek( 4d, 8g, 4d, 7i) frac - ------------------------------------- ----- - ------------------------------------- ----- 2 0.00000021 ryd = 0.0227 cm-1 0.007 4 0.00000000 ryd = 0.0000 cm-1 1.000 4 0.00000008 ryd = 0.0087 cm-1 0.447 6 0.00000000 ryd = 0.0000 cm-1 1.000 ag i d9 5s8g -d9 5s7i 4 0.0000 5 0.0000 5 0.0000 5 0.0000 5 31 36 36 1.328 0.039 362.063 sec sqrtdel= 1.0000 1.0000 0.0000 0.0000 0.0000 0.0000 rcn mod 32 ee,eee= -0.01563 -0.01564 slater integrals for ag i d9 5s8g nconf=31 z= 47 ion= 0 exf=0.650 irel= 1 ag i d9 5s8i nconf=37 kut=-1 corrf=0.000 class 0 k rdk( 4d, 8g, 4d, 8i) frac k rek( 4d, 8g, 4d, 8i) frac - ------------------------------------- ----- - ------------------------------------- ----- 2 0.00000000 ryd = -0.0001 cm-1 0.000 4 0.00000000 ryd = 0.0000 cm-1 1.000 4 0.00000010 ryd = 0.0112 cm-1 0.524 6 0.00000000 ryd = 0.0000 cm-1 1.000 ag i d9 5s8g -d9 5s8i 4 0.0000 5 0.0000 5 0.0000 5 0.0000 5 31 37 1 0.031 0.031 362.133 sec sqrtdel= 1.0000 1.0000 0.0000 0.0000 0.0000 0.0000 rcn mod 32 ee,eee= -0.01234 -0.01400 slater integrals for ag i d9 5s8g nconf=31 z= 47 ion= 0 exf=0.650 irel= 1 ag i d9 5s9i nconf=38 kut=-1 corrf=0.000 class 0 k rdk( 4d, 8g, 4d, 9i) frac k rek( 4d, 8g, 4d, 9i) frac - ------------------------------------- ----- - ------------------------------------- ----- 2 -0.00000420 ryd = -0.4604 cm-1 -0.176 4 0.00000000 ryd = 0.0000 cm-1 1.000 4 0.00000011 ryd = 0.0119 cm-1 0.568 6 0.00000000 ryd = 0.0000 cm-1 1.000 ag i d9 5s8g -d9 5s9i 4 -0.0005 5 0.0000 5 0.0000 5 0.0000 5 31 38 1 0.031 0.039 362.203 sec sqrtdel= 1.0000 1.0000 -0.0005 0.0000 0.0000 0.0000 rcn mod 32 ee,eee= -0.01000 -0.01282 slater integrals for ag i d9 5s8g nconf=31 z= 47 ion= 0 exf=0.650 irel= 1 ag i d9 5s9l nconf=40 kut=-1 corrf=0.000 class 0 k rdk( 4d, 8g, 4d,10l) frac k rek( 4d, 8g, 4d,10l) frac - ------------------------------------- ----- - ------------------------------------- ----- 4 0.00000000 ryd = 0.0001 cm-1 0.066 6 0.00000000 ryd = 0.0000 cm-1 1.000 ag i d9 5s8g -d9 5s9l 2 0.0000 5 0.0000 5 31 40 2 0.047 0.031 362.281 sec sqrtdel= 1.0000 1.0000 0.0000 0.0000 rcn mod 32 ee,eee= -0.01236 -0.00618 ee,eee= -0.02041 -0.01638 slater integrals for ag i d9 5s9g nconf=32 z= 47 ion= 0 exf=0.650 irel= 1 ag i d10 7i nconf=33 kut=-1 corrf=0.000 class 0 k rdk( 5s, 9g, 4d, 7i) frac k rek( 5s, 9g, 4d, 7i) frac - ------------------------------------- ----- - ------------------------------------- ----- 2 -0.00000038 ryd = -0.0414 cm-1 -0.011 6 0.00000000 ryd = -0.0001 cm-1 -1.000 ag i d9 5s9g -d10 7i 2 0.0000 5 0.0000 5 32 33 33 1.227 0.164 363.695 sec sqrtdel= 1.0000 1.0000 0.0000 0.0000 rcn mod 32 ee,eee= -0.01563 -0.01399 slater integrals for ag i d9 5s9g nconf=32 z= 47 ion= 0 exf=0.650 irel= 1 ag i d10 8i nconf=34 kut=-1 corrf=0.000 class 0 k rdk( 5s, 9g, 4d, 8i) frac k rek( 5s, 9g, 4d, 8i) frac - ------------------------------------- ----- - ------------------------------------- ----- 2 -0.00000025 ryd = -0.0274 cm-1 -0.008 6 0.00000000 ryd = -0.0001 cm-1 -1.000 ag i d9 5s9g -d10 8i 2 0.0000 5 0.0000 5 32 34 1 0.016 0.031 363.742 sec sqrtdel= 1.0000 1.0000 0.0000 0.0000 rcn mod 32 ee,eee= -0.01234 -0.01235 slater integrals for ag i d9 5s9g nconf=32 z= 47 ion= 0 exf=0.650 irel= 1 ag i d10 9i nconf=35 kut=-1 corrf=0.000 class 0 k rdk( 5s, 9g, 4d, 9i) frac k rek( 5s, 9g, 4d, 9i) frac - ------------------------------------- ----- - ------------------------------------- ----- 2 0.00000000 ryd = 0.0001 cm-1 0.000 6 0.00000000 ryd = -0.0001 cm-1 -1.000 ag i d9 5s9g -d10 9i 2 0.0000 5 0.0000 5 32 35 1 0.031 0.078 363.852 sec sqrtdel= 1.0000 1.0000 0.0000 0.0000 rcn mod 32 ee,eee= -0.01236 -0.00618 ee,eee= -0.02041 -0.01638 slater integrals for ag i d9 5s9g nconf=32 z= 47 ion= 0 exf=0.650 irel= 1 ag i d9 5s7i nconf=36 kut=-1 corrf=0.000 class 0 k rdk( 4d, 9g, 4d, 7i) frac k rek( 4d, 9g, 4d, 7i) frac - ------------------------------------- ----- - ------------------------------------- ----- 2 0.00000026 ryd = 0.0284 cm-1 0.011 4 0.00000000 ryd = 0.0000 cm-1 1.000 4 0.00000006 ryd = 0.0069 cm-1 0.430 6 0.00000000 ryd = 0.0000 cm-1 1.000 ag i d9 5s9g -d9 5s7i 4 0.0000 5 0.0000 5 0.0000 5 0.0000 5 32 36 36 1.313 0.039 365.242 sec sqrtdel= 1.0000 1.0000 0.0000 0.0000 0.0000 0.0000 rcn mod 32 ee,eee= -0.01563 -0.01399 slater integrals for ag i d9 5s9g nconf=32 z= 47 ion= 0 exf=0.650 irel= 1 ag i d9 5s8i nconf=37 kut=-1 corrf=0.000 class 0 k rdk( 4d, 9g, 4d, 8i) frac k rek( 4d, 9g, 4d, 8i) frac - ------------------------------------- ----- - ------------------------------------- ----- 2 0.00000017 ryd = 0.0188 cm-1 0.008 4 0.00000000 ryd = 0.0000 cm-1 1.000 4 0.00000008 ryd = 0.0089 cm-1 0.504 6 0.00000000 ryd = 0.0000 cm-1 1.000 ag i d9 5s9g -d9 5s8i 4 0.0000 5 0.0000 5 0.0000 5 0.0000 5 32 37 1 0.031 0.039 365.320 sec sqrtdel= 1.0000 1.0000 0.0000 0.0000 0.0000 0.0000 rcn mod 32 ee,eee= -0.01234 -0.01235 slater integrals for ag i d9 5s9g nconf=32 z= 47 ion= 0 exf=0.650 irel= 1 ag i d9 5s9i nconf=38 kut=-1 corrf=0.000 class 0 k rdk( 4d, 9g, 4d, 9i) frac k rek( 4d, 9g, 4d, 9i) frac - ------------------------------------- ----- - ------------------------------------- ----- 2 0.00000000 ryd = -0.0001 cm-1 0.000 4 0.00000000 ryd = 0.0000 cm-1 1.000 4 0.00000009 ryd = 0.0095 cm-1 0.549 6 0.00000000 ryd = 0.0000 cm-1 1.000 ag i d9 5s9g -d9 5s9i 4 0.0000 5 0.0000 5 0.0000 5 0.0000 5 32 38 1 0.023 0.031 365.406 sec sqrtdel= 1.0000 1.0000 0.0000 0.0000 0.0000 0.0000 rcn mod 32 ee,eee= -0.01000 -0.01118 slater integrals for ag i d9 5s9g nconf=32 z= 47 ion= 0 exf=0.650 irel= 1 ag i d9 5s9l nconf=40 kut=-1 corrf=0.000 class 0 k rdk( 4d, 9g, 4d,10l) frac k rek( 4d, 9g, 4d,10l) frac - ------------------------------------- ----- - ------------------------------------- ----- 4 0.00000000 ryd = 0.0000 cm-1 -0.003 6 0.00000000 ryd = 0.0000 cm-1 1.000 ag i d9 5s9g -d9 5s9l 2 0.0000 5 0.0000 5 32 40 2 0.055 0.023 365.500 sec sqrtdel= 1.0000 1.0000 0.0000 0.0000 rcn mod 32 ee,eee= -1.76853 -0.88427 ee,eee= -1.17020 -1.46937 slater integrals for ag i d10 7i nconf=33 z= 47 ion= 0 exf=0.650 irel= 1 ag i d9 5s7i nconf=36 kut=-1 corrf=0.000 class 0 k rdk( 4d, 4d, 4d, 5s) frac k rek( 4d, 4d, 4d, 5s) frac - ------------------------------------- ----- - ------------------------------------- ----- 2 -0.13771314 ryd = -15112.2692 cm-1 -0.475 2 -0.13771340 ryd = -15112.2983 cm-1 -0.475 ag i d10 7i -d9 5s7i 1 -15.1123 5 33 36 36 1.703 0.008 367.234 sec rcn mod 32 ee,eee= -0.02041 -0.01020 ee,eee= -0.02041 -0.02041 slater integrals for ag i d10 7i nconf=33 z= 47 ion= 0 exf=0.650 irel= 1 ag i d9 5s7i nconf=36 kut=-1 corrf=0.000 class 0 k rdk( 4d, 7i, 5s, 7i) frac k rek( 4d, 7i, 5s, 7i) frac - ------------------------------------- ----- - ------------------------------------- ----- 2 -0.00006761 ryd = -7.4188 cm-1 -0.961 6 0.00000000 ryd = 0.0000 cm-1 -1.000 ag i d10 7i -d9 5s7i 2 -0.0074 5 0.0000 5 33 36 36 1.016 0.031 368.281 sec sqrtdel= 1.0000 1.0000 -15.1123 -0.0074 0.0000 rcn mod 32 ee,eee= -1.76853 -0.88427 ee,eee= -1.17977 -1.47415 slater integrals for ag i d10 7i nconf=33 z= 47 ion= 0 exf=0.650 irel= 1 ag i d9 5s8i nconf=37 kut=-1 corrf=0.000 class 0 k rdk( 4d, 4d, 4d, 5s) frac k rek( 4d, 4d, 4d, 5s) frac - ------------------------------------- ----- - ------------------------------------- ----- 2 0.00000000 ryd = 0.0000 cm-1 0.000 2 0.00000000 ryd = 0.0000 cm-1 0.000 ag i d10 7i -d9 5s8i 1 0.0000 5 33 37 37 1.258 0.008 369.563 sec rcn mod 32 ee,eee= -0.02041 -0.01020 ee,eee= -0.01563 -0.01802 slater integrals for ag i d10 7i nconf=33 z= 47 ion= 0 exf=0.650 irel= 1 ag i d9 5s8i nconf=37 kut=-1 corrf=0.000 class 0 k rdk( 4d, 7i, 5s, 8i) frac k rek( 4d, 7i, 5s, 8i) frac - ------------------------------------- ----- - ------------------------------------- ----- 2 -0.00003771 ryd = -4.1384 cm-1 -0.743 6 0.00000000 ryd = 0.0000 cm-1 -1.000 ag i d10 7i -d9 5s8i 2 -0.0041 5 0.0000 5 33 37 37 1.102 0.063 370.734 sec sqrtdel= 1.0000 1.0000 0.0000 -0.0041 0.0000 rcn mod 32 ee,eee= -1.76853 -0.88427 ee,eee= -1.18633 -1.47743 slater integrals for ag i d10 7i nconf=33 z= 47 ion= 0 exf=0.650 irel= 1 ag i d9 5s9i nconf=38 kut=-1 corrf=0.000 class 0 k rdk( 4d, 4d, 4d, 5s) frac k rek( 4d, 4d, 4d, 5s) frac - ------------------------------------- ----- - ------------------------------------- ----- 2 0.00000000 ryd = 0.0000 cm-1 0.000 2 0.00000000 ryd = 0.0000 cm-1 0.000 ag i d10 7i -d9 5s9i 1 0.0000 5 33 38 38 1.719 0.070 372.523 sec rcn mod 32 ee,eee= -0.02041 -0.01020 ee,eee= -0.01234 -0.01638 slater integrals for ag i d10 7i nconf=33 z= 47 ion= 0 exf=0.650 irel= 1 ag i d9 5s9i nconf=38 kut=-1 corrf=0.000 class 0 k rdk( 4d, 7i, 5s, 9i) frac k rek( 4d, 7i, 5s, 9i) frac - ------------------------------------- ----- - ------------------------------------- ----- 2 -0.00002621 ryd = -2.8766 cm-1 -0.650 6 0.00000000 ryd = 0.0000 cm-1 -1.000 ag i d10 7i -d9 5s9i 2 -0.0029 5 0.0000 5 33 38 38 1.563 0.047 374.133 sec sqrtdel= 1.0000 1.0000 0.0000 -0.0029 0.0000 rcn mod 32 ee,eee= -0.01000 -0.01520 slater integrals for ag i d10 7i nconf=33 z= 47 ion= 0 exf=0.650 irel= 1 ag i d9 5s9l nconf=40 kut=-1 corrf=0.000 class 0 k rdk( 4d, 7i, 5s,10l) frac k rek( 4d, 7i, 5s,10l) frac - ------------------------------------- ----- - ------------------------------------- ----- 2 -0.00001850 ryd = -2.0300 cm-1 -0.947 6 0.00000000 ryd = 0.0000 cm-1 -1.000 ag i d10 7i -d9 5s9l 2 -0.0020 5 0.0000 5 33 40 2 0.055 0.039 374.234 sec sqrtdel= 1.0000 1.0000 -0.0020 0.0000 rcn mod 32 ee,eee= -1.77810 -0.88905 ee,eee= -1.17020 -1.47415 slater integrals for ag i d10 8i nconf=34 z= 47 ion= 0 exf=0.650 irel= 1 ag i d9 5s7i nconf=36 kut=-1 corrf=0.000 class 0 k rdk( 4d, 4d, 4d, 5s) frac k rek( 4d, 4d, 4d, 5s) frac - ------------------------------------- ----- - ------------------------------------- ----- 2 0.00000000 ryd = 0.0000 cm-1 0.000 2 0.00000000 ryd = 0.0000 cm-1 0.000 ag i d10 8i -d9 5s7i 1 0.0000 5 34 36 36 1.141 0.031 375.414 sec rcn mod 32 ee,eee= -0.01563 -0.00781 ee,eee= -0.02041 -0.01802 slater integrals for ag i d10 8i nconf=34 z= 47 ion= 0 exf=0.650 irel= 1 ag i d9 5s7i nconf=36 kut=-1 corrf=0.000 class 0 k rdk( 4d, 8i, 5s, 7i) frac k rek( 4d, 8i, 5s, 7i) frac - ------------------------------------- ----- - ------------------------------------- ----- 2 -0.00003771 ryd = -4.1384 cm-1 -0.743 6 0.00000000 ryd = 0.0000 cm-1 -1.000 ag i d10 8i -d9 5s7i 2 -0.0041 5 0.0000 5 34 36 36 1.359 0.031 376.805 sec sqrtdel= 1.0000 1.0000 0.0000 -0.0041 0.0000 rcn mod 32 ee,eee= -1.77810 -0.88905 ee,eee= -1.17977 -1.47894 slater integrals for ag i d10 8i nconf=34 z= 47 ion= 0 exf=0.650 irel= 1 ag i d9 5s8i nconf=37 kut=-1 corrf=0.000 class 0 k rdk( 4d, 4d, 4d, 5s) frac k rek( 4d, 4d, 4d, 5s) frac - ------------------------------------- ----- - ------------------------------------- ----- 2 -0.13771312 ryd = -15112.2676 cm-1 -0.475 2 -0.13771339 ryd = -15112.2966 cm-1 -0.475 ag i d10 8i -d9 5s8i 1 -15.1123 5 34 37 37 1.031 0.016 377.852 sec rcn mod 32 ee,eee= -0.01563 -0.00781 ee,eee= -0.01563 -0.01563 slater integrals for ag i d10 8i nconf=34 z= 47 ion= 0 exf=0.650 irel= 1 ag i d9 5s8i nconf=37 kut=-1 corrf=0.000 class 0 k rdk( 4d, 8i, 5s, 8i) frac k rek( 4d, 8i, 5s, 8i) frac - ------------------------------------- ----- - ------------------------------------- ----- 2 -0.00004529 ryd = -4.9700 cm-1 -0.961 6 0.00000000 ryd = 0.0000 cm-1 -1.000 ag i d10 8i -d9 5s8i 2 -0.0050 5 0.0000 5 34 37 37 1.352 0.047 379.250 sec sqrtdel= 1.0000 1.0000 -15.1123 -0.0050 0.0000 rcn mod 32 ee,eee= -1.77810 -0.88905 ee,eee= -1.18633 -1.48221 slater integrals for ag i d10 8i nconf=34 z= 47 ion= 0 exf=0.650 irel= 1 ag i d9 5s9i nconf=38 kut=-1 corrf=0.000 class 0 k rdk( 4d, 4d, 4d, 5s) frac k rek( 4d, 4d, 4d, 5s) frac - ------------------------------------- ----- - ------------------------------------- ----- 2 0.00000000 ryd = 0.0000 cm-1 0.000 2 0.00000000 ryd = 0.0000 cm-1 0.000 ag i d10 8i -d9 5s9i 1 0.0000 5 34 38 38 1.891 0.031 381.195 sec rcn mod 32 ee,eee= -0.01563 -0.00781 ee,eee= -0.01234 -0.01398 slater integrals for ag i d10 8i nconf=34 z= 47 ion= 0 exf=0.650 irel= 1 ag i d9 5s9i nconf=38 kut=-1 corrf=0.000 class 0 k rdk( 4d, 8i, 5s, 9i) frac k rek( 4d, 8i, 5s, 9i) frac - ------------------------------------- ----- - ------------------------------------- ----- 2 -0.00003129 ryd = -3.4338 cm-1 -0.851 6 0.00000000 ryd = 0.0000 cm-1 -1.000 ag i d10 8i -d9 5s9i 2 -0.0034 5 0.0000 5 34 38 38 1.117 0.047 382.367 sec sqrtdel= 1.0000 1.0000 0.0000 -0.0034 0.0000 rcn mod 32 ee,eee= -0.01000 -0.01281 slater integrals for ag i d10 8i nconf=34 z= 47 ion= 0 exf=0.650 irel= 1 ag i d9 5s9l nconf=40 kut=-1 corrf=0.000 class 0 k rdk( 4d, 8i, 5s,10l) frac k rek( 4d, 8i, 5s,10l) frac - ------------------------------------- ----- - ------------------------------------- ----- 2 -0.00000397 ryd = -0.4352 cm-1 -0.310 6 0.00000000 ryd = 0.0000 cm-1 -1.000 ag i d10 8i -d9 5s9l 2 -0.0004 5 0.0000 5 34 40 2 0.047 0.031 382.445 sec sqrtdel= 1.0000 1.0000 -0.0004 0.0000 rcn mod 32 ee,eee= -1.78466 -0.89233 ee,eee= -1.17020 -1.47743 slater integrals for ag i d10 9i nconf=35 z= 47 ion= 0 exf=0.650 irel= 1 ag i d9 5s7i nconf=36 kut=-1 corrf=0.000 class 0 k rdk( 4d, 4d, 4d, 5s) frac k rek( 4d, 4d, 4d, 5s) frac - ------------------------------------- ----- - ------------------------------------- ----- 2 0.00000000 ryd = 0.0000 cm-1 0.000 2 0.00000000 ryd = 0.0000 cm-1 0.000 ag i d10 9i -d9 5s7i 1 0.0000 5 35 36 36 1.383 0.008 383.844 sec rcn mod 32 ee,eee= -0.01234 -0.00617 ee,eee= -0.02041 -0.01638 slater integrals for ag i d10 9i nconf=35 z= 47 ion= 0 exf=0.650 irel= 1 ag i d9 5s7i nconf=36 kut=-1 corrf=0.000 class 0 k rdk( 4d, 9i, 5s, 7i) frac k rek( 4d, 9i, 5s, 7i) frac - ------------------------------------- ----- - ------------------------------------- ----- 2 -0.00002621 ryd = -2.8766 cm-1 -0.650 6 0.00000000 ryd = 0.0000 cm-1 -1.000 ag i d10 9i -d9 5s7i 2 -0.0029 5 0.0000 5 35 36 36 1.203 0.031 385.086 sec sqrtdel= 1.0000 1.0000 0.0000 -0.0029 0.0000 rcn mod 32 ee,eee= -1.78466 -0.89233 ee,eee= -1.17977 -1.48221 slater integrals for ag i d10 9i nconf=35 z= 47 ion= 0 exf=0.650 irel= 1 ag i d9 5s8i nconf=37 kut=-1 corrf=0.000 class 0 k rdk( 4d, 4d, 4d, 5s) frac k rek( 4d, 4d, 4d, 5s) frac - ------------------------------------- ----- - ------------------------------------- ----- 2 0.00000000 ryd = 0.0000 cm-1 0.000 2 0.00000000 ryd = 0.0000 cm-1 0.000 ag i d10 9i -d9 5s8i 1 0.0000 5 35 37 37 1.250 0.031 386.375 sec rcn mod 32 ee,eee= -0.01234 -0.00617 ee,eee= -0.01563 -0.01398 slater integrals for ag i d10 9i nconf=35 z= 47 ion= 0 exf=0.650 irel= 1 ag i d9 5s8i nconf=37 kut=-1 corrf=0.000 class 0 k rdk( 4d, 9i, 5s, 8i) frac k rek( 4d, 9i, 5s, 8i) frac - ------------------------------------- ----- - ------------------------------------- ----- 2 -0.00003129 ryd = -3.4338 cm-1 -0.851 6 0.00000000 ryd = 0.0000 cm-1 -1.000 ag i d10 9i -d9 5s8i 2 -0.0034 5 0.0000 5 35 37 37 1.180 0.047 387.602 sec sqrtdel= 1.0000 1.0000 0.0000 -0.0034 0.0000 rcn mod 32 ee,eee= -1.78466 -0.89233 ee,eee= -1.18633 -1.48549 slater integrals for ag i d10 9i nconf=35 z= 47 ion= 0 exf=0.650 irel= 1 ag i d9 5s9i nconf=38 kut=-1 corrf=0.000 class 0 k rdk( 4d, 4d, 4d, 5s) frac k rek( 4d, 4d, 4d, 5s) frac - ------------------------------------- ----- - ------------------------------------- ----- 2 -0.13771312 ryd = -15112.2675 cm-1 -0.475 2 -0.13771339 ryd = -15112.2966 cm-1 -0.475 ag i d10 9i -d9 5s9i 1 -15.1123 5 35 38 38 1.797 0.016 389.430 sec rcn mod 32 ee,eee= -0.01234 -0.00617 ee,eee= -0.01234 -0.01234 slater integrals for ag i d10 9i nconf=35 z= 47 ion= 0 exf=0.650 irel= 1 ag i d9 5s9i nconf=38 kut=-1 corrf=0.000 class 0 k rdk( 4d, 9i, 5s, 9i) frac k rek( 4d, 9i, 5s, 9i) frac - ------------------------------------- ----- - ------------------------------------- ----- 2 -0.00003181 ryd = -3.4906 cm-1 -0.961 6 0.00000000 ryd = 0.0000 cm-1 -1.000 ag i d10 9i -d9 5s9i 2 -0.0035 5 0.0000 5 35 38 38 1.383 0.039 390.852 sec sqrtdel= 1.0000 1.0000 -15.1123 -0.0035 0.0000 rcn mod 32 ee,eee= -0.01000 -0.01117 slater integrals for ag i d10 9i nconf=35 z= 47 ion= 0 exf=0.650 irel= 1 ag i d9 5s9l nconf=40 kut=-1 corrf=0.000 class 0 k rdk( 4d, 9i, 5s,10l) frac k rek( 4d, 9i, 5s,10l) frac - ------------------------------------- ----- - ------------------------------------- ----- 2 0.00000256 ryd = 0.2811 cm-1 0.224 6 0.00000000 ryd = 0.0000 cm-1 -1.000 ag i d10 9i -d9 5s9l 2 0.0003 5 0.0000 5 35 40 2 0.055 0.016 390.922 sec sqrtdel= 1.0000 1.0000 0.0003 0.0000 rcn mod 32 ee,eee= -0.02041 -0.01020 ee,eee= -0.01563 -0.01802 slater integrals for ag i d9 5s7i nconf=36 z= 47 ion= 0 exf=0.650 irel= 1 ag i d9 5s8i nconf=37 kut=-1 corrf=0.000 class 11 k rdk( 4d, 7i, 4d, 8i) frac k rek( 4d, 7i, 4d, 8i) frac - ------------------------------------- ----- - ------------------------------------- ----- 0 0.00863519 ryd = 947.6024 cm-1 0.318 4 0.00000000 ryd = 0.0000 cm-1 1.000 2 0.00002585 ryd = 2.8371 cm-1 0.773 6 0.00000000 ryd = 0.0000 cm-1 1.000 4 0.00000012 ryd = 0.0130 cm-1 0.948 8 0.00000000 ryd = 0.0000 cm-1 1.000 - ------------------------------------- ----- - ------------------------------------- ----- 0 0.00863519 ryd = 947.6024 cm-1 0.318 4 0.00000000 ryd = 0.0000 cm-1 1.000 2 0.00002585 ryd = 2.8371 cm-1 0.773 6 0.00000000 ryd = 0.0000 cm-1 1.000 4 0.00000012 ryd = 0.0130 cm-1 0.948 8 0.00000000 ryd = 0.0000 cm-1 1.000 - ------------------------------------- ----- - ------------------------------------- ----- 0 0.00863519 ryd = 947.6024 cm-1 0.318 4 0.00000000 ryd = 0.0000 cm-1 1.000 2 0.00002585 ryd = 2.8371 cm-1 0.773 6 0.00000000 ryd = 0.0000 cm-1 1.000 4 0.00000012 ryd = 0.0130 cm-1 0.948 8 0.00000000 ryd = 0.0000 cm-1 1.000 - ------------------------------------- ----- - ------------------------------------- ----- 0 0.00863519 ryd = 947.6024 cm-1 0.318 4 0.00000000 ryd = 0.0000 cm-1 1.000 2 0.00002585 ryd = 2.8371 cm-1 0.773 6 0.00000000 ryd = 0.0000 cm-1 1.000 4 0.00000012 ryd = 0.0130 cm-1 0.948 8 0.00000000 ryd = 0.0000 cm-1 1.000 9.00000 0.00000 2.00000 4.00000 6.00000 0.00000 -0.01802 0.00000 9.00000 0.00000 2.00000 6.00000 6.00000 0.00000 -0.01802 0.00000 9.00000 0.00000 2.00000 8.00000 6.00000 0.00000 -0.01802 0.00000 ag i d9 5s7i -d9 5s8i 6 0.0000 5 0.0028 5 0.0000 5 0.0000 5 0.0000 5 0.0000 5 36 37 37 1.156 0.141 392.242 sec rcn mod 32 ee,eee= -0.02041 -0.01020 ee,eee= -0.01563 -0.01802 slater integrals for ag i d9 5s7i nconf=36 z= 47 ion= 0 exf=0.650 irel= 1 ag i d9 5s8i nconf=37 kut=-1 corrf=0.000 class 11 k rdk( 5s, 7i, 5s, 8i) frac k rek( 5s, 7i, 5s, 8i) frac - ------------------------------------- ----- - ------------------------------------- ----- 0 0.00863519 ryd = 947.6024 cm-1 0.318 6 0.00000000 ryd = 0.0000 cm-1 1.000 - ------------------------------------- ----- - ------------------------------------- ----- 0 0.00863519 ryd = 947.6024 cm-1 0.318 6 0.00000000 ryd = 0.0000 cm-1 1.000 - ------------------------------------- ----- - ------------------------------------- ----- 0 0.00863519 ryd = 947.6024 cm-1 0.318 6 0.00000000 ryd = 0.0000 cm-1 1.000 - ------------------------------------- ----- - ------------------------------------- ----- 0 0.00863519 ryd = 947.6024 cm-1 0.318 6 0.00000000 ryd = 0.0000 cm-1 1.000 1.00000 0.00000 0.00000 6.00000 6.00000 0.00000 -0.01802 0.00000 ag i d9 5s7i -d9 5s8i 2 0.0000 5 0.0000 5 36 37 37 1.391 0.141 393.781 sec sqrtdel= 1.0000 1.0000 0.0000 0.0028 0.0000 0.0000 0.0000 0.0000 0.0000 0.0000 rcn mod 32 ee,eee= -0.02041 -0.01020 ee,eee= -0.01234 -0.01638 slater integrals for ag i d9 5s7i nconf=36 z= 47 ion= 0 exf=0.650 irel= 1 ag i d9 5s9i nconf=38 kut=-1 corrf=0.000 class 11 k rdk( 4d, 7i, 4d, 9i) frac k rek( 4d, 7i, 4d, 9i) frac - ------------------------------------- ----- - ------------------------------------- ----- 0 0.00455227 ryd = 499.5537 cm-1 0.223 4 0.00000000 ryd = 0.0000 cm-1 1.000 2 0.00001797 ryd = 1.9720 cm-1 0.676 6 0.00000000 ryd = 0.0000 cm-1 1.000 4 0.00000010 ryd = 0.0107 cm-1 0.911 8 0.00000000 ryd = 0.0000 cm-1 1.000 - ------------------------------------- ----- - ------------------------------------- ----- 0 0.00455227 ryd = 499.5537 cm-1 0.223 4 0.00000000 ryd = 0.0000 cm-1 1.000 2 0.00001797 ryd = 1.9720 cm-1 0.676 6 0.00000000 ryd = 0.0000 cm-1 1.000 4 0.00000010 ryd = 0.0107 cm-1 0.911 8 0.00000000 ryd = 0.0000 cm-1 1.000 - ------------------------------------- ----- - ------------------------------------- ----- 0 0.00455227 ryd = 499.5537 cm-1 0.223 4 0.00000000 ryd = 0.0000 cm-1 1.000 2 0.00001797 ryd = 1.9720 cm-1 0.676 6 0.00000000 ryd = 0.0000 cm-1 1.000 4 0.00000010 ryd = 0.0107 cm-1 0.911 8 0.00000000 ryd = 0.0000 cm-1 1.000 - ------------------------------------- ----- - ------------------------------------- ----- 0 0.00455227 ryd = 499.5537 cm-1 0.223 4 0.00000000 ryd = 0.0000 cm-1 1.000 2 0.00001797 ryd = 1.9720 cm-1 0.676 6 0.00000000 ryd = 0.0000 cm-1 1.000 4 0.00000010 ryd = 0.0107 cm-1 0.911 8 0.00000000 ryd = 0.0000 cm-1 1.000 9.00000 0.00000 2.00000 4.00000 6.00000 0.00000 -0.01638 0.00000 9.00000 0.00000 2.00000 6.00000 6.00000 0.00000 -0.01638 0.00000 9.00000 0.00000 2.00000 8.00000 6.00000 0.00000 -0.01638 0.00000 ag i d9 5s7i -d9 5s9i 6 0.0000 5 0.0020 5 0.0000 5 0.0000 5 0.0000 5 0.0000 5 36 38 38 1.031 0.289 395.125 sec rcn mod 32 ee,eee= -0.02041 -0.01020 ee,eee= -0.01234 -0.01638 slater integrals for ag i d9 5s7i nconf=36 z= 47 ion= 0 exf=0.650 irel= 1 ag i d9 5s9i nconf=38 kut=-1 corrf=0.000 class 11 k rdk( 5s, 7i, 5s, 9i) frac k rek( 5s, 7i, 5s, 9i) frac - ------------------------------------- ----- - ------------------------------------- ----- 0 0.00455227 ryd = 499.5537 cm-1 0.223 6 0.00000000 ryd = 0.0000 cm-1 1.000 - ------------------------------------- ----- - ------------------------------------- ----- 0 0.00455227 ryd = 499.5537 cm-1 0.223 6 0.00000000 ryd = 0.0000 cm-1 1.000 - ------------------------------------- ----- - ------------------------------------- ----- 0 0.00455227 ryd = 499.5537 cm-1 0.223 6 0.00000000 ryd = 0.0000 cm-1 1.000 - ------------------------------------- ----- - ------------------------------------- ----- 0 0.00455227 ryd = 499.5537 cm-1 0.223 6 0.00000000 ryd = 0.0000 cm-1 1.000 1.00000 0.00000 0.00000 6.00000 6.00000 0.00000 -0.01638 0.00000 ag i d9 5s7i -d9 5s9i 2 0.0000 5 0.0000 5 36 38 38 1.938 0.070 397.133 sec sqrtdel= 1.0000 1.0000 0.0000 0.0020 0.0000 0.0000 0.0000 0.0000 0.0000 0.0000 rcn mod 32 ee,eee= -0.01000 -0.01520 slater integrals for ag i d9 5s7i nconf=36 z= 47 ion= 0 exf=0.650 irel= 1 ag i d10 9l nconf=39 kut=-1 corrf=0.000 class 0 k rdk( 5s, 7i, 4d,10l) frac k rek( 5s, 7i, 4d,10l) frac - ------------------------------------- ----- - ------------------------------------- ----- 2 -0.00001850 ryd = -2.0300 cm-1 -0.947 8 0.00000000 ryd = 0.0000 cm-1 -1.000 ag i d9 5s7i -d10 9l 2 -0.0020 5 0.0000 5 36 39 1 0.039 0.023 397.195 sec sqrtdel= 1.0000 1.0000 -0.0020 0.0000 rcn mod 32 ee,eee= -0.02041 -0.01020 ee,eee= -0.01000 -0.01520 slater integrals for ag i d9 5s7i nconf=36 z= 47 ion= 0 exf=0.650 irel= 1 ag i d9 5s9l nconf=40 kut=-1 corrf=0.000 class 0 k rdk( 4d, 7i, 4d,10l) frac k rek( 4d, 7i, 4d,10l) frac - ------------------------------------- ----- - ------------------------------------- ----- 2 0.00001268 ryd = 1.3916 cm-1 0.985 6 0.00000000 ryd = 0.0000 cm-1 1.000 4 0.00000003 ryd = 0.0028 cm-1 0.997 8 0.00000000 ryd = 0.0000 cm-1 1.000 ag i d9 5s7i -d9 5s9l 4 0.0014 5 0.0000 5 0.0000 5 0.0000 5 36 40 40 1.430 0.047 398.727 sec sqrtdel= 1.0000 1.0000 0.0014 0.0000 0.0000 0.0000 rcn mod 32 ee,eee= -0.01563 -0.00781 ee,eee= -0.01234 -0.01398 slater integrals for ag i d9 5s8i nconf=37 z= 47 ion= 0 exf=0.650 irel= 1 ag i d9 5s9i nconf=38 kut=-1 corrf=0.000 class 11 k rdk( 4d, 8i, 4d, 9i) frac k rek( 4d, 8i, 4d, 9i) frac - ------------------------------------- ----- - ------------------------------------- ----- 0 0.00849341 ryd = 932.0443 cm-1 0.385 4 0.00000000 ryd = 0.0000 cm-1 1.000 2 0.00002145 ryd = 2.3540 cm-1 0.885 6 0.00000000 ryd = 0.0000 cm-1 1.000 4 0.00000010 ryd = 0.0114 cm-1 0.987 8 0.00000000 ryd = 0.0000 cm-1 1.000 - ------------------------------------- ----- - ------------------------------------- ----- 0 0.00849341 ryd = 932.0443 cm-1 0.385 4 0.00000000 ryd = 0.0000 cm-1 1.000 2 0.00002145 ryd = 2.3540 cm-1 0.885 6 0.00000000 ryd = 0.0000 cm-1 1.000 4 0.00000010 ryd = 0.0114 cm-1 0.987 8 0.00000000 ryd = 0.0000 cm-1 1.000 - ------------------------------------- ----- - ------------------------------------- ----- 0 0.00849341 ryd = 932.0443 cm-1 0.385 4 0.00000000 ryd = 0.0000 cm-1 1.000 2 0.00002145 ryd = 2.3540 cm-1 0.885 6 0.00000000 ryd = 0.0000 cm-1 1.000 4 0.00000010 ryd = 0.0114 cm-1 0.987 8 0.00000000 ryd = 0.0000 cm-1 1.000 - ------------------------------------- ----- - ------------------------------------- ----- 0 0.00849341 ryd = 932.0443 cm-1 0.385 4 0.00000000 ryd = 0.0000 cm-1 1.000 2 0.00002145 ryd = 2.3540 cm-1 0.885 6 0.00000000 ryd = 0.0000 cm-1 1.000 4 0.00000010 ryd = 0.0114 cm-1 0.987 8 0.00000000 ryd = 0.0000 cm-1 1.000 9.00000 0.00000 2.00000 4.00000 6.00000 0.00000 -0.01398 0.00000 9.00000 0.00000 2.00000 6.00000 6.00000 0.00000 -0.01398 0.00000 9.00000 0.00000 2.00000 8.00000 6.00000 0.00000 -0.01398 0.00000 ag i d9 5s8i -d9 5s9i 6 0.0000 5 0.0024 5 0.0000 5 0.0000 5 0.0000 5 0.0000 5 37 38 38 1.430 0.156 400.320 sec rcn mod 32 ee,eee= -0.01563 -0.00781 ee,eee= -0.01234 -0.01398 slater integrals for ag i d9 5s8i nconf=37 z= 47 ion= 0 exf=0.650 irel= 1 ag i d9 5s9i nconf=38 kut=-1 corrf=0.000 class 11 k rdk( 5s, 8i, 5s, 9i) frac k rek( 5s, 8i, 5s, 9i) frac - ------------------------------------- ----- - ------------------------------------- ----- 0 0.00849341 ryd = 932.0442 cm-1 0.385 6 0.00000000 ryd = 0.0000 cm-1 1.000 - ------------------------------------- ----- - ------------------------------------- ----- 0 0.00849341 ryd = 932.0442 cm-1 0.385 6 0.00000000 ryd = 0.0000 cm-1 1.000 - ------------------------------------- ----- - ------------------------------------- ----- 0 0.00849341 ryd = 932.0442 cm-1 0.385 6 0.00000000 ryd = 0.0000 cm-1 1.000 - ------------------------------------- ----- - ------------------------------------- ----- 0 0.00849341 ryd = 932.0442 cm-1 0.385 6 0.00000000 ryd = 0.0000 cm-1 1.000 1.00000 0.00000 0.00000 6.00000 6.00000 0.00000 -0.01398 0.00000 ag i d9 5s8i -d9 5s9i 2 0.0000 5 0.0000 5 37 38 38 1.180 0.070 401.570 sec sqrtdel= 1.0000 1.0000 0.0000 0.0024 0.0000 0.0000 0.0000 0.0000 0.0000 0.0000 rcn mod 32 ee,eee= -0.01000 -0.01281 slater integrals for ag i d9 5s8i nconf=37 z= 47 ion= 0 exf=0.650 irel= 1 ag i d10 9l nconf=39 kut=-1 corrf=0.000 class 0 k rdk( 5s, 8i, 4d,10l) frac k rek( 5s, 8i, 4d,10l) frac - ------------------------------------- ----- - ------------------------------------- ----- 2 -0.00000397 ryd = -0.4352 cm-1 -0.310 8 0.00000000 ryd = 0.0000 cm-1 -1.000 ag i d9 5s8i -d10 9l 2 -0.0004 5 0.0000 5 37 39 1 0.016 0.031 401.633 sec sqrtdel= 1.0000 1.0000 -0.0004 0.0000 rcn mod 32 ee,eee= -0.01563 -0.00781 ee,eee= -0.01000 -0.01281 slater integrals for ag i d9 5s8i nconf=37 z= 47 ion= 0 exf=0.650 irel= 1 ag i d9 5s9l nconf=40 kut=-1 corrf=0.000 class 0 k rdk( 4d, 8i, 4d,10l) frac k rek( 4d, 8i, 4d,10l) frac - ------------------------------------- ----- - ------------------------------------- ----- 2 0.00000272 ryd = 0.2983 cm-1 0.323 6 0.00000000 ryd = 0.0000 cm-1 1.000 4 0.00000001 ryd = 0.0013 cm-1 0.707 8 0.00000000 ryd = 0.0000 cm-1 1.000 ag i d9 5s8i -d9 5s9l 4 0.0003 5 0.0000 5 0.0000 5 0.0000 5 37 40 40 1.508 0.039 403.180 sec sqrtdel= 1.0000 1.0000 0.0003 0.0000 0.0000 0.0000 rcn mod 32 ee,eee= -0.01234 -0.00617 ee,eee= -0.01000 -0.01117 slater integrals for ag i d9 5s9i nconf=38 z= 47 ion= 0 exf=0.650 irel= 1 ag i d10 9l nconf=39 kut=-1 corrf=0.000 class 0 k rdk( 5s, 9i, 4d,10l) frac k rek( 5s, 9i, 4d,10l) frac - ------------------------------------- ----- - ------------------------------------- ----- 2 0.00000256 ryd = 0.2811 cm-1 0.224 8 0.00000000 ryd = 0.0000 cm-1 -1.000 ag i d9 5s9i -d10 9l 2 0.0003 5 0.0000 5 38 39 39 1.727 0.039 404.961 sec sqrtdel= 1.0000 1.0000 0.0003 0.0000 rcn mod 32 ee,eee= -0.01234 -0.00617 ee,eee= -0.01000 -0.01117 slater integrals for ag i d9 5s9i nconf=38 z= 47 ion= 0 exf=0.650 irel= 1 ag i d9 5s9l nconf=40 kut=-1 corrf=0.000 class 0 k rdk( 4d, 9i, 4d,10l) frac k rek( 4d, 9i, 4d,10l) frac - ------------------------------------- ----- - ------------------------------------- ----- 2 -0.00000176 ryd = -0.1927 cm-1 -0.233 6 0.00000000 ryd = 0.0000 cm-1 1.000 4 0.00000001 ryd = 0.0007 cm-1 0.460 8 0.00000000 ryd = 0.0000 cm-1 1.000 ag i d9 5s9i -d9 5s9l 4 -0.0002 5 0.0000 5 0.0000 5 0.0000 5 38 40 40 1.242 0.039 406.273 sec sqrtdel= 1.0000 1.0000 -0.0002 0.0000 0.0000 0.0000 rcn mod 32 ee,eee= -1.78935 -0.89467 ee,eee= -1.19102 -1.49019 slater integrals for ag i d10 9l nconf=39 z= 47 ion= 0 exf=0.650 irel= 1 ag i d9 5s9l nconf=40 kut=-1 corrf=0.000 class 0 k rdk( 4d, 4d, 4d, 5s) frac k rek( 4d, 4d, 4d, 5s) frac - ------------------------------------- ----- - ------------------------------------- ----- 2 -0.13771312 ryd = -15112.2671 cm-1 -0.475 2 -0.13771338 ryd = -15112.2961 cm-1 -0.475 ag i d10 9l -d9 5s9l 1 -15.1123 5 39 40 40 1.406 0.031 407.734 sec rcn mod 32 ee,eee= -0.01000 -0.00500 ee,eee= -0.01000 -0.01000 slater integrals for ag i d10 9l nconf=39 z= 47 ion= 0 exf=0.650 irel= 1 ag i d9 5s9l nconf=40 kut=-1 corrf=0.000 class 0 k rdk( 4d,10l, 5s,10l) frac k rek( 4d,10l, 5s,10l) frac - ------------------------------------- ----- - ------------------------------------- ----- 2 -0.00001034 ryd = -1.1351 cm-1 -0.961 8 0.00000000 ryd = 0.0000 cm-1 -1.000 ag i d10 9l -d9 5s9l 2 -0.0011 5 0.0000 5 39 40 40 1.227 0.102 409.063 sec sqrtdel= 1.0000 1.0000 -15.1123 -0.0011 0.0000 z kut ca1 ca0 conf1 conf2 r integral reduced mupole element frac sigma sq over fr1 --- --- ---- ---- ------------------- ------------------- ---------- ---------------------------- ------ --------- ----- ----- 47 -1 0.70 0.50 ag i d10 5s ag i d10 5s 0.000E+00 ( //r2// )= 0.000E+00 a0 0.0000 0.000E+00 0.000 0.000 sqrtdel= 1.0000 0.000E+00 47 -1 0.70 0.50 ag i d10 5s ag i d10 6s 0.000E+00 ( //r2// )= 0.000E+00 a0 0.0000 0.000E+00 0.000 0.000 sqrtdel= 1.0000 0.000E+00 47 -1 0.70 0.50 ag i d10 5s ag i d10 7s 0.000E+00 ( //r2// )= 0.000E+00 a0 0.0000 0.000E+00 0.000 0.000 sqrtdel= 1.0000 0.000E+00 47 -1 0.70 0.50 ag i d10 5s ag i d10 8s 0.000E+00 ( //r2// )= 0.000E+00 a0 0.0000 0.000E+00 0.000 0.000 sqrtdel= 1.0000 0.000E+00 47 -1 0.70 0.50 ag i d10 5s ag i d10 9s 0.000E+00 ( //r2// )= 0.000E+00 a0 0.0000 0.000E+00 0.000 0.000 sqrtdel= 1.0000 0.000E+00 47 -1 0.70 0.50 ag i d10 5s ag i d9 5s2 -3.464E+00 ( 4d//r2// 5s)=-3.464E+00 a0 -0.9682 7.997E-01-0.445-0.698 sqrtdel= 1.0000 -3.464E+00 47 -1 0.70 0.50 ag i d10 5s ag i d9 5s6s 1.053E-01 ( 4d//r2// 6s)= 1.053E-01 a0 0.0771 7.392E-04-0.086-0.444 sqrtdel= 1.0000 1.053E-01 47 -1 0.70 0.50 ag i d10 5s ag i d9 5s7s 5.577E-02 ( 4d//r2// 7s)= 5.577E-02 a0 0.0731 2.074E-04-0.047-0.421 sqrtdel= 1.0000 5.577E-02 47 -1 0.70 0.50 ag i d10 5s ag i d9 5s8s 3.575E-02 ( 4d//r2// 8s)= 3.575E-02 a0 0.0700 8.519E-05-0.031-0.412 sqrtdel= 1.0000 3.575E-02 47 -1 0.70 0.50 ag i d10 5s ag i d9 5s9s 2.542E-02 ( 4d//r2// 9s)= 2.542E-02 a0 0.0681 4.308E-05-0.023-0.408 sqrtdel= 1.0000 2.542E-02 47 -1 0.70 0.50 ag i d10 5s ag i d8 5s2 6s 0.000E+00 ( //r2// )= 0.000E+00 a0 0.0000 0.000E+00 0.000 0.000 sqrtdel= 1.0000 0.000E+00 47 -1 0.70 0.50 ag i d10 5s ag i d10 5d 9.894E+00 ( 5s//r2// 5d)= 9.894E+00 a0 0.9967 6.525E+00 0.291 0.956 sqrtdel= 1.0000 9.894E+00 47 -1 0.70 0.50 ag i d10 5s ag i d10 6d 5.276E+00 ( 5s//r2// 6d)= 5.276E+00 a0 0.9487 1.856E+00 0.190 0.948 sqrtdel= 1.0000 5.276E+00 47 -1 0.70 0.50 ag i d10 5s ag i d10 7d 3.437E+00 ( 5s//r2// 7d)= 3.437E+00 a0 0.9062 7.875E-01 0.135 0.941 sqrtdel= 1.0000 3.437E+00 47 -1 0.70 0.50 ag i d10 5s ag i d10 8d 2.482E+00 ( 5s//r2// 8d)= 2.482E+00 a0 0.8802 4.108E-01 0.103 0.935 sqrtdel= 1.0000 2.482E+00 47 -1 0.70 0.50 ag i d10 5s ag i d10 9d 1.908E+00 ( 5s//r2// 9d)= 1.908E+00 a0 0.8632 2.428E-01 0.081 0.932 sqrtdel= 1.0000 1.908E+00 47 -1 0.70 0.50 ag i d10 5s ag i d9 5s5d -1.035E+00 ( 4d//r2// 5d)= 1.237E+00 a0 -0.9011 7.136E-02-0.015-0.132 sqrtdel= 1.0000 1.237E+00 47 -1 0.70 0.50 ag i d10 5s ag i d9 5s6d -6.810E-01 ( 4d//r2// 6d)= 8.140E-01 a0 -0.8885 3.092E-02-0.010-0.120 sqrtdel= 1.0000 8.140E-01 47 -1 0.70 0.50 ag i d10 5s ag i d9 5s7d -4.840E-01 ( 4d//r2// 7d)= 5.784E-01 a0 -0.8797 1.561E-02-0.007-0.116 sqrtdel= 1.0000 5.784E-01 47 -1 0.70 0.50 ag i d10 5s ag i d9 5s8d -3.652E-01 ( 4d//r2// 8d)= 4.365E-01 a0 -0.8736 8.893E-03-0.005-0.114 sqrtdel= 1.0000 4.365E-01 47 -1 0.70 0.50 ag i d10 5s ag i d9 5s9d -2.879E-01 ( 4d//r2// 9d)= 3.441E-01 a0 -0.8693 5.524E-03-0.004-0.112 sqrtdel= 1.0000 3.441E-01 47 -1 0.70 0.50 ag i d10 5s ag i d8 5s2 5d 0.000E+00 ( //r2// )= 0.000E+00 a0 0.0000 0.000E+00 0.000 0.000 sqrtdel= 1.0000 0.000E+00 47 -1 0.70 0.50 ag i d10 5s ag i d10 5g 0.000E+00 ( //r2// )= 0.000E+00 a0 0.0000 0.000E+00 0.000 0.000 sqrtdel= 1.0000 0.000E+00 47 -1 0.70 0.50 ag i d10 5s ag i d10 6g 0.000E+00 ( //r2// )= 0.000E+00 a0 0.0000 0.000E+00 0.000 0.000 sqrtdel= 1.0000 0.000E+00 47 -1 0.70 0.50 ag i d10 5s ag i d10 7g 0.000E+00 ( //r2// )= 0.000E+00 a0 0.0000 0.000E+00 0.000 0.000 sqrtdel= 1.0000 0.000E+00 47 -1 0.70 0.50 ag i d10 5s ag i d10 8g 0.000E+00 ( //r2// )= 0.000E+00 a0 0.0000 0.000E+00 0.000 0.000 sqrtdel= 1.0000 0.000E+00 47 -1 0.70 0.50 ag i d10 5s ag i d10 9g 0.000E+00 ( //r2// )= 0.000E+00 a0 0.0000 0.000E+00 0.000 0.000 sqrtdel= 1.0000 0.000E+00 47 -1 0.70 0.50 ag i d10 5s ag i d9 5s5g -2.882E-02 ( 4d//r2// 5g)=-4.621E-02 a0 -1.0000 1.318E-05-0.001-1.000 sqrtdel= 1.0000 -4.621E-02 47 -1 0.70 0.50 ag i d10 5s ag i d9 5s6g -2.944E-02 ( 4d//r2// 6g)=-4.721E-02 a0 -1.0000 1.376E-05-0.001-1.000 sqrtdel= 1.0000 -4.721E-02 47 -1 0.70 0.50 ag i d10 5s ag i d9 5s7g -2.682E-02 ( 4d//r2// 7g)=-4.301E-02 a0 -1.0000 1.142E-05-0.001-1.000 sqrtdel= 1.0000 -4.301E-02 47 -1 0.70 0.50 ag i d10 5s ag i d9 5s8g -2.377E-02 ( 4d//r2// 8g)=-3.811E-02 a0 -1.0000 8.967E-06-0.001-1.000 sqrtdel= 1.0000 -3.811E-02 47 -1 0.70 0.50 ag i d10 5s ag i d9 5s9g -2.096E-02 ( 4d//r2// 9g)=-3.362E-02 a0 -1.0000 6.975E-06-0.001-1.000 sqrtdel= 1.0000 -3.362E-02 47 -1 0.70 0.50 ag i d10 5s ag i d10 7i 0.000E+00 ( //r2// )= 0.000E+00 a0 0.0000 0.000E+00 0.000 0.000 sqrtdel= 1.0000 0.000E+00 47 -1 0.70 0.50 ag i d10 5s ag i d10 8i 0.000E+00 ( //r2// )= 0.000E+00 a0 0.0000 0.000E+00 0.000 0.000 sqrtdel= 1.0000 0.000E+00 47 -1 0.70 0.50 ag i d10 5s ag i d10 9i 0.000E+00 ( //r2// )= 0.000E+00 a0 0.0000 0.000E+00 0.000 0.000 sqrtdel= 1.0000 0.000E+00 47 -1 0.70 0.50 ag i d10 5s ag i d9 5s7i 0.000E+00 ( //r2// )= 0.000E+00 a0 0.0000 0.000E+00 0.000 0.000 sqrtdel= 1.0000 0.000E+00 47 -1 0.70 0.50 ag i d10 5s ag i d9 5s8i 0.000E+00 ( //r2// )= 0.000E+00 a0 0.0000 0.000E+00 0.000 0.000 sqrtdel= 1.0000 0.000E+00 47 -1 0.70 0.50 ag i d10 5s ag i d9 5s9i 0.000E+00 ( //r2// )= 0.000E+00 a0 0.0000 0.000E+00 0.000 0.000 sqrtdel= 1.0000 0.000E+00 47 -1 0.70 0.50 ag i d10 5s ag i d10 9l 0.000E+00 ( //r2// )= 0.000E+00 a0 0.0000 0.000E+00 0.000 0.000 sqrtdel= 1.0000 0.000E+00 47 -1 0.70 0.50 ag i d10 5s ag i d9 5s9l 0.000E+00 ( //r2// )= 0.000E+00 a0 0.0000 0.000E+00 0.000 0.000 sqrtdel= 1.0000 0.000E+00 47 -1 0.70 0.50 ag i d10 5s ag i d9 5p2 0.000E+00 ( //r2// )= 0.000E+00 a0 0.0000 0.000E+00 0.000 0.000 sqrtdel= 1.0000 0.000E+00 47 -1 0.70 0.50 ag i d10 6s ag i d10 5s 0.000E+00 ( //r2// )= 0.000E+00 a0 0.0000 0.000E+00 0.000 0.000 sqrtdel= 1.0000 0.000E+00 47 -1 0.70 0.50 ag i d10 6s ag i d10 6s 0.000E+00 ( //r2// )= 0.000E+00 a0 0.0000 0.000E+00 0.000 0.000 sqrtdel= 1.0000 0.000E+00 47 -1 0.70 0.50 ag i d10 6s ag i d10 7s 0.000E+00 ( //r2// )= 0.000E+00 a0 0.0000 0.000E+00 0.000 0.000 sqrtdel= 1.0000 0.000E+00 47 -1 0.70 0.50 ag i d10 6s ag i d10 8s 0.000E+00 ( //r2// )= 0.000E+00 a0 0.0000 0.000E+00 0.000 0.000 sqrtdel= 1.0000 0.000E+00 47 -1 0.70 0.50 ag i d10 6s ag i d10 9s 0.000E+00 ( //r2// )= 0.000E+00 a0 0.0000 0.000E+00 0.000 0.000 sqrtdel= 1.0000 0.000E+00 47 -1 0.70 0.50 ag i d10 6s ag i d9 5s2 0.000E+00 ( //r2// )= 0.000E+00 a0 0.0000 0.000E+00 0.000 0.000 sqrtdel= 1.0000 0.000E+00 47 -1 0.70 0.50 ag i d10 6s ag i d9 5s6s -3.190E+00 ( 4d//r2// 5s)=-3.190E+00 a0 -0.9620 6.782E-01-0.449-0.678 sqrtdel= 1.0000 -3.190E+00 47 -1 0.70 0.50 ag i d10 6s ag i d9 5s7s 0.000E+00 ( //r2// )= 0.000E+00 a0 0.0000 0.000E+00 0.000 0.000 sqrtdel= 1.0000 0.000E+00 47 -1 0.70 0.50 ag i d10 6s ag i d9 5s8s 0.000E+00 ( //r2// )= 0.000E+00 a0 0.0000 0.000E+00 0.000 0.000 sqrtdel= 1.0000 0.000E+00 47 -1 0.70 0.50 ag i d10 6s ag i d9 5s9s 0.000E+00 ( //r2// )= 0.000E+00 a0 0.0000 0.000E+00 0.000 0.000 sqrtdel= 1.0000 0.000E+00 47 -1 0.70 0.50 ag i d10 6s ag i d8 5s2 6s 0.000E+00 ( //r2// )= 0.000E+00 a0 0.0000 0.000E+00 0.000 0.000 sqrtdel= 1.0000 0.000E+00 47 -1 0.70 0.50 ag i d10 6s ag i d10 5d -1.070E+02 ( 6s//r2// 5d)=-1.070E+02 a0 -0.9978 7.626E+02-0.927-0.969 sqrtdel= 1.0000 -1.070E+02 47 -1 0.70 0.50 ag i d10 6s ag i d10 6d 3.300E+01 ( 6s//r2// 6d)= 3.300E+01 a0 0.4614 7.259E+01-0.130-0.276 sqrtdel= 1.0000 3.300E+01 47 -1 0.70 0.50 ag i d10 6s ag i d10 7d 1.939E+01 ( 6s//r2// 7d)= 1.939E+01 a0 0.4344 2.506E+01-0.039-0.124 sqrtdel= 1.0000 1.939E+01 47 -1 0.70 0.50 ag i d10 6s ag i d10 8d 1.296E+01 ( 6s//r2// 8d)= 1.296E+01 a0 0.3988 1.120E+01-0.014-0.060 sqrtdel= 1.0000 1.296E+01 47 -1 0.70 0.50 ag i d10 6s ag i d10 9d 9.500E+00 ( 6s//r2// 9d)= 9.500E+00 a0 0.3767 6.017E+00-0.004-0.025 sqrtdel= 1.0000 9.500E+00 47 -1 0.70 0.50 ag i d10 6s ag i d9 5s5d 0.000E+00 ( //r2// )= 0.000E+00 a0 0.0000 0.000E+00 0.000 0.000 sqrtdel= 1.0000 0.000E+00 47 -1 0.70 0.50 ag i d10 6s ag i d9 5s6d 0.000E+00 ( //r2// )= 0.000E+00 a0 0.0000 0.000E+00 0.000 0.000 sqrtdel= 1.0000 0.000E+00 47 -1 0.70 0.50 ag i d10 6s ag i d9 5s7d 0.000E+00 ( //r2// )= 0.000E+00 a0 0.0000 0.000E+00 0.000 0.000 sqrtdel= 1.0000 0.000E+00 47 -1 0.70 0.50 ag i d10 6s ag i d9 5s8d 0.000E+00 ( //r2// )= 0.000E+00 a0 0.0000 0.000E+00 0.000 0.000 sqrtdel= 1.0000 0.000E+00 47 -1 0.70 0.50 ag i d10 6s ag i d9 5s9d 0.000E+00 ( //r2// )= 0.000E+00 a0 0.0000 0.000E+00 0.000 0.000 sqrtdel= 1.0000 0.000E+00 47 -1 0.70 0.50 ag i d10 6s ag i d8 5s2 5d 0.000E+00 ( //r2// )= 0.000E+00 a0 0.0000 0.000E+00 0.000 0.000 sqrtdel= 1.0000 0.000E+00 47 -1 0.70 0.50 ag i d10 6s ag i d10 5g 0.000E+00 ( //r2// )= 0.000E+00 a0 0.0000 0.000E+00 0.000 0.000 sqrtdel= 1.0000 0.000E+00 47 -1 0.70 0.50 ag i d10 6s ag i d10 6g 0.000E+00 ( //r2// )= 0.000E+00 a0 0.0000 0.000E+00 0.000 0.000 sqrtdel= 1.0000 0.000E+00 47 -1 0.70 0.50 ag i d10 6s ag i d10 7g 0.000E+00 ( //r2// )= 0.000E+00 a0 0.0000 0.000E+00 0.000 0.000 sqrtdel= 1.0000 0.000E+00 47 -1 0.70 0.50 ag i d10 6s ag i d10 8g 0.000E+00 ( //r2// )= 0.000E+00 a0 0.0000 0.000E+00 0.000 0.000 sqrtdel= 1.0000 0.000E+00 47 -1 0.70 0.50 ag i d10 6s ag i d10 9g 0.000E+00 ( //r2// )= 0.000E+00 a0 0.0000 0.000E+00 0.000 0.000 sqrtdel= 1.0000 0.000E+00 47 -1 0.70 0.50 ag i d10 6s ag i d9 5s5g 0.000E+00 ( //r2// )= 0.000E+00 a0 0.0000 0.000E+00 0.000 0.000 sqrtdel= 1.0000 0.000E+00 47 -1 0.70 0.50 ag i d10 6s ag i d9 5s6g 0.000E+00 ( //r2// )= 0.000E+00 a0 0.0000 0.000E+00 0.000 0.000 sqrtdel= 1.0000 0.000E+00 47 -1 0.70 0.50 ag i d10 6s ag i d9 5s7g 0.000E+00 ( //r2// )= 0.000E+00 a0 0.0000 0.000E+00 0.000 0.000 sqrtdel= 1.0000 0.000E+00 47 -1 0.70 0.50 ag i d10 6s ag i d9 5s8g 0.000E+00 ( //r2// )= 0.000E+00 a0 0.0000 0.000E+00 0.000 0.000 sqrtdel= 1.0000 0.000E+00 47 -1 0.70 0.50 ag i d10 6s ag i d9 5s9g 0.000E+00 ( //r2// )= 0.000E+00 a0 0.0000 0.000E+00 0.000 0.000 sqrtdel= 1.0000 0.000E+00 47 -1 0.70 0.50 ag i d10 6s ag i d10 7i 0.000E+00 ( //r2// )= 0.000E+00 a0 0.0000 0.000E+00 0.000 0.000 sqrtdel= 1.0000 0.000E+00 47 -1 0.70 0.50 ag i d10 6s ag i d10 8i 0.000E+00 ( //r2// )= 0.000E+00 a0 0.0000 0.000E+00 0.000 0.000 sqrtdel= 1.0000 0.000E+00 47 -1 0.70 0.50 ag i d10 6s ag i d10 9i 0.000E+00 ( //r2// )= 0.000E+00 a0 0.0000 0.000E+00 0.000 0.000 sqrtdel= 1.0000 0.000E+00 47 -1 0.70 0.50 ag i d10 6s ag i d9 5s7i 0.000E+00 ( //r2// )= 0.000E+00 a0 0.0000 0.000E+00 0.000 0.000 sqrtdel= 1.0000 0.000E+00 47 -1 0.70 0.50 ag i d10 6s ag i d9 5s8i 0.000E+00 ( //r2// )= 0.000E+00 a0 0.0000 0.000E+00 0.000 0.000 sqrtdel= 1.0000 0.000E+00 47 -1 0.70 0.50 ag i d10 6s ag i d9 5s9i 0.000E+00 ( //r2// )= 0.000E+00 a0 0.0000 0.000E+00 0.000 0.000 sqrtdel= 1.0000 0.000E+00 47 -1 0.70 0.50 ag i d10 6s ag i d10 9l 0.000E+00 ( //r2// )= 0.000E+00 a0 0.0000 0.000E+00 0.000 0.000 sqrtdel= 1.0000 0.000E+00 47 -1 0.70 0.50 ag i d10 6s ag i d9 5s9l 0.000E+00 ( //r2// )= 0.000E+00 a0 0.0000 0.000E+00 0.000 0.000 sqrtdel= 1.0000 0.000E+00 47 -1 0.70 0.50 ag i d10 6s ag i d9 5p2 0.000E+00 ( //r2// )= 0.000E+00 a0 0.0000 0.000E+00 0.000 0.000 sqrtdel= 1.0000 0.000E+00 47 -1 0.70 0.50 ag i d10 7s ag i d10 5s 0.000E+00 ( //r2// )= 0.000E+00 a0 0.0000 0.000E+00 0.000 0.000 sqrtdel= 1.0000 0.000E+00 47 -1 0.70 0.50 ag i d10 7s ag i d10 6s 0.000E+00 ( //r2// )= 0.000E+00 a0 0.0000 0.000E+00 0.000 0.000 sqrtdel= 1.0000 0.000E+00 47 -1 0.70 0.50 ag i d10 7s ag i d10 7s 0.000E+00 ( //r2// )= 0.000E+00 a0 0.0000 0.000E+00 0.000 0.000 sqrtdel= 1.0000 0.000E+00 47 -1 0.70 0.50 ag i d10 7s ag i d10 8s 0.000E+00 ( //r2// )= 0.000E+00 a0 0.0000 0.000E+00 0.000 0.000 sqrtdel= 1.0000 0.000E+00 47 -1 0.70 0.50 ag i d10 7s ag i d10 9s 0.000E+00 ( //r2// )= 0.000E+00 a0 0.0000 0.000E+00 0.000 0.000 sqrtdel= 1.0000 0.000E+00 47 -1 0.70 0.50 ag i d10 7s ag i d9 5s2 0.000E+00 ( //r2// )= 0.000E+00 a0 0.0000 0.000E+00 0.000 0.000 sqrtdel= 1.0000 0.000E+00 47 -1 0.70 0.50 ag i d10 7s ag i d9 5s6s 0.000E+00 ( //r2// )= 0.000E+00 a0 0.0000 0.000E+00 0.000 0.000 sqrtdel= 1.0000 0.000E+00 47 -1 0.70 0.50 ag i d10 7s ag i d9 5s7s -3.173E+00 ( 4d//r2// 5s)=-3.173E+00 a0 -0.9616 6.713E-01-0.449-0.676 sqrtdel= 1.0000 -3.173E+00 47 -1 0.70 0.50 ag i d10 7s ag i d9 5s8s 0.000E+00 ( //r2// )= 0.000E+00 a0 0.0000 0.000E+00 0.000 0.000 sqrtdel= 1.0000 0.000E+00 47 -1 0.70 0.50 ag i d10 7s ag i d9 5s9s 0.000E+00 ( //r2// )= 0.000E+00 a0 0.0000 0.000E+00 0.000 0.000 sqrtdel= 1.0000 0.000E+00 47 -1 0.70 0.50 ag i d10 7s ag i d8 5s2 6s 0.000E+00 ( //r2// )= 0.000E+00 a0 0.0000 0.000E+00 0.000 0.000 sqrtdel= 1.0000 0.000E+00 47 -1 0.70 0.50 ag i d10 7s ag i d10 5d 1.235E+02 ( 7s//r2// 5d)= 1.235E+02 a0 0.8330 1.018E+03 0.222 0.330 sqrtdel= 1.0000 1.235E+02 47 -1 0.70 0.50 ag i d10 7s ag i d10 6d -4.066E+02 ( 7s//r2// 6d)=-4.066E+02 a0 -0.9986 1.102E+04-0.914-0.984 sqrtdel= 1.0000 -4.066E+02 47 -1 0.70 0.50 ag i d10 7s ag i d10 7d 7.254E+01 ( 7s//r2// 7d)= 7.254E+01 a0 0.2637 3.508E+02-0.219-0.400 sqrtdel= 1.0000 7.254E+01 47 -1 0.70 0.50 ag i d10 7s ag i d10 8d 4.465E+01 ( 7s//r2// 8d)= 4.465E+01 a0 0.2436 1.329E+02-0.104-0.271 sqrtdel= 1.0000 4.465E+01 47 -1 0.70 0.50 ag i d10 7s ag i d10 9d 3.018E+01 ( 7s//r2// 9d)= 3.018E+01 a0 0.2178 6.070E+01-0.062-0.213 sqrtdel= 1.0000 3.018E+01 47 -1 0.70 0.50 ag i d10 7s ag i d9 5s5d 0.000E+00 ( //r2// )= 0.000E+00 a0 0.0000 0.000E+00 0.000 0.000 sqrtdel= 1.0000 0.000E+00 47 -1 0.70 0.50 ag i d10 7s ag i d9 5s6d 0.000E+00 ( //r2// )= 0.000E+00 a0 0.0000 0.000E+00 0.000 0.000 sqrtdel= 1.0000 0.000E+00 47 -1 0.70 0.50 ag i d10 7s ag i d9 5s7d 0.000E+00 ( //r2// )= 0.000E+00 a0 0.0000 0.000E+00 0.000 0.000 sqrtdel= 1.0000 0.000E+00 47 -1 0.70 0.50 ag i d10 7s ag i d9 5s8d 0.000E+00 ( //r2// )= 0.000E+00 a0 0.0000 0.000E+00 0.000 0.000 sqrtdel= 1.0000 0.000E+00 47 -1 0.70 0.50 ag i d10 7s ag i d9 5s9d 0.000E+00 ( //r2// )= 0.000E+00 a0 0.0000 0.000E+00 0.000 0.000 sqrtdel= 1.0000 0.000E+00 47 -1 0.70 0.50 ag i d10 7s ag i d8 5s2 5d 0.000E+00 ( //r2// )= 0.000E+00 a0 0.0000 0.000E+00 0.000 0.000 sqrtdel= 1.0000 0.000E+00 47 -1 0.70 0.50 ag i d10 7s ag i d10 5g 0.000E+00 ( //r2// )= 0.000E+00 a0 0.0000 0.000E+00 0.000 0.000 sqrtdel= 1.0000 0.000E+00 47 -1 0.70 0.50 ag i d10 7s ag i d10 6g 0.000E+00 ( //r2// )= 0.000E+00 a0 0.0000 0.000E+00 0.000 0.000 sqrtdel= 1.0000 0.000E+00 47 -1 0.70 0.50 ag i d10 7s ag i d10 7g 0.000E+00 ( //r2// )= 0.000E+00 a0 0.0000 0.000E+00 0.000 0.000 sqrtdel= 1.0000 0.000E+00 47 -1 0.70 0.50 ag i d10 7s ag i d10 8g 0.000E+00 ( //r2// )= 0.000E+00 a0 0.0000 0.000E+00 0.000 0.000 sqrtdel= 1.0000 0.000E+00 47 -1 0.70 0.50 ag i d10 7s ag i d10 9g 0.000E+00 ( //r2// )= 0.000E+00 a0 0.0000 0.000E+00 0.000 0.000 sqrtdel= 1.0000 0.000E+00 47 -1 0.70 0.50 ag i d10 7s ag i d9 5s5g 0.000E+00 ( //r2// )= 0.000E+00 a0 0.0000 0.000E+00 0.000 0.000 sqrtdel= 1.0000 0.000E+00 47 -1 0.70 0.50 ag i d10 7s ag i d9 5s6g 0.000E+00 ( //r2// )= 0.000E+00 a0 0.0000 0.000E+00 0.000 0.000 sqrtdel= 1.0000 0.000E+00 47 -1 0.70 0.50 ag i d10 7s ag i d9 5s7g 0.000E+00 ( //r2// )= 0.000E+00 a0 0.0000 0.000E+00 0.000 0.000 sqrtdel= 1.0000 0.000E+00 47 -1 0.70 0.50 ag i d10 7s ag i d9 5s8g 0.000E+00 ( //r2// )= 0.000E+00 a0 0.0000 0.000E+00 0.000 0.000 sqrtdel= 1.0000 0.000E+00 47 -1 0.70 0.50 ag i d10 7s ag i d9 5s9g 0.000E+00 ( //r2// )= 0.000E+00 a0 0.0000 0.000E+00 0.000 0.000 sqrtdel= 1.0000 0.000E+00 47 -1 0.70 0.50 ag i d10 7s ag i d10 7i 0.000E+00 ( //r2// )= 0.000E+00 a0 0.0000 0.000E+00 0.000 0.000 sqrtdel= 1.0000 0.000E+00 47 -1 0.70 0.50 ag i d10 7s ag i d10 8i 0.000E+00 ( //r2// )= 0.000E+00 a0 0.0000 0.000E+00 0.000 0.000 sqrtdel= 1.0000 0.000E+00 47 -1 0.70 0.50 ag i d10 7s ag i d10 9i 0.000E+00 ( //r2// )= 0.000E+00 a0 0.0000 0.000E+00 0.000 0.000 sqrtdel= 1.0000 0.000E+00 47 -1 0.70 0.50 ag i d10 7s ag i d9 5s7i 0.000E+00 ( //r2// )= 0.000E+00 a0 0.0000 0.000E+00 0.000 0.000 sqrtdel= 1.0000 0.000E+00 47 -1 0.70 0.50 ag i d10 7s ag i d9 5s8i 0.000E+00 ( //r2// )= 0.000E+00 a0 0.0000 0.000E+00 0.000 0.000 sqrtdel= 1.0000 0.000E+00 47 -1 0.70 0.50 ag i d10 7s ag i d9 5s9i 0.000E+00 ( //r2// )= 0.000E+00 a0 0.0000 0.000E+00 0.000 0.000 sqrtdel= 1.0000 0.000E+00 47 -1 0.70 0.50 ag i d10 7s ag i d10 9l 0.000E+00 ( //r2// )= 0.000E+00 a0 0.0000 0.000E+00 0.000 0.000 sqrtdel= 1.0000 0.000E+00 47 -1 0.70 0.50 ag i d10 7s ag i d9 5s9l 0.000E+00 ( //r2// )= 0.000E+00 a0 0.0000 0.000E+00 0.000 0.000 sqrtdel= 1.0000 0.000E+00 47 -1 0.70 0.50 ag i d10 7s ag i d9 5p2 0.000E+00 ( //r2// )= 0.000E+00 a0 0.0000 0.000E+00 0.000 0.000 sqrtdel= 1.0000 0.000E+00 47 -1 0.70 0.50 ag i d10 8s ag i d10 5s 0.000E+00 ( //r2// )= 0.000E+00 a0 0.0000 0.000E+00 0.000 0.000 sqrtdel= 1.0000 0.000E+00 47 -1 0.70 0.50 ag i d10 8s ag i d10 6s 0.000E+00 ( //r2// )= 0.000E+00 a0 0.0000 0.000E+00 0.000 0.000 sqrtdel= 1.0000 0.000E+00 47 -1 0.70 0.50 ag i d10 8s ag i d10 7s 0.000E+00 ( //r2// )= 0.000E+00 a0 0.0000 0.000E+00 0.000 0.000 sqrtdel= 1.0000 0.000E+00 47 -1 0.70 0.50 ag i d10 8s ag i d10 8s 0.000E+00 ( //r2// )= 0.000E+00 a0 0.0000 0.000E+00 0.000 0.000 sqrtdel= 1.0000 0.000E+00 47 -1 0.70 0.50 ag i d10 8s ag i d10 9s 0.000E+00 ( //r2// )= 0.000E+00 a0 0.0000 0.000E+00 0.000 0.000 sqrtdel= 1.0000 0.000E+00 47 -1 0.70 0.50 ag i d10 8s ag i d9 5s2 0.000E+00 ( //r2// )= 0.000E+00 a0 0.0000 0.000E+00 0.000 0.000 sqrtdel= 1.0000 0.000E+00 47 -1 0.70 0.50 ag i d10 8s ag i d9 5s6s 0.000E+00 ( //r2// )= 0.000E+00 a0 0.0000 0.000E+00 0.000 0.000 sqrtdel= 1.0000 0.000E+00 47 -1 0.70 0.50 ag i d10 8s ag i d9 5s7s 0.000E+00 ( //r2// )= 0.000E+00 a0 0.0000 0.000E+00 0.000 0.000 sqrtdel= 1.0000 0.000E+00 47 -1 0.70 0.50 ag i d10 8s ag i d9 5s8s -3.169E+00 ( 4d//r2// 5s)=-3.169E+00 a0 -0.9615 6.695E-01-0.449-0.676 sqrtdel= 1.0000 -3.169E+00 47 -1 0.70 0.50 ag i d10 8s ag i d9 5s9s 0.000E+00 ( //r2// )= 0.000E+00 a0 0.0000 0.000E+00 0.000 0.000 sqrtdel= 1.0000 0.000E+00 47 -1 0.70 0.50 ag i d10 8s ag i d8 5s2 6s 0.000E+00 ( //r2// )= 0.000E+00 a0 0.0000 0.000E+00 0.000 0.000 sqrtdel= 1.0000 0.000E+00 47 -1 0.70 0.50 ag i d10 8s ag i d10 5d 5.478E+00 ( 8s//r2// 5d)= 5.478E+00 a0 0.0609 2.000E+00 0.052 0.128 sqrtdel= 1.0000 5.478E+00 47 -1 0.70 0.50 ag i d10 8s ag i d10 6d 4.557E+02 ( 8s//r2// 6d)= 4.557E+02 a0 0.8458 1.384E+04 0.314 0.426 sqrtdel= 1.0000 4.557E+02 47 -1 0.70 0.50 ag i d10 8s ag i d10 7d -1.069E+03 ( 8s//r2// 7d)=-1.069E+03 a0 -0.9921 7.615E+04-0.880-0.975 sqrtdel= 1.0000 -1.069E+03 47 -1 0.70 0.50 ag i d10 8s ag i d10 8d 1.340E+02 ( 8s//r2// 8d)= 1.340E+02 a0 0.1774 1.197E+03-0.248-0.420 sqrtdel= 1.0000 1.340E+02 47 -1 0.70 0.50 ag i d10 8s ag i d10 9d 8.492E+01 ( 8s//r2// 9d)= 8.492E+01 a0 0.1610 4.808E+02-0.130-0.301 sqrtdel= 1.0000 8.492E+01 47 -1 0.70 0.50 ag i d10 8s ag i d9 5s5d 0.000E+00 ( //r2// )= 0.000E+00 a0 0.0000 0.000E+00 0.000 0.000 sqrtdel= 1.0000 0.000E+00 47 -1 0.70 0.50 ag i d10 8s ag i d9 5s6d 0.000E+00 ( //r2// )= 0.000E+00 a0 0.0000 0.000E+00 0.000 0.000 sqrtdel= 1.0000 0.000E+00 47 -1 0.70 0.50 ag i d10 8s ag i d9 5s7d 0.000E+00 ( //r2// )= 0.000E+00 a0 0.0000 0.000E+00 0.000 0.000 sqrtdel= 1.0000 0.000E+00 47 -1 0.70 0.50 ag i d10 8s ag i d9 5s8d 0.000E+00 ( //r2// )= 0.000E+00 a0 0.0000 0.000E+00 0.000 0.000 sqrtdel= 1.0000 0.000E+00 47 -1 0.70 0.50 ag i d10 8s ag i d9 5s9d 0.000E+00 ( //r2// )= 0.000E+00 a0 0.0000 0.000E+00 0.000 0.000 sqrtdel= 1.0000 0.000E+00 47 -1 0.70 0.50 ag i d10 8s ag i d8 5s2 5d 0.000E+00 ( //r2// )= 0.000E+00 a0 0.0000 0.000E+00 0.000 0.000 sqrtdel= 1.0000 0.000E+00 47 -1 0.70 0.50 ag i d10 8s ag i d10 5g 0.000E+00 ( //r2// )= 0.000E+00 a0 0.0000 0.000E+00 0.000 0.000 sqrtdel= 1.0000 0.000E+00 47 -1 0.70 0.50 ag i d10 8s ag i d10 6g 0.000E+00 ( //r2// )= 0.000E+00 a0 0.0000 0.000E+00 0.000 0.000 sqrtdel= 1.0000 0.000E+00 47 -1 0.70 0.50 ag i d10 8s ag i d10 7g 0.000E+00 ( //r2// )= 0.000E+00 a0 0.0000 0.000E+00 0.000 0.000 sqrtdel= 1.0000 0.000E+00 47 -1 0.70 0.50 ag i d10 8s ag i d10 8g 0.000E+00 ( //r2// )= 0.000E+00 a0 0.0000 0.000E+00 0.000 0.000 sqrtdel= 1.0000 0.000E+00 47 -1 0.70 0.50 ag i d10 8s ag i d10 9g 0.000E+00 ( //r2// )= 0.000E+00 a0 0.0000 0.000E+00 0.000 0.000 sqrtdel= 1.0000 0.000E+00 47 -1 0.70 0.50 ag i d10 8s ag i d9 5s5g 0.000E+00 ( //r2// )= 0.000E+00 a0 0.0000 0.000E+00 0.000 0.000 sqrtdel= 1.0000 0.000E+00 47 -1 0.70 0.50 ag i d10 8s ag i d9 5s6g 0.000E+00 ( //r2// )= 0.000E+00 a0 0.0000 0.000E+00 0.000 0.000 sqrtdel= 1.0000 0.000E+00 47 -1 0.70 0.50 ag i d10 8s ag i d9 5s7g 0.000E+00 ( //r2// )= 0.000E+00 a0 0.0000 0.000E+00 0.000 0.000 sqrtdel= 1.0000 0.000E+00 47 -1 0.70 0.50 ag i d10 8s ag i d9 5s8g 0.000E+00 ( //r2// )= 0.000E+00 a0 0.0000 0.000E+00 0.000 0.000 sqrtdel= 1.0000 0.000E+00 47 -1 0.70 0.50 ag i d10 8s ag i d9 5s9g 0.000E+00 ( //r2// )= 0.000E+00 a0 0.0000 0.000E+00 0.000 0.000 sqrtdel= 1.0000 0.000E+00 47 -1 0.70 0.50 ag i d10 8s ag i d10 7i 0.000E+00 ( //r2// )= 0.000E+00 a0 0.0000 0.000E+00 0.000 0.000 sqrtdel= 1.0000 0.000E+00 47 -1 0.70 0.50 ag i d10 8s ag i d10 8i 0.000E+00 ( //r2// )= 0.000E+00 a0 0.0000 0.000E+00 0.000 0.000 sqrtdel= 1.0000 0.000E+00 47 -1 0.70 0.50 ag i d10 8s ag i d10 9i 0.000E+00 ( //r2// )= 0.000E+00 a0 0.0000 0.000E+00 0.000 0.000 sqrtdel= 1.0000 0.000E+00 47 -1 0.70 0.50 ag i d10 8s ag i d9 5s7i 0.000E+00 ( //r2// )= 0.000E+00 a0 0.0000 0.000E+00 0.000 0.000 sqrtdel= 1.0000 0.000E+00 47 -1 0.70 0.50 ag i d10 8s ag i d9 5s8i 0.000E+00 ( //r2// )= 0.000E+00 a0 0.0000 0.000E+00 0.000 0.000 sqrtdel= 1.0000 0.000E+00 47 -1 0.70 0.50 ag i d10 8s ag i d9 5s9i 0.000E+00 ( //r2// )= 0.000E+00 a0 0.0000 0.000E+00 0.000 0.000 sqrtdel= 1.0000 0.000E+00 47 -1 0.70 0.50 ag i d10 8s ag i d10 9l 0.000E+00 ( //r2// )= 0.000E+00 a0 0.0000 0.000E+00 0.000 0.000 sqrtdel= 1.0000 0.000E+00 47 -1 0.70 0.50 ag i d10 8s ag i d9 5s9l 0.000E+00 ( //r2// )= 0.000E+00 a0 0.0000 0.000E+00 0.000 0.000 sqrtdel= 1.0000 0.000E+00 47 -1 0.70 0.50 ag i d10 8s ag i d9 5p2 0.000E+00 ( //r2// )= 0.000E+00 a0 0.0000 0.000E+00 0.000 0.000 sqrtdel= 1.0000 0.000E+00 47 -1 0.70 0.50 ag i d10 9s ag i d10 5s 0.000E+00 ( //r2// )= 0.000E+00 a0 0.0000 0.000E+00 0.000 0.000 sqrtdel= 1.0000 0.000E+00 47 -1 0.70 0.50 ag i d10 9s ag i d10 6s 0.000E+00 ( //r2// )= 0.000E+00 a0 0.0000 0.000E+00 0.000 0.000 sqrtdel= 1.0000 0.000E+00 47 -1 0.70 0.50 ag i d10 9s ag i d10 7s 0.000E+00 ( //r2// )= 0.000E+00 a0 0.0000 0.000E+00 0.000 0.000 sqrtdel= 1.0000 0.000E+00 47 -1 0.70 0.50 ag i d10 9s ag i d10 8s 0.000E+00 ( //r2// )= 0.000E+00 a0 0.0000 0.000E+00 0.000 0.000 sqrtdel= 1.0000 0.000E+00 47 -1 0.70 0.50 ag i d10 9s ag i d10 9s 0.000E+00 ( //r2// )= 0.000E+00 a0 0.0000 0.000E+00 0.000 0.000 sqrtdel= 1.0000 0.000E+00 47 -1 0.70 0.50 ag i d10 9s ag i d9 5s2 0.000E+00 ( //r2// )= 0.000E+00 a0 0.0000 0.000E+00 0.000 0.000 sqrtdel= 1.0000 0.000E+00 47 -1 0.70 0.50 ag i d10 9s ag i d9 5s6s 0.000E+00 ( //r2// )= 0.000E+00 a0 0.0000 0.000E+00 0.000 0.000 sqrtdel= 1.0000 0.000E+00 47 -1 0.70 0.50 ag i d10 9s ag i d9 5s7s 0.000E+00 ( //r2// )= 0.000E+00 a0 0.0000 0.000E+00 0.000 0.000 sqrtdel= 1.0000 0.000E+00 47 -1 0.70 0.50 ag i d10 9s ag i d9 5s8s 0.000E+00 ( //r2// )= 0.000E+00 a0 0.0000 0.000E+00 0.000 0.000 sqrtdel= 1.0000 0.000E+00 47 -1 0.70 0.50 ag i d10 9s ag i d9 5s9s -3.167E+00 ( 4d//r2// 5s)=-3.167E+00 a0 -0.9615 6.687E-01-0.449-0.676 sqrtdel= 1.0000 -3.167E+00 47 -1 0.70 0.50 ag i d10 9s ag i d8 5s2 6s 0.000E+00 ( //r2// )= 0.000E+00 a0 0.0000 0.000E+00 0.000 0.000 sqrtdel= 1.0000 0.000E+00 47 -1 0.70 0.50 ag i d10 9s ag i d10 5d 1.935E+00 ( 9s//r2// 5d)= 1.935E+00 a0 0.0319 2.495E-01 0.026 0.091 sqrtdel= 1.0000 1.935E+00 47 -1 0.70 0.50 ag i d10 9s ag i d10 6d 1.339E+01 ( 9s//r2// 6d)= 1.339E+01 a0 0.0380 1.195E+01 0.081 0.173 sqrtdel= 1.0000 1.339E+01 47 -1 0.70 0.50 ag i d10 9s ag i d10 7d 1.175E+03 ( 9s//r2// 7d)= 1.175E+03 a0 0.8563 9.210E+04 0.373 0.492 sqrtdel= 1.0000 1.175E+03 47 -1 0.70 0.50 ag i d10 9s ag i d10 8d -2.303E+03 ( 9s//r2// 8d)=-2.303E+03 a0 -0.9841 3.536E+05-0.848-0.960 sqrtdel= 1.0000 -2.303E+03 47 -1 0.70 0.50 ag i d10 9s ag i d10 9d 2.241E+02 ( 9s//r2// 9d)= 2.241E+02 a0 0.1321 3.348E+03-0.258-0.417 sqrtdel= 1.0000 2.241E+02 47 -1 0.70 0.50 ag i d10 9s ag i d9 5s5d 0.000E+00 ( //r2// )= 0.000E+00 a0 0.0000 0.000E+00 0.000 0.000 sqrtdel= 1.0000 0.000E+00 47 -1 0.70 0.50 ag i d10 9s ag i d9 5s6d 0.000E+00 ( //r2// )= 0.000E+00 a0 0.0000 0.000E+00 0.000 0.000 sqrtdel= 1.0000 0.000E+00 47 -1 0.70 0.50 ag i d10 9s ag i d9 5s7d 0.000E+00 ( //r2// )= 0.000E+00 a0 0.0000 0.000E+00 0.000 0.000 sqrtdel= 1.0000 0.000E+00 47 -1 0.70 0.50 ag i d10 9s ag i d9 5s8d 0.000E+00 ( //r2// )= 0.000E+00 a0 0.0000 0.000E+00 0.000 0.000 sqrtdel= 1.0000 0.000E+00 47 -1 0.70 0.50 ag i d10 9s ag i d9 5s9d 0.000E+00 ( //r2// )= 0.000E+00 a0 0.0000 0.000E+00 0.000 0.000 sqrtdel= 1.0000 0.000E+00 47 -1 0.70 0.50 ag i d10 9s ag i d8 5s2 5d 0.000E+00 ( //r2// )= 0.000E+00 a0 0.0000 0.000E+00 0.000 0.000 sqrtdel= 1.0000 0.000E+00 47 -1 0.70 0.50 ag i d10 9s ag i d10 5g 0.000E+00 ( //r2// )= 0.000E+00 a0 0.0000 0.000E+00 0.000 0.000 sqrtdel= 1.0000 0.000E+00 47 -1 0.70 0.50 ag i d10 9s ag i d10 6g 0.000E+00 ( //r2// )= 0.000E+00 a0 0.0000 0.000E+00 0.000 0.000 sqrtdel= 1.0000 0.000E+00 47 -1 0.70 0.50 ag i d10 9s ag i d10 7g 0.000E+00 ( //r2// )= 0.000E+00 a0 0.0000 0.000E+00 0.000 0.000 sqrtdel= 1.0000 0.000E+00 47 -1 0.70 0.50 ag i d10 9s ag i d10 8g 0.000E+00 ( //r2// )= 0.000E+00 a0 0.0000 0.000E+00 0.000 0.000 sqrtdel= 1.0000 0.000E+00 47 -1 0.70 0.50 ag i d10 9s ag i d10 9g 0.000E+00 ( //r2// )= 0.000E+00 a0 0.0000 0.000E+00 0.000 0.000 sqrtdel= 1.0000 0.000E+00 47 -1 0.70 0.50 ag i d10 9s ag i d9 5s5g 0.000E+00 ( //r2// )= 0.000E+00 a0 0.0000 0.000E+00 0.000 0.000 sqrtdel= 1.0000 0.000E+00 47 -1 0.70 0.50 ag i d10 9s ag i d9 5s6g 0.000E+00 ( //r2// )= 0.000E+00 a0 0.0000 0.000E+00 0.000 0.000 sqrtdel= 1.0000 0.000E+00 47 -1 0.70 0.50 ag i d10 9s ag i d9 5s7g 0.000E+00 ( //r2// )= 0.000E+00 a0 0.0000 0.000E+00 0.000 0.000 sqrtdel= 1.0000 0.000E+00 47 -1 0.70 0.50 ag i d10 9s ag i d9 5s8g 0.000E+00 ( //r2// )= 0.000E+00 a0 0.0000 0.000E+00 0.000 0.000 sqrtdel= 1.0000 0.000E+00 47 -1 0.70 0.50 ag i d10 9s ag i d9 5s9g 0.000E+00 ( //r2// )= 0.000E+00 a0 0.0000 0.000E+00 0.000 0.000 sqrtdel= 1.0000 0.000E+00 47 -1 0.70 0.50 ag i d10 9s ag i d10 7i 0.000E+00 ( //r2// )= 0.000E+00 a0 0.0000 0.000E+00 0.000 0.000 sqrtdel= 1.0000 0.000E+00 47 -1 0.70 0.50 ag i d10 9s ag i d10 8i 0.000E+00 ( //r2// )= 0.000E+00 a0 0.0000 0.000E+00 0.000 0.000 sqrtdel= 1.0000 0.000E+00 47 -1 0.70 0.50 ag i d10 9s ag i d10 9i 0.000E+00 ( //r2// )= 0.000E+00 a0 0.0000 0.000E+00 0.000 0.000 sqrtdel= 1.0000 0.000E+00 47 -1 0.70 0.50 ag i d10 9s ag i d9 5s7i 0.000E+00 ( //r2// )= 0.000E+00 a0 0.0000 0.000E+00 0.000 0.000 sqrtdel= 1.0000 0.000E+00 47 -1 0.70 0.50 ag i d10 9s ag i d9 5s8i 0.000E+00 ( //r2// )= 0.000E+00 a0 0.0000 0.000E+00 0.000 0.000 sqrtdel= 1.0000 0.000E+00 47 -1 0.70 0.50 ag i d10 9s ag i d9 5s9i 0.000E+00 ( //r2// )= 0.000E+00 a0 0.0000 0.000E+00 0.000 0.000 sqrtdel= 1.0000 0.000E+00 47 -1 0.70 0.50 ag i d10 9s ag i d10 9l 0.000E+00 ( //r2// )= 0.000E+00 a0 0.0000 0.000E+00 0.000 0.000 sqrtdel= 1.0000 0.000E+00 47 -1 0.70 0.50 ag i d10 9s ag i d9 5s9l 0.000E+00 ( //r2// )= 0.000E+00 a0 0.0000 0.000E+00 0.000 0.000 sqrtdel= 1.0000 0.000E+00 47 -1 0.70 0.50 ag i d10 9s ag i d9 5p2 0.000E+00 ( //r2// )= 0.000E+00 a0 0.0000 0.000E+00 0.000 0.000 sqrtdel= 1.0000 0.000E+00 47 -1 0.70 0.50 ag i d9 5s2 ag i d10 5s -3.464E+00 ( 5s//r2// 4d)=-3.464E+00 a0 -0.9682 7.997E-01-0.445-0.698 sqrtdel= 1.0000 -3.464E+00 47 -1 0.70 0.50 ag i d9 5s2 ag i d10 6s 0.000E+00 ( //r2// )= 0.000E+00 a0 0.0000 0.000E+00 0.000 0.000 sqrtdel= 1.0000 0.000E+00 47 -1 0.70 0.50 ag i d9 5s2 ag i d10 7s 0.000E+00 ( //r2// )= 0.000E+00 a0 0.0000 0.000E+00 0.000 0.000 sqrtdel= 1.0000 0.000E+00 47 -1 0.70 0.50 ag i d9 5s2 ag i d10 8s 0.000E+00 ( //r2// )= 0.000E+00 a0 0.0000 0.000E+00 0.000 0.000 sqrtdel= 1.0000 0.000E+00 47 -1 0.70 0.50 ag i d9 5s2 ag i d10 9s 0.000E+00 ( //r2// )= 0.000E+00 a0 0.0000 0.000E+00 0.000 0.000 sqrtdel= 1.0000 0.000E+00 47 -1 0.70 0.50 ag i d9 5s2 ag i d9 5s2 2.241E+00 ( 4d//r2// 4d)=-2.678E+00 a0 1.0000 3.347E-01 1.000 1.000 sqrtdel= 1.0000 -2.678E+00 47 -1 0.70 0.50 ag i d9 5s2 ag i d9 5s6s 0.000E+00 ( //r2// )= 0.000E+00 a0 0.0000 0.000E+00 0.000 0.000 sqrtdel= 1.0000 0.000E+00 47 -1 0.70 0.50 ag i d9 5s2 ag i d9 5s7s 0.000E+00 ( //r2// )= 0.000E+00 a0 0.0000 0.000E+00 0.000 0.000 sqrtdel= 1.0000 0.000E+00 47 -1 0.70 0.50 ag i d9 5s2 ag i d9 5s8s 0.000E+00 ( //r2// )= 0.000E+00 a0 0.0000 0.000E+00 0.000 0.000 sqrtdel= 1.0000 0.000E+00 47 -1 0.70 0.50 ag i d9 5s2 ag i d9 5s9s 0.000E+00 ( //r2// )= 0.000E+00 a0 0.0000 0.000E+00 0.000 0.000 sqrtdel= 1.0000 0.000E+00 47 -1 0.70 0.50 ag i d9 5s2 ag i d8 5s2 6s -3.060E-02 ( 4d//r2// 6s)=-3.060E-02 a0 -0.0287 6.244E-05-0.081-0.440 sqrtdel= 1.0000 -3.060E-02 47 -1 0.70 0.50 ag i d9 5s2 ag i d10 5d 0.000E+00 ( //r2// )= 0.000E+00 a0 0.0000 0.000E+00 0.000 0.000 sqrtdel= 1.0000 0.000E+00 47 -1 0.70 0.50 ag i d9 5s2 ag i d10 6d 0.000E+00 ( //r2// )= 0.000E+00 a0 0.0000 0.000E+00 0.000 0.000 sqrtdel= 1.0000 0.000E+00 47 -1 0.70 0.50 ag i d9 5s2 ag i d10 7d 0.000E+00 ( //r2// )= 0.000E+00 a0 0.0000 0.000E+00 0.000 0.000 sqrtdel= 1.0000 0.000E+00 47 -1 0.70 0.50 ag i d9 5s2 ag i d10 8d 0.000E+00 ( //r2// )= 0.000E+00 a0 0.0000 0.000E+00 0.000 0.000 sqrtdel= 1.0000 0.000E+00 47 -1 0.70 0.50 ag i d9 5s2 ag i d10 9d 0.000E+00 ( //r2// )= 0.000E+00 a0 0.0000 0.000E+00 0.000 0.000 sqrtdel= 1.0000 0.000E+00 47 -1 0.70 0.50 ag i d9 5s2 ag i d9 5s5d 8.933E+00 ( 5s//r2// 5d)= 8.933E+00 a0 0.9972 5.320E+00 0.304 0.964 sqrtdel= 1.0000 8.933E+00 47 -1 0.70 0.50 ag i d9 5s2 ag i d9 5s6d 4.813E+00 ( 5s//r2// 6d)= 4.813E+00 a0 0.9527 1.545E+00 0.200 0.956 sqrtdel= 1.0000 4.813E+00 47 -1 0.70 0.50 ag i d9 5s2 ag i d9 5s7d 3.115E+00 ( 5s//r2// 7d)= 3.115E+00 a0 0.9086 6.471E-01 0.143 0.949 sqrtdel= 1.0000 3.115E+00 47 -1 0.70 0.50 ag i d9 5s2 ag i d9 5s8d 2.230E+00 ( 5s//r2// 8d)= 2.230E+00 a0 0.8797 3.316E-01 0.108 0.943 sqrtdel= 1.0000 2.230E+00 47 -1 0.70 0.50 ag i d9 5s2 ag i d9 5s9d 1.700E+00 ( 5s//r2// 9d)= 1.700E+00 a0 0.8598 1.926E-01 0.085 0.940 sqrtdel= 1.0000 1.700E+00 47 -1 0.70 0.50 ag i d9 5s2 ag i d8 5s2 5d -6.327E-01 ( 4d//r2// 5d)= 7.562E-01 a0 -0.7873 2.669E-02 0.020 0.186 sqrtdel= 1.0000 7.562E-01 47 -1 0.70 0.50 ag i d9 5s2 ag i d10 5g 0.000E+00 ( //r2// )= 0.000E+00 a0 0.0000 0.000E+00 0.000 0.000 sqrtdel= 1.0000 0.000E+00 47 -1 0.70 0.50 ag i d9 5s2 ag i d10 6g 0.000E+00 ( //r2// )= 0.000E+00 a0 0.0000 0.000E+00 0.000 0.000 sqrtdel= 1.0000 0.000E+00 47 -1 0.70 0.50 ag i d9 5s2 ag i d10 7g 0.000E+00 ( //r2// )= 0.000E+00 a0 0.0000 0.000E+00 0.000 0.000 sqrtdel= 1.0000 0.000E+00 47 -1 0.70 0.50 ag i d9 5s2 ag i d10 8g 0.000E+00 ( //r2// )= 0.000E+00 a0 0.0000 0.000E+00 0.000 0.000 sqrtdel= 1.0000 0.000E+00 47 -1 0.70 0.50 ag i d9 5s2 ag i d10 9g 0.000E+00 ( //r2// )= 0.000E+00 a0 0.0000 0.000E+00 0.000 0.000 sqrtdel= 1.0000 0.000E+00 47 -1 0.70 0.50 ag i d9 5s2 ag i d9 5s5g 0.000E+00 ( //r2// )= 0.000E+00 a0 0.0000 0.000E+00 0.000 0.000 sqrtdel= 1.0000 0.000E+00 47 -1 0.70 0.50 ag i d9 5s2 ag i d9 5s6g 0.000E+00 ( //r2// )= 0.000E+00 a0 0.0000 0.000E+00 0.000 0.000 sqrtdel= 1.0000 0.000E+00 47 -1 0.70 0.50 ag i d9 5s2 ag i d9 5s7g 0.000E+00 ( //r2// )= 0.000E+00 a0 0.0000 0.000E+00 0.000 0.000 sqrtdel= 1.0000 0.000E+00 47 -1 0.70 0.50 ag i d9 5s2 ag i d9 5s8g 0.000E+00 ( //r2// )= 0.000E+00 a0 0.0000 0.000E+00 0.000 0.000 sqrtdel= 1.0000 0.000E+00 47 -1 0.70 0.50 ag i d9 5s2 ag i d9 5s9g 0.000E+00 ( //r2// )= 0.000E+00 a0 0.0000 0.000E+00 0.000 0.000 sqrtdel= 1.0000 0.000E+00 47 -1 0.70 0.50 ag i d9 5s2 ag i d10 7i 0.000E+00 ( //r2// )= 0.000E+00 a0 0.0000 0.000E+00 0.000 0.000 sqrtdel= 1.0000 0.000E+00 47 -1 0.70 0.50 ag i d9 5s2 ag i d10 8i 0.000E+00 ( //r2// )= 0.000E+00 a0 0.0000 0.000E+00 0.000 0.000 sqrtdel= 1.0000 0.000E+00 47 -1 0.70 0.50 ag i d9 5s2 ag i d10 9i 0.000E+00 ( //r2// )= 0.000E+00 a0 0.0000 0.000E+00 0.000 0.000 sqrtdel= 1.0000 0.000E+00 47 -1 0.70 0.50 ag i d9 5s2 ag i d9 5s7i 0.000E+00 ( //r2// )= 0.000E+00 a0 0.0000 0.000E+00 0.000 0.000 sqrtdel= 1.0000 0.000E+00 47 -1 0.70 0.50 ag i d9 5s2 ag i d9 5s8i 0.000E+00 ( //r2// )= 0.000E+00 a0 0.0000 0.000E+00 0.000 0.000 sqrtdel= 1.0000 0.000E+00 47 -1 0.70 0.50 ag i d9 5s2 ag i d9 5s9i 0.000E+00 ( //r2// )= 0.000E+00 a0 0.0000 0.000E+00 0.000 0.000 sqrtdel= 1.0000 0.000E+00 47 -1 0.70 0.50 ag i d9 5s2 ag i d10 9l 0.000E+00 ( //r2// )= 0.000E+00 a0 0.0000 0.000E+00 0.000 0.000 sqrtdel= 1.0000 0.000E+00 47 -1 0.70 0.50 ag i d9 5s2 ag i d9 5s9l 0.000E+00 ( //r2// )= 0.000E+00 a0 0.0000 0.000E+00 0.000 0.000 sqrtdel= 1.0000 0.000E+00 47 -1 0.70 0.50 ag i d9 5s2 ag i d9 5p2 0.000E+00 ( //r2// )= 0.000E+00 a0 0.0000 0.000E+00 0.000 0.000 sqrtdel= 1.0000 0.000E+00 47 -1 0.70 0.50 ag i d9 5s6s ag i d10 5s 1.053E-01 ( 6s//r2// 4d)= 1.053E-01 a0 0.0771 7.392E-04-0.086-0.444 sqrtdel= 1.0000 1.053E-01 47 -1 0.70 0.50 ag i d9 5s6s ag i d10 6s -3.190E+00 ( 5s//r2// 4d)=-3.190E+00 a0 -0.9620 6.782E-01-0.449-0.678 sqrtdel= 1.0000 -3.190E+00 47 -1 0.70 0.50 ag i d9 5s6s ag i d10 7s 0.000E+00 ( //r2// )= 0.000E+00 a0 0.0000 0.000E+00 0.000 0.000 sqrtdel= 1.0000 0.000E+00 47 -1 0.70 0.50 ag i d9 5s6s ag i d10 8s 0.000E+00 ( //r2// )= 0.000E+00 a0 0.0000 0.000E+00 0.000 0.000 sqrtdel= 1.0000 0.000E+00 47 -1 0.70 0.50 ag i d9 5s6s ag i d10 9s 0.000E+00 ( //r2// )= 0.000E+00 a0 0.0000 0.000E+00 0.000 0.000 sqrtdel= 1.0000 0.000E+00 47 -1 0.70 0.50 ag i d9 5s6s ag i d9 5s2 0.000E+00 ( //r2// )= 0.000E+00 a0 0.0000 0.000E+00 0.000 0.000 sqrtdel= 1.0000 0.000E+00 47 -1 0.70 0.50 ag i d9 5s6s ag i d9 5s6s 2.176E+00 ( 4d//r2// 4d)=-2.601E+00 a0 1.0000 3.156E-01 1.000 1.000 sqrtdel= 1.0000 -2.601E+00 47 -1 0.70 0.50 ag i d9 5s6s ag i d9 5s7s 0.000E+00 ( //r2// )= 0.000E+00 a0 0.0000 0.000E+00 0.000 0.000 sqrtdel= 1.0000 0.000E+00 47 -1 0.70 0.50 ag i d9 5s6s ag i d9 5s8s 0.000E+00 ( //r2// )= 0.000E+00 a0 0.0000 0.000E+00 0.000 0.000 sqrtdel= 1.0000 0.000E+00 47 -1 0.70 0.50 ag i d9 5s6s ag i d9 5s9s 0.000E+00 ( //r2// )= 0.000E+00 a0 0.0000 0.000E+00 0.000 0.000 sqrtdel= 1.0000 0.000E+00 47 -1 0.70 0.50 ag i d9 5s6s ag i d8 5s2 6s -2.808E+00 ( 4d//r2// 5s)=-2.808E+00 a0 -0.9548 5.256E-01-0.423-0.648 sqrtdel= 1.0000 -2.808E+00 47 -1 0.70 0.50 ag i d9 5s6s ag i d10 5d 0.000E+00 ( //r2// )= 0.000E+00 a0 0.0000 0.000E+00 0.000 0.000 sqrtdel= 1.0000 0.000E+00 47 -1 0.70 0.50 ag i d9 5s6s ag i d10 6d 0.000E+00 ( //r2// )= 0.000E+00 a0 0.0000 0.000E+00 0.000 0.000 sqrtdel= 1.0000 0.000E+00 47 -1 0.70 0.50 ag i d9 5s6s ag i d10 7d 0.000E+00 ( //r2// )= 0.000E+00 a0 0.0000 0.000E+00 0.000 0.000 sqrtdel= 1.0000 0.000E+00 47 -1 0.70 0.50 ag i d9 5s6s ag i d10 8d 0.000E+00 ( //r2// )= 0.000E+00 a0 0.0000 0.000E+00 0.000 0.000 sqrtdel= 1.0000 0.000E+00 47 -1 0.70 0.50 ag i d9 5s6s ag i d10 9d 0.000E+00 ( //r2// )= 0.000E+00 a0 0.0000 0.000E+00 0.000 0.000 sqrtdel= 1.0000 0.000E+00 47 -1 0.70 0.50 ag i d9 5s6s ag i d9 5s5d -9.752E+01 ( 6s//r2// 5d)=-9.752E+01 a0 -0.9978 6.340E+02-0.925-0.967 sqrtdel= 1.0000 -9.752E+01 47 -1 0.70 0.50 ag i d9 5s6s ag i d9 5s6d 3.063E+01 ( 6s//r2// 6d)= 3.063E+01 a0 0.4720 6.254E+01-0.129-0.276 sqrtdel= 1.0000 3.063E+01 47 -1 0.70 0.50 ag i d9 5s6s ag i d9 5s7d 1.852E+01 ( 6s//r2// 7d)= 1.852E+01 a0 0.4567 2.287E+01-0.033-0.106 sqrtdel= 1.0000 1.852E+01 47 -1 0.70 0.50 ag i d9 5s6s ag i d9 5s8d 1.248E+01 ( 6s//r2// 8d)= 1.248E+01 a0 0.4231 1.039E+01-0.007-0.030 sqrtdel= 1.0000 1.248E+01 47 -1 0.70 0.50 ag i d9 5s6s ag i d9 5s9d 9.173E+00 ( 6s//r2// 9d)= 9.173E+00 a0 0.4011 5.610E+00 0.002 0.013 sqrtdel= 1.0000 9.173E+00 47 -1 0.70 0.50 ag i d9 5s6s ag i d8 5s2 5d 0.000E+00 ( //r2// )= 0.000E+00 a0 0.0000 0.000E+00 0.000 0.000 sqrtdel= 1.0000 0.000E+00 47 -1 0.70 0.50 ag i d9 5s6s ag i d10 5g 0.000E+00 ( //r2// )= 0.000E+00 a0 0.0000 0.000E+00 0.000 0.000 sqrtdel= 1.0000 0.000E+00 47 -1 0.70 0.50 ag i d9 5s6s ag i d10 6g 0.000E+00 ( //r2// )= 0.000E+00 a0 0.0000 0.000E+00 0.000 0.000 sqrtdel= 1.0000 0.000E+00 47 -1 0.70 0.50 ag i d9 5s6s ag i d10 7g 0.000E+00 ( //r2// )= 0.000E+00 a0 0.0000 0.000E+00 0.000 0.000 sqrtdel= 1.0000 0.000E+00 47 -1 0.70 0.50 ag i d9 5s6s ag i d10 8g 0.000E+00 ( //r2// )= 0.000E+00 a0 0.0000 0.000E+00 0.000 0.000 sqrtdel= 1.0000 0.000E+00 47 -1 0.70 0.50 ag i d9 5s6s ag i d10 9g 0.000E+00 ( //r2// )= 0.000E+00 a0 0.0000 0.000E+00 0.000 0.000 sqrtdel= 1.0000 0.000E+00 47 -1 0.70 0.50 ag i d9 5s6s ag i d9 5s5g 0.000E+00 ( //r2// )= 0.000E+00 a0 0.0000 0.000E+00 0.000 0.000 sqrtdel= 1.0000 0.000E+00 47 -1 0.70 0.50 ag i d9 5s6s ag i d9 5s6g 0.000E+00 ( //r2// )= 0.000E+00 a0 0.0000 0.000E+00 0.000 0.000 sqrtdel= 1.0000 0.000E+00 47 -1 0.70 0.50 ag i d9 5s6s ag i d9 5s7g 0.000E+00 ( //r2// )= 0.000E+00 a0 0.0000 0.000E+00 0.000 0.000 sqrtdel= 1.0000 0.000E+00 47 -1 0.70 0.50 ag i d9 5s6s ag i d9 5s8g 0.000E+00 ( //r2// )= 0.000E+00 a0 0.0000 0.000E+00 0.000 0.000 sqrtdel= 1.0000 0.000E+00 47 -1 0.70 0.50 ag i d9 5s6s ag i d9 5s9g 0.000E+00 ( //r2// )= 0.000E+00 a0 0.0000 0.000E+00 0.000 0.000 sqrtdel= 1.0000 0.000E+00 47 -1 0.70 0.50 ag i d9 5s6s ag i d10 7i 0.000E+00 ( //r2// )= 0.000E+00 a0 0.0000 0.000E+00 0.000 0.000 sqrtdel= 1.0000 0.000E+00 47 -1 0.70 0.50 ag i d9 5s6s ag i d10 8i 0.000E+00 ( //r2// )= 0.000E+00 a0 0.0000 0.000E+00 0.000 0.000 sqrtdel= 1.0000 0.000E+00 47 -1 0.70 0.50 ag i d9 5s6s ag i d10 9i 0.000E+00 ( //r2// )= 0.000E+00 a0 0.0000 0.000E+00 0.000 0.000 sqrtdel= 1.0000 0.000E+00 47 -1 0.70 0.50 ag i d9 5s6s ag i d9 5s7i 0.000E+00 ( //r2// )= 0.000E+00 a0 0.0000 0.000E+00 0.000 0.000 sqrtdel= 1.0000 0.000E+00 47 -1 0.70 0.50 ag i d9 5s6s ag i d9 5s8i 0.000E+00 ( //r2// )= 0.000E+00 a0 0.0000 0.000E+00 0.000 0.000 sqrtdel= 1.0000 0.000E+00 47 -1 0.70 0.50 ag i d9 5s6s ag i d9 5s9i 0.000E+00 ( //r2// )= 0.000E+00 a0 0.0000 0.000E+00 0.000 0.000 sqrtdel= 1.0000 0.000E+00 47 -1 0.70 0.50 ag i d9 5s6s ag i d10 9l 0.000E+00 ( //r2// )= 0.000E+00 a0 0.0000 0.000E+00 0.000 0.000 sqrtdel= 1.0000 0.000E+00 47 -1 0.70 0.50 ag i d9 5s6s ag i d9 5s9l 0.000E+00 ( //r2// )= 0.000E+00 a0 0.0000 0.000E+00 0.000 0.000 sqrtdel= 1.0000 0.000E+00 47 -1 0.70 0.50 ag i d9 5s6s ag i d9 5p2 0.000E+00 ( //r2// )= 0.000E+00 a0 0.0000 0.000E+00 0.000 0.000 sqrtdel= 1.0000 0.000E+00 47 -1 0.70 0.50 ag i d9 5s7s ag i d10 5s 5.577E-02 ( 7s//r2// 4d)= 5.577E-02 a0 0.0731 2.074E-04-0.047-0.421 sqrtdel= 1.0000 5.577E-02 47 -1 0.70 0.50 ag i d9 5s7s ag i d10 6s 0.000E+00 ( //r2// )= 0.000E+00 a0 0.0000 0.000E+00 0.000 0.000 sqrtdel= 1.0000 0.000E+00 47 -1 0.70 0.50 ag i d9 5s7s ag i d10 7s -3.173E+00 ( 5s//r2// 4d)=-3.173E+00 a0 -0.9616 6.713E-01-0.449-0.676 sqrtdel= 1.0000 -3.173E+00 47 -1 0.70 0.50 ag i d9 5s7s ag i d10 8s 0.000E+00 ( //r2// )= 0.000E+00 a0 0.0000 0.000E+00 0.000 0.000 sqrtdel= 1.0000 0.000E+00 47 -1 0.70 0.50 ag i d9 5s7s ag i d10 9s 0.000E+00 ( //r2// )= 0.000E+00 a0 0.0000 0.000E+00 0.000 0.000 sqrtdel= 1.0000 0.000E+00 47 -1 0.70 0.50 ag i d9 5s7s ag i d9 5s2 0.000E+00 ( //r2// )= 0.000E+00 a0 0.0000 0.000E+00 0.000 0.000 sqrtdel= 1.0000 0.000E+00 47 -1 0.70 0.50 ag i d9 5s7s ag i d9 5s6s 0.000E+00 ( //r2// )= 0.000E+00 a0 0.0000 0.000E+00 0.000 0.000 sqrtdel= 1.0000 0.000E+00 47 -1 0.70 0.50 ag i d9 5s7s ag i d9 5s7s 2.172E+00 ( 4d//r2// 4d)=-2.596E+00 a0 1.0000 3.145E-01 1.000 1.000 sqrtdel= 1.0000 -2.596E+00 47 -1 0.70 0.50 ag i d9 5s7s ag i d9 5s8s 0.000E+00 ( //r2// )= 0.000E+00 a0 0.0000 0.000E+00 0.000 0.000 sqrtdel= 1.0000 0.000E+00 47 -1 0.70 0.50 ag i d9 5s7s ag i d9 5s9s 0.000E+00 ( //r2// )= 0.000E+00 a0 0.0000 0.000E+00 0.000 0.000 sqrtdel= 1.0000 0.000E+00 47 -1 0.70 0.50 ag i d9 5s7s ag i d8 5s2 6s 0.000E+00 ( //r2// )= 0.000E+00 a0 0.0000 0.000E+00 0.000 0.000 sqrtdel= 1.0000 0.000E+00 47 -1 0.70 0.50 ag i d9 5s7s ag i d10 5d 0.000E+00 ( //r2// )= 0.000E+00 a0 0.0000 0.000E+00 0.000 0.000 sqrtdel= 1.0000 0.000E+00 47 -1 0.70 0.50 ag i d9 5s7s ag i d10 6d 0.000E+00 ( //r2// )= 0.000E+00 a0 0.0000 0.000E+00 0.000 0.000 sqrtdel= 1.0000 0.000E+00 47 -1 0.70 0.50 ag i d9 5s7s ag i d10 7d 0.000E+00 ( //r2// )= 0.000E+00 a0 0.0000 0.000E+00 0.000 0.000 sqrtdel= 1.0000 0.000E+00 47 -1 0.70 0.50 ag i d9 5s7s ag i d10 8d 0.000E+00 ( //r2// )= 0.000E+00 a0 0.0000 0.000E+00 0.000 0.000 sqrtdel= 1.0000 0.000E+00 47 -1 0.70 0.50 ag i d9 5s7s ag i d10 9d 0.000E+00 ( //r2// )= 0.000E+00 a0 0.0000 0.000E+00 0.000 0.000 sqrtdel= 1.0000 0.000E+00 47 -1 0.70 0.50 ag i d9 5s7s ag i d9 5s5d 1.171E+02 ( 7s//r2// 5d)= 1.171E+02 a0 0.8418 9.138E+02 0.230 0.340 sqrtdel= 1.0000 1.171E+02 47 -1 0.70 0.50 ag i d9 5s7s ag i d9 5s6d -3.800E+02 ( 7s//r2// 6d)=-3.800E+02 a0 -0.9987 9.629E+03-0.913-0.983 sqrtdel= 1.0000 -3.800E+02 47 -1 0.70 0.50 ag i d9 5s7s ag i d9 5s7d 7.099E+01 ( 7s//r2// 7d)= 7.099E+01 a0 0.2760 3.360E+02-0.215-0.394 sqrtdel= 1.0000 7.099E+01 47 -1 0.70 0.50 ag i d9 5s7s ag i d9 5s8d 4.427E+01 ( 7s//r2// 8d)= 4.427E+01 a0 0.2587 1.307E+02-0.098-0.256 sqrtdel= 1.0000 4.427E+01 47 -1 0.70 0.50 ag i d9 5s7s ag i d9 5s9d 3.003E+01 ( 7s//r2// 9d)= 3.003E+01 a0 0.2326 6.011E+01-0.056-0.193 sqrtdel= 1.0000 3.003E+01 47 -1 0.70 0.50 ag i d9 5s7s ag i d8 5s2 5d 0.000E+00 ( //r2// )= 0.000E+00 a0 0.0000 0.000E+00 0.000 0.000 sqrtdel= 1.0000 0.000E+00 47 -1 0.70 0.50 ag i d9 5s7s ag i d10 5g 0.000E+00 ( //r2// )= 0.000E+00 a0 0.0000 0.000E+00 0.000 0.000 sqrtdel= 1.0000 0.000E+00 47 -1 0.70 0.50 ag i d9 5s7s ag i d10 6g 0.000E+00 ( //r2// )= 0.000E+00 a0 0.0000 0.000E+00 0.000 0.000 sqrtdel= 1.0000 0.000E+00 47 -1 0.70 0.50 ag i d9 5s7s ag i d10 7g 0.000E+00 ( //r2// )= 0.000E+00 a0 0.0000 0.000E+00 0.000 0.000 sqrtdel= 1.0000 0.000E+00 47 -1 0.70 0.50 ag i d9 5s7s ag i d10 8g 0.000E+00 ( //r2// )= 0.000E+00 a0 0.0000 0.000E+00 0.000 0.000 sqrtdel= 1.0000 0.000E+00 47 -1 0.70 0.50 ag i d9 5s7s ag i d10 9g 0.000E+00 ( //r2// )= 0.000E+00 a0 0.0000 0.000E+00 0.000 0.000 sqrtdel= 1.0000 0.000E+00 47 -1 0.70 0.50 ag i d9 5s7s ag i d9 5s5g 0.000E+00 ( //r2// )= 0.000E+00 a0 0.0000 0.000E+00 0.000 0.000 sqrtdel= 1.0000 0.000E+00 47 -1 0.70 0.50 ag i d9 5s7s ag i d9 5s6g 0.000E+00 ( //r2// )= 0.000E+00 a0 0.0000 0.000E+00 0.000 0.000 sqrtdel= 1.0000 0.000E+00 47 -1 0.70 0.50 ag i d9 5s7s ag i d9 5s7g 0.000E+00 ( //r2// )= 0.000E+00 a0 0.0000 0.000E+00 0.000 0.000 sqrtdel= 1.0000 0.000E+00 47 -1 0.70 0.50 ag i d9 5s7s ag i d9 5s8g 0.000E+00 ( //r2// )= 0.000E+00 a0 0.0000 0.000E+00 0.000 0.000 sqrtdel= 1.0000 0.000E+00 47 -1 0.70 0.50 ag i d9 5s7s ag i d9 5s9g 0.000E+00 ( //r2// )= 0.000E+00 a0 0.0000 0.000E+00 0.000 0.000 sqrtdel= 1.0000 0.000E+00 47 -1 0.70 0.50 ag i d9 5s7s ag i d10 7i 0.000E+00 ( //r2// )= 0.000E+00 a0 0.0000 0.000E+00 0.000 0.000 sqrtdel= 1.0000 0.000E+00 47 -1 0.70 0.50 ag i d9 5s7s ag i d10 8i 0.000E+00 ( //r2// )= 0.000E+00 a0 0.0000 0.000E+00 0.000 0.000 sqrtdel= 1.0000 0.000E+00 47 -1 0.70 0.50 ag i d9 5s7s ag i d10 9i 0.000E+00 ( //r2// )= 0.000E+00 a0 0.0000 0.000E+00 0.000 0.000 sqrtdel= 1.0000 0.000E+00 47 -1 0.70 0.50 ag i d9 5s7s ag i d9 5s7i 0.000E+00 ( //r2// )= 0.000E+00 a0 0.0000 0.000E+00 0.000 0.000 sqrtdel= 1.0000 0.000E+00 47 -1 0.70 0.50 ag i d9 5s7s ag i d9 5s8i 0.000E+00 ( //r2// )= 0.000E+00 a0 0.0000 0.000E+00 0.000 0.000 sqrtdel= 1.0000 0.000E+00 47 -1 0.70 0.50 ag i d9 5s7s ag i d9 5s9i 0.000E+00 ( //r2// )= 0.000E+00 a0 0.0000 0.000E+00 0.000 0.000 sqrtdel= 1.0000 0.000E+00 47 -1 0.70 0.50 ag i d9 5s7s ag i d10 9l 0.000E+00 ( //r2// )= 0.000E+00 a0 0.0000 0.000E+00 0.000 0.000 sqrtdel= 1.0000 0.000E+00 47 -1 0.70 0.50 ag i d9 5s7s ag i d9 5s9l 0.000E+00 ( //r2// )= 0.000E+00 a0 0.0000 0.000E+00 0.000 0.000 sqrtdel= 1.0000 0.000E+00 47 -1 0.70 0.50 ag i d9 5s7s ag i d9 5p2 0.000E+00 ( //r2// )= 0.000E+00 a0 0.0000 0.000E+00 0.000 0.000 sqrtdel= 1.0000 0.000E+00 47 -1 0.70 0.50 ag i d9 5s8s ag i d10 5s 3.575E-02 ( 8s//r2// 4d)= 3.575E-02 a0 0.0700 8.519E-05-0.031-0.412 sqrtdel= 1.0000 3.575E-02 47 -1 0.70 0.50 ag i d9 5s8s ag i d10 6s 0.000E+00 ( //r2// )= 0.000E+00 a0 0.0000 0.000E+00 0.000 0.000 sqrtdel= 1.0000 0.000E+00 47 -1 0.70 0.50 ag i d9 5s8s ag i d10 7s 0.000E+00 ( //r2// )= 0.000E+00 a0 0.0000 0.000E+00 0.000 0.000 sqrtdel= 1.0000 0.000E+00 47 -1 0.70 0.50 ag i d9 5s8s ag i d10 8s -3.169E+00 ( 5s//r2// 4d)=-3.169E+00 a0 -0.9615 6.695E-01-0.449-0.676 sqrtdel= 1.0000 -3.169E+00 47 -1 0.70 0.50 ag i d9 5s8s ag i d10 9s 0.000E+00 ( //r2// )= 0.000E+00 a0 0.0000 0.000E+00 0.000 0.000 sqrtdel= 1.0000 0.000E+00 47 -1 0.70 0.50 ag i d9 5s8s ag i d9 5s2 0.000E+00 ( //r2// )= 0.000E+00 a0 0.0000 0.000E+00 0.000 0.000 sqrtdel= 1.0000 0.000E+00 47 -1 0.70 0.50 ag i d9 5s8s ag i d9 5s6s 0.000E+00 ( //r2// )= 0.000E+00 a0 0.0000 0.000E+00 0.000 0.000 sqrtdel= 1.0000 0.000E+00 47 -1 0.70 0.50 ag i d9 5s8s ag i d9 5s7s 0.000E+00 ( //r2// )= 0.000E+00 a0 0.0000 0.000E+00 0.000 0.000 sqrtdel= 1.0000 0.000E+00 47 -1 0.70 0.50 ag i d9 5s8s ag i d9 5s8s 2.171E+00 ( 4d//r2// 4d)=-2.595E+00 a0 1.0000 3.142E-01 1.000 1.000 sqrtdel= 1.0000 -2.595E+00 47 -1 0.70 0.50 ag i d9 5s8s ag i d9 5s9s 0.000E+00 ( //r2// )= 0.000E+00 a0 0.0000 0.000E+00 0.000 0.000 sqrtdel= 1.0000 0.000E+00 47 -1 0.70 0.50 ag i d9 5s8s ag i d8 5s2 6s 0.000E+00 ( //r2// )= 0.000E+00 a0 0.0000 0.000E+00 0.000 0.000 sqrtdel= 1.0000 0.000E+00 47 -1 0.70 0.50 ag i d9 5s8s ag i d10 5d 0.000E+00 ( //r2// )= 0.000E+00 a0 0.0000 0.000E+00 0.000 0.000 sqrtdel= 1.0000 0.000E+00 47 -1 0.70 0.50 ag i d9 5s8s ag i d10 6d 0.000E+00 ( //r2// )= 0.000E+00 a0 0.0000 0.000E+00 0.000 0.000 sqrtdel= 1.0000 0.000E+00 47 -1 0.70 0.50 ag i d9 5s8s ag i d10 7d 0.000E+00 ( //r2// )= 0.000E+00 a0 0.0000 0.000E+00 0.000 0.000 sqrtdel= 1.0000 0.000E+00 47 -1 0.70 0.50 ag i d9 5s8s ag i d10 8d 0.000E+00 ( //r2// )= 0.000E+00 a0 0.0000 0.000E+00 0.000 0.000 sqrtdel= 1.0000 0.000E+00 47 -1 0.70 0.50 ag i d9 5s8s ag i d10 9d 0.000E+00 ( //r2// )= 0.000E+00 a0 0.0000 0.000E+00 0.000 0.000 sqrtdel= 1.0000 0.000E+00 47 -1 0.70 0.50 ag i d9 5s8s ag i d9 5s5d 3.733E+00 ( 8s//r2// 5d)= 3.733E+00 a0 0.0442 9.288E-01 0.053 0.131 sqrtdel= 1.0000 3.733E+00 47 -1 0.70 0.50 ag i d9 5s8s ag i d9 5s6d 4.318E+02 ( 8s//r2// 6d)= 4.318E+02 a0 0.8491 1.243E+04 0.316 0.429 sqrtdel= 1.0000 4.318E+02 47 -1 0.70 0.50 ag i d9 5s8s ag i d9 5s7d -1.014E+03 ( 8s//r2// 7d)=-1.014E+03 a0 -0.9928 6.856E+04-0.882-0.975 sqrtdel= 1.0000 -1.014E+03 47 -1 0.70 0.50 ag i d9 5s8s ag i d9 5s8d 1.370E+02 ( 8s//r2// 8d)= 1.370E+02 a0 0.1909 1.251E+03-0.244-0.413 sqrtdel= 1.0000 1.370E+02 47 -1 0.70 0.50 ag i d9 5s8s ag i d9 5s9d 8.636E+01 ( 8s//r2// 9d)= 8.636E+01 a0 0.1728 4.971E+02-0.125-0.289 sqrtdel= 1.0000 8.636E+01 47 -1 0.70 0.50 ag i d9 5s8s ag i d8 5s2 5d 0.000E+00 ( //r2// )= 0.000E+00 a0 0.0000 0.000E+00 0.000 0.000 sqrtdel= 1.0000 0.000E+00 47 -1 0.70 0.50 ag i d9 5s8s ag i d10 5g 0.000E+00 ( //r2// )= 0.000E+00 a0 0.0000 0.000E+00 0.000 0.000 sqrtdel= 1.0000 0.000E+00 47 -1 0.70 0.50 ag i d9 5s8s ag i d10 6g 0.000E+00 ( //r2// )= 0.000E+00 a0 0.0000 0.000E+00 0.000 0.000 sqrtdel= 1.0000 0.000E+00 47 -1 0.70 0.50 ag i d9 5s8s ag i d10 7g 0.000E+00 ( //r2// )= 0.000E+00 a0 0.0000 0.000E+00 0.000 0.000 sqrtdel= 1.0000 0.000E+00 47 -1 0.70 0.50 ag i d9 5s8s ag i d10 8g 0.000E+00 ( //r2// )= 0.000E+00 a0 0.0000 0.000E+00 0.000 0.000 sqrtdel= 1.0000 0.000E+00 47 -1 0.70 0.50 ag i d9 5s8s ag i d10 9g 0.000E+00 ( //r2// )= 0.000E+00 a0 0.0000 0.000E+00 0.000 0.000 sqrtdel= 1.0000 0.000E+00 47 -1 0.70 0.50 ag i d9 5s8s ag i d9 5s5g 0.000E+00 ( //r2// )= 0.000E+00 a0 0.0000 0.000E+00 0.000 0.000 sqrtdel= 1.0000 0.000E+00 47 -1 0.70 0.50 ag i d9 5s8s ag i d9 5s6g 0.000E+00 ( //r2// )= 0.000E+00 a0 0.0000 0.000E+00 0.000 0.000 sqrtdel= 1.0000 0.000E+00 47 -1 0.70 0.50 ag i d9 5s8s ag i d9 5s7g 0.000E+00 ( //r2// )= 0.000E+00 a0 0.0000 0.000E+00 0.000 0.000 sqrtdel= 1.0000 0.000E+00 47 -1 0.70 0.50 ag i d9 5s8s ag i d9 5s8g 0.000E+00 ( //r2// )= 0.000E+00 a0 0.0000 0.000E+00 0.000 0.000 sqrtdel= 1.0000 0.000E+00 47 -1 0.70 0.50 ag i d9 5s8s ag i d9 5s9g 0.000E+00 ( //r2// )= 0.000E+00 a0 0.0000 0.000E+00 0.000 0.000 sqrtdel= 1.0000 0.000E+00 47 -1 0.70 0.50 ag i d9 5s8s ag i d10 7i 0.000E+00 ( //r2// )= 0.000E+00 a0 0.0000 0.000E+00 0.000 0.000 sqrtdel= 1.0000 0.000E+00 47 -1 0.70 0.50 ag i d9 5s8s ag i d10 8i 0.000E+00 ( //r2// )= 0.000E+00 a0 0.0000 0.000E+00 0.000 0.000 sqrtdel= 1.0000 0.000E+00 47 -1 0.70 0.50 ag i d9 5s8s ag i d10 9i 0.000E+00 ( //r2// )= 0.000E+00 a0 0.0000 0.000E+00 0.000 0.000 sqrtdel= 1.0000 0.000E+00 47 -1 0.70 0.50 ag i d9 5s8s ag i d9 5s7i 0.000E+00 ( //r2// )= 0.000E+00 a0 0.0000 0.000E+00 0.000 0.000 sqrtdel= 1.0000 0.000E+00 47 -1 0.70 0.50 ag i d9 5s8s ag i d9 5s8i 0.000E+00 ( //r2// )= 0.000E+00 a0 0.0000 0.000E+00 0.000 0.000 sqrtdel= 1.0000 0.000E+00 47 -1 0.70 0.50 ag i d9 5s8s ag i d9 5s9i 0.000E+00 ( //r2// )= 0.000E+00 a0 0.0000 0.000E+00 0.000 0.000 sqrtdel= 1.0000 0.000E+00 47 -1 0.70 0.50 ag i d9 5s8s ag i d10 9l 0.000E+00 ( //r2// )= 0.000E+00 a0 0.0000 0.000E+00 0.000 0.000 sqrtdel= 1.0000 0.000E+00 47 -1 0.70 0.50 ag i d9 5s8s ag i d9 5s9l 0.000E+00 ( //r2// )= 0.000E+00 a0 0.0000 0.000E+00 0.000 0.000 sqrtdel= 1.0000 0.000E+00 47 -1 0.70 0.50 ag i d9 5s8s ag i d9 5p2 0.000E+00 ( //r2// )= 0.000E+00 a0 0.0000 0.000E+00 0.000 0.000 sqrtdel= 1.0000 0.000E+00 47 -1 0.70 0.50 ag i d9 5s9s ag i d10 5s 2.542E-02 ( 9s//r2// 4d)= 2.542E-02 a0 0.0681 4.308E-05-0.023-0.408 sqrtdel= 1.0000 2.542E-02 47 -1 0.70 0.50 ag i d9 5s9s ag i d10 6s 0.000E+00 ( //r2// )= 0.000E+00 a0 0.0000 0.000E+00 0.000 0.000 sqrtdel= 1.0000 0.000E+00 47 -1 0.70 0.50 ag i d9 5s9s ag i d10 7s 0.000E+00 ( //r2// )= 0.000E+00 a0 0.0000 0.000E+00 0.000 0.000 sqrtdel= 1.0000 0.000E+00 47 -1 0.70 0.50 ag i d9 5s9s ag i d10 8s 0.000E+00 ( //r2// )= 0.000E+00 a0 0.0000 0.000E+00 0.000 0.000 sqrtdel= 1.0000 0.000E+00 47 -1 0.70 0.50 ag i d9 5s9s ag i d10 9s -3.167E+00 ( 5s//r2// 4d)=-3.167E+00 a0 -0.9615 6.687E-01-0.449-0.676 sqrtdel= 1.0000 -3.167E+00 47 -1 0.70 0.50 ag i d9 5s9s ag i d9 5s2 0.000E+00 ( //r2// )= 0.000E+00 a0 0.0000 0.000E+00 0.000 0.000 sqrtdel= 1.0000 0.000E+00 47 -1 0.70 0.50 ag i d9 5s9s ag i d9 5s6s 0.000E+00 ( //r2// )= 0.000E+00 a0 0.0000 0.000E+00 0.000 0.000 sqrtdel= 1.0000 0.000E+00 47 -1 0.70 0.50 ag i d9 5s9s ag i d9 5s7s 0.000E+00 ( //r2// )= 0.000E+00 a0 0.0000 0.000E+00 0.000 0.000 sqrtdel= 1.0000 0.000E+00 47 -1 0.70 0.50 ag i d9 5s9s ag i d9 5s8s 0.000E+00 ( //r2// )= 0.000E+00 a0 0.0000 0.000E+00 0.000 0.000 sqrtdel= 1.0000 0.000E+00 47 -1 0.70 0.50 ag i d9 5s9s ag i d9 5s9s 2.170E+00 ( 4d//r2// 4d)=-2.594E+00 a0 1.0000 3.140E-01 1.000 1.000 sqrtdel= 1.0000 -2.594E+00 47 -1 0.70 0.50 ag i d9 5s9s ag i d8 5s2 6s 0.000E+00 ( //r2// )= 0.000E+00 a0 0.0000 0.000E+00 0.000 0.000 sqrtdel= 1.0000 0.000E+00 47 -1 0.70 0.50 ag i d9 5s9s ag i d10 5d 0.000E+00 ( //r2// )= 0.000E+00 a0 0.0000 0.000E+00 0.000 0.000 sqrtdel= 1.0000 0.000E+00 47 -1 0.70 0.50 ag i d9 5s9s ag i d10 6d 0.000E+00 ( //r2// )= 0.000E+00 a0 0.0000 0.000E+00 0.000 0.000 sqrtdel= 1.0000 0.000E+00 47 -1 0.70 0.50 ag i d9 5s9s ag i d10 7d 0.000E+00 ( //r2// )= 0.000E+00 a0 0.0000 0.000E+00 0.000 0.000 sqrtdel= 1.0000 0.000E+00 47 -1 0.70 0.50 ag i d9 5s9s ag i d10 8d 0.000E+00 ( //r2// )= 0.000E+00 a0 0.0000 0.000E+00 0.000 0.000 sqrtdel= 1.0000 0.000E+00 47 -1 0.70 0.50 ag i d9 5s9s ag i d10 9d 0.000E+00 ( //r2// )= 0.000E+00 a0 0.0000 0.000E+00 0.000 0.000 sqrtdel= 1.0000 0.000E+00 47 -1 0.70 0.50 ag i d9 5s9s ag i d9 5s5d 1.151E+00 ( 9s//r2// 5d)= 1.151E+00 a0 0.0203 8.838E-02 0.026 0.093 sqrtdel= 1.0000 1.151E+00 47 -1 0.70 0.50 ag i d9 5s9s ag i d9 5s6d 1.067E+01 ( 9s//r2// 6d)= 1.067E+01 a0 0.0321 7.593E+00 0.081 0.173 sqrtdel= 1.0000 1.067E+01 47 -1 0.70 0.50 ag i d9 5s9s ag i d9 5s7d 1.115E+03 ( 9s//r2// 7d)= 1.115E+03 a0 0.8558 8.283E+04 0.369 0.487 sqrtdel= 1.0000 1.115E+03 47 -1 0.70 0.50 ag i d9 5s9s ag i d9 5s8d -2.209E+03 ( 9s//r2// 8d)=-2.209E+03 a0 -0.9855 3.252E+05-0.855-0.963 sqrtdel= 1.0000 -2.209E+03 47 -1 0.70 0.50 ag i d9 5s9s ag i d9 5s9d 2.376E+02 ( 9s//r2// 9d)= 2.376E+02 a0 0.1458 3.764E+03-0.254-0.410 sqrtdel= 1.0000 2.376E+02 47 -1 0.70 0.50 ag i d9 5s9s ag i d8 5s2 5d 0.000E+00 ( //r2// )= 0.000E+00 a0 0.0000 0.000E+00 0.000 0.000 sqrtdel= 1.0000 0.000E+00 47 -1 0.70 0.50 ag i d9 5s9s ag i d10 5g 0.000E+00 ( //r2// )= 0.000E+00 a0 0.0000 0.000E+00 0.000 0.000 sqrtdel= 1.0000 0.000E+00 47 -1 0.70 0.50 ag i d9 5s9s ag i d10 6g 0.000E+00 ( //r2// )= 0.000E+00 a0 0.0000 0.000E+00 0.000 0.000 sqrtdel= 1.0000 0.000E+00 47 -1 0.70 0.50 ag i d9 5s9s ag i d10 7g 0.000E+00 ( //r2// )= 0.000E+00 a0 0.0000 0.000E+00 0.000 0.000 sqrtdel= 1.0000 0.000E+00 47 -1 0.70 0.50 ag i d9 5s9s ag i d10 8g 0.000E+00 ( //r2// )= 0.000E+00 a0 0.0000 0.000E+00 0.000 0.000 sqrtdel= 1.0000 0.000E+00 47 -1 0.70 0.50 ag i d9 5s9s ag i d10 9g 0.000E+00 ( //r2// )= 0.000E+00 a0 0.0000 0.000E+00 0.000 0.000 sqrtdel= 1.0000 0.000E+00 47 -1 0.70 0.50 ag i d9 5s9s ag i d9 5s5g 0.000E+00 ( //r2// )= 0.000E+00 a0 0.0000 0.000E+00 0.000 0.000 sqrtdel= 1.0000 0.000E+00 47 -1 0.70 0.50 ag i d9 5s9s ag i d9 5s6g 0.000E+00 ( //r2// )= 0.000E+00 a0 0.0000 0.000E+00 0.000 0.000 sqrtdel= 1.0000 0.000E+00 47 -1 0.70 0.50 ag i d9 5s9s ag i d9 5s7g 0.000E+00 ( //r2// )= 0.000E+00 a0 0.0000 0.000E+00 0.000 0.000 sqrtdel= 1.0000 0.000E+00 47 -1 0.70 0.50 ag i d9 5s9s ag i d9 5s8g 0.000E+00 ( //r2// )= 0.000E+00 a0 0.0000 0.000E+00 0.000 0.000 sqrtdel= 1.0000 0.000E+00 47 -1 0.70 0.50 ag i d9 5s9s ag i d9 5s9g 0.000E+00 ( //r2// )= 0.000E+00 a0 0.0000 0.000E+00 0.000 0.000 sqrtdel= 1.0000 0.000E+00 47 -1 0.70 0.50 ag i d9 5s9s ag i d10 7i 0.000E+00 ( //r2// )= 0.000E+00 a0 0.0000 0.000E+00 0.000 0.000 sqrtdel= 1.0000 0.000E+00 47 -1 0.70 0.50 ag i d9 5s9s ag i d10 8i 0.000E+00 ( //r2// )= 0.000E+00 a0 0.0000 0.000E+00 0.000 0.000 sqrtdel= 1.0000 0.000E+00 47 -1 0.70 0.50 ag i d9 5s9s ag i d10 9i 0.000E+00 ( //r2// )= 0.000E+00 a0 0.0000 0.000E+00 0.000 0.000 sqrtdel= 1.0000 0.000E+00 47 -1 0.70 0.50 ag i d9 5s9s ag i d9 5s7i 0.000E+00 ( //r2// )= 0.000E+00 a0 0.0000 0.000E+00 0.000 0.000 sqrtdel= 1.0000 0.000E+00 47 -1 0.70 0.50 ag i d9 5s9s ag i d9 5s8i 0.000E+00 ( //r2// )= 0.000E+00 a0 0.0000 0.000E+00 0.000 0.000 sqrtdel= 1.0000 0.000E+00 47 -1 0.70 0.50 ag i d9 5s9s ag i d9 5s9i 0.000E+00 ( //r2// )= 0.000E+00 a0 0.0000 0.000E+00 0.000 0.000 sqrtdel= 1.0000 0.000E+00 47 -1 0.70 0.50 ag i d9 5s9s ag i d10 9l 0.000E+00 ( //r2// )= 0.000E+00 a0 0.0000 0.000E+00 0.000 0.000 sqrtdel= 1.0000 0.000E+00 47 -1 0.70 0.50 ag i d9 5s9s ag i d9 5s9l 0.000E+00 ( //r2// )= 0.000E+00 a0 0.0000 0.000E+00 0.000 0.000 sqrtdel= 1.0000 0.000E+00 47 -1 0.70 0.50 ag i d9 5s9s ag i d9 5p2 0.000E+00 ( //r2// )= 0.000E+00 a0 0.0000 0.000E+00 0.000 0.000 sqrtdel= 1.0000 0.000E+00 47 -1 0.70 0.50 ag i d8 5s2 6s ag i d10 5s 0.000E+00 ( //r2// )= 0.000E+00 a0 0.0000 0.000E+00 0.000 0.000 sqrtdel= 1.0000 0.000E+00 47 -1 0.70 0.50 ag i d8 5s2 6s ag i d10 6s 0.000E+00 ( //r2// )= 0.000E+00 a0 0.0000 0.000E+00 0.000 0.000 sqrtdel= 1.0000 0.000E+00 47 -1 0.70 0.50 ag i d8 5s2 6s ag i d10 7s 0.000E+00 ( //r2// )= 0.000E+00 a0 0.0000 0.000E+00 0.000 0.000 sqrtdel= 1.0000 0.000E+00 47 -1 0.70 0.50 ag i d8 5s2 6s ag i d10 8s 0.000E+00 ( //r2// )= 0.000E+00 a0 0.0000 0.000E+00 0.000 0.000 sqrtdel= 1.0000 0.000E+00 47 -1 0.70 0.50 ag i d8 5s2 6s ag i d10 9s 0.000E+00 ( //r2// )= 0.000E+00 a0 0.0000 0.000E+00 0.000 0.000 sqrtdel= 1.0000 0.000E+00 47 -1 0.70 0.50 ag i d8 5s2 6s ag i d9 5s2 -3.060E-02 ( 6s//r2// 4d)=-3.060E-02 a0 -0.0287 6.244E-05-0.081-0.440 sqrtdel= 1.0000 -3.060E-02 47 -1 0.70 0.50 ag i d8 5s2 6s ag i d9 5s6s -2.808E+00 ( 5s//r2// 4d)=-2.808E+00 a0 -0.9548 5.256E-01-0.423-0.648 sqrtdel= 1.0000 -2.808E+00 47 -1 0.70 0.50 ag i d8 5s2 6s ag i d9 5s7s 0.000E+00 ( //r2// )= 0.000E+00 a0 0.0000 0.000E+00 0.000 0.000 sqrtdel= 1.0000 0.000E+00 47 -1 0.70 0.50 ag i d8 5s2 6s ag i d9 5s8s 0.000E+00 ( //r2// )= 0.000E+00 a0 0.0000 0.000E+00 0.000 0.000 sqrtdel= 1.0000 0.000E+00 47 -1 0.70 0.50 ag i d8 5s2 6s ag i d9 5s9s 0.000E+00 ( //r2// )= 0.000E+00 a0 0.0000 0.000E+00 0.000 0.000 sqrtdel= 1.0000 0.000E+00 47 -1 0.70 0.50 ag i d8 5s2 6s ag i d8 5s2 6s 2.004E+00 ( 4d//r2// 4d)=-2.396E+00 a0 1.0000 2.679E-01 1.000 1.000 sqrtdel= 1.0000 -2.396E+00 47 -1 0.70 0.50 ag i d8 5s2 6s ag i d10 5d 0.000E+00 ( //r2// )= 0.000E+00 a0 0.0000 0.000E+00 0.000 0.000 sqrtdel= 1.0000 0.000E+00 47 -1 0.70 0.50 ag i d8 5s2 6s ag i d10 6d 0.000E+00 ( //r2// )= 0.000E+00 a0 0.0000 0.000E+00 0.000 0.000 sqrtdel= 1.0000 0.000E+00 47 -1 0.70 0.50 ag i d8 5s2 6s ag i d10 7d 0.000E+00 ( //r2// )= 0.000E+00 a0 0.0000 0.000E+00 0.000 0.000 sqrtdel= 1.0000 0.000E+00 47 -1 0.70 0.50 ag i d8 5s2 6s ag i d10 8d 0.000E+00 ( //r2// )= 0.000E+00 a0 0.0000 0.000E+00 0.000 0.000 sqrtdel= 1.0000 0.000E+00 47 -1 0.70 0.50 ag i d8 5s2 6s ag i d10 9d 0.000E+00 ( //r2// )= 0.000E+00 a0 0.0000 0.000E+00 0.000 0.000 sqrtdel= 1.0000 0.000E+00 47 -1 0.70 0.50 ag i d8 5s2 6s ag i d9 5s5d 0.000E+00 ( //r2// )= 0.000E+00 a0 0.0000 0.000E+00 0.000 0.000 sqrtdel= 1.0000 0.000E+00 47 -1 0.70 0.50 ag i d8 5s2 6s ag i d9 5s6d 0.000E+00 ( //r2// )= 0.000E+00 a0 0.0000 0.000E+00 0.000 0.000 sqrtdel= 1.0000 0.000E+00 47 -1 0.70 0.50 ag i d8 5s2 6s ag i d9 5s7d 0.000E+00 ( //r2// )= 0.000E+00 a0 0.0000 0.000E+00 0.000 0.000 sqrtdel= 1.0000 0.000E+00 47 -1 0.70 0.50 ag i d8 5s2 6s ag i d9 5s8d 0.000E+00 ( //r2// )= 0.000E+00 a0 0.0000 0.000E+00 0.000 0.000 sqrtdel= 1.0000 0.000E+00 47 -1 0.70 0.50 ag i d8 5s2 6s ag i d9 5s9d 0.000E+00 ( //r2// )= 0.000E+00 a0 0.0000 0.000E+00 0.000 0.000 sqrtdel= 1.0000 0.000E+00 47 -1 0.70 0.50 ag i d8 5s2 6s ag i d8 5s2 5d -9.143E+01 ( 6s//r2// 5d)=-9.143E+01 a0 -0.9985 5.572E+02-0.925-0.976 sqrtdel= 1.0000 -9.143E+01 47 -1 0.70 0.50 ag i d8 5s2 6s ag i d10 5g 0.000E+00 ( //r2// )= 0.000E+00 a0 0.0000 0.000E+00 0.000 0.000 sqrtdel= 1.0000 0.000E+00 47 -1 0.70 0.50 ag i d8 5s2 6s ag i d10 6g 0.000E+00 ( //r2// )= 0.000E+00 a0 0.0000 0.000E+00 0.000 0.000 sqrtdel= 1.0000 0.000E+00 47 -1 0.70 0.50 ag i d8 5s2 6s ag i d10 7g 0.000E+00 ( //r2// )= 0.000E+00 a0 0.0000 0.000E+00 0.000 0.000 sqrtdel= 1.0000 0.000E+00 47 -1 0.70 0.50 ag i d8 5s2 6s ag i d10 8g 0.000E+00 ( //r2// )= 0.000E+00 a0 0.0000 0.000E+00 0.000 0.000 sqrtdel= 1.0000 0.000E+00 47 -1 0.70 0.50 ag i d8 5s2 6s ag i d10 9g 0.000E+00 ( //r2// )= 0.000E+00 a0 0.0000 0.000E+00 0.000 0.000 sqrtdel= 1.0000 0.000E+00 47 -1 0.70 0.50 ag i d8 5s2 6s ag i d9 5s5g 0.000E+00 ( //r2// )= 0.000E+00 a0 0.0000 0.000E+00 0.000 0.000 sqrtdel= 1.0000 0.000E+00 47 -1 0.70 0.50 ag i d8 5s2 6s ag i d9 5s6g 0.000E+00 ( //r2// )= 0.000E+00 a0 0.0000 0.000E+00 0.000 0.000 sqrtdel= 1.0000 0.000E+00 47 -1 0.70 0.50 ag i d8 5s2 6s ag i d9 5s7g 0.000E+00 ( //r2// )= 0.000E+00 a0 0.0000 0.000E+00 0.000 0.000 sqrtdel= 1.0000 0.000E+00 47 -1 0.70 0.50 ag i d8 5s2 6s ag i d9 5s8g 0.000E+00 ( //r2// )= 0.000E+00 a0 0.0000 0.000E+00 0.000 0.000 sqrtdel= 1.0000 0.000E+00 47 -1 0.70 0.50 ag i d8 5s2 6s ag i d9 5s9g 0.000E+00 ( //r2// )= 0.000E+00 a0 0.0000 0.000E+00 0.000 0.000 sqrtdel= 1.0000 0.000E+00 47 -1 0.70 0.50 ag i d8 5s2 6s ag i d10 7i 0.000E+00 ( //r2// )= 0.000E+00 a0 0.0000 0.000E+00 0.000 0.000 sqrtdel= 1.0000 0.000E+00 47 -1 0.70 0.50 ag i d8 5s2 6s ag i d10 8i 0.000E+00 ( //r2// )= 0.000E+00 a0 0.0000 0.000E+00 0.000 0.000 sqrtdel= 1.0000 0.000E+00 47 -1 0.70 0.50 ag i d8 5s2 6s ag i d10 9i 0.000E+00 ( //r2// )= 0.000E+00 a0 0.0000 0.000E+00 0.000 0.000 sqrtdel= 1.0000 0.000E+00 47 -1 0.70 0.50 ag i d8 5s2 6s ag i d9 5s7i 0.000E+00 ( //r2// )= 0.000E+00 a0 0.0000 0.000E+00 0.000 0.000 sqrtdel= 1.0000 0.000E+00 47 -1 0.70 0.50 ag i d8 5s2 6s ag i d9 5s8i 0.000E+00 ( //r2// )= 0.000E+00 a0 0.0000 0.000E+00 0.000 0.000 sqrtdel= 1.0000 0.000E+00 47 -1 0.70 0.50 ag i d8 5s2 6s ag i d9 5s9i 0.000E+00 ( //r2// )= 0.000E+00 a0 0.0000 0.000E+00 0.000 0.000 sqrtdel= 1.0000 0.000E+00 47 -1 0.70 0.50 ag i d8 5s2 6s ag i d10 9l 0.000E+00 ( //r2// )= 0.000E+00 a0 0.0000 0.000E+00 0.000 0.000 sqrtdel= 1.0000 0.000E+00 47 -1 0.70 0.50 ag i d8 5s2 6s ag i d9 5s9l 0.000E+00 ( //r2// )= 0.000E+00 a0 0.0000 0.000E+00 0.000 0.000 sqrtdel= 1.0000 0.000E+00 47 -1 0.70 0.50 ag i d8 5s2 6s ag i d9 5p2 0.000E+00 ( //r2// )= 0.000E+00 a0 0.0000 0.000E+00 0.000 0.000 sqrtdel= 1.0000 0.000E+00 47 -1 0.70 0.50 ag i d10 5d ag i d10 5s 9.894E+00 ( 5d//r2// 5s)= 9.894E+00 a0 0.9967 6.525E+00 0.291 0.956 sqrtdel= 1.0000 9.894E+00 47 -1 0.70 0.50 ag i d10 5d ag i d10 6s -1.070E+02 ( 5d//r2// 6s)=-1.070E+02 a0 -0.9978 7.626E+02-0.927-0.969 sqrtdel= 1.0000 -1.070E+02 47 -1 0.70 0.50 ag i d10 5d ag i d10 7s 1.235E+02 ( 5d//r2// 7s)= 1.235E+02 a0 0.8330 1.018E+03 0.222 0.330 sqrtdel= 1.0000 1.235E+02 47 -1 0.70 0.50 ag i d10 5d ag i d10 8s 5.478E+00 ( 5d//r2// 8s)= 5.478E+00 a0 0.0609 2.000E+00 0.052 0.128 sqrtdel= 1.0000 5.478E+00 47 -1 0.70 0.50 ag i d10 5d ag i d10 9s 1.935E+00 ( 5d//r2// 9s)= 1.935E+00 a0 0.0319 2.495E-01 0.026 0.091 sqrtdel= 1.0000 1.935E+00 47 -1 0.70 0.50 ag i d10 5d ag i d9 5s2 0.000E+00 ( //r2// )= 0.000E+00 a0 0.0000 0.000E+00 0.000 0.000 sqrtdel= 1.0000 0.000E+00 47 -1 0.70 0.50 ag i d10 5d ag i d9 5s6s 0.000E+00 ( //r2// )= 0.000E+00 a0 0.0000 0.000E+00 0.000 0.000 sqrtdel= 1.0000 0.000E+00 47 -1 0.70 0.50 ag i d10 5d ag i d9 5s7s 0.000E+00 ( //r2// )= 0.000E+00 a0 0.0000 0.000E+00 0.000 0.000 sqrtdel= 1.0000 0.000E+00 47 -1 0.70 0.50 ag i d10 5d ag i d9 5s8s 0.000E+00 ( //r2// )= 0.000E+00 a0 0.0000 0.000E+00 0.000 0.000 sqrtdel= 1.0000 0.000E+00 47 -1 0.70 0.50 ag i d10 5d ag i d9 5s9s 0.000E+00 ( //r2// )= 0.000E+00 a0 0.0000 0.000E+00 0.000 0.000 sqrtdel= 1.0000 0.000E+00 47 -1 0.70 0.50 ag i d10 5d ag i d8 5s2 6s 0.000E+00 ( //r2// )= 0.000E+00 a0 0.0000 0.000E+00 0.000 0.000 sqrtdel= 1.0000 0.000E+00 47 -1 0.70 0.50 ag i d10 5d ag i d10 5d 1.296E+02 ( 5d//r2// 5d)=-1.549E+02 a0 1.0000 1.120E+03 1.000 1.000 sqrtdel= 1.0000 -1.549E+02 47 -1 0.70 0.50 ag i d10 5d ag i d10 6d -9.505E+01 ( 5d//r2// 6d)= 1.136E+02 a0 -0.7289 6.023E+02-0.003-0.006 sqrtdel= 1.0000 1.136E+02 47 -1 0.70 0.50 ag i d10 5d ag i d10 7d -2.544E+01 ( 5d//r2// 7d)= 3.041E+01 a0 -0.3273 4.316E+01-0.003-0.008 sqrtdel= 1.0000 3.041E+01 47 -1 0.70 0.50 ag i d10 5d ag i d10 8d -1.268E+01 ( 5d//r2// 8d)= 1.516E+01 a0 -0.2283 1.072E+01-0.003-0.010 sqrtdel= 1.0000 1.516E+01 47 -1 0.70 0.50 ag i d10 5d ag i d10 9d -7.986E+00 ( 5d//r2// 9d)= 9.545E+00 a0 -0.1866 4.252E+00-0.003-0.012 sqrtdel= 1.0000 9.545E+00 47 -1 0.70 0.50 ag i d10 5d ag i d9 5s5d -3.175E+00 ( 4d//r2// 5s)=-3.175E+00 a0 -0.9617 6.721E-01-0.448-0.677 sqrtdel= 1.0000 -3.175E+00 47 -1 0.70 0.50 ag i d10 5d ag i d9 5s6d 0.000E+00 ( //r2// )= 0.000E+00 a0 0.0000 0.000E+00 0.000 0.000 sqrtdel= 1.0000 0.000E+00 47 -1 0.70 0.50 ag i d10 5d ag i d9 5s7d 0.000E+00 ( //r2// )= 0.000E+00 a0 0.0000 0.000E+00 0.000 0.000 sqrtdel= 1.0000 0.000E+00 47 -1 0.70 0.50 ag i d10 5d ag i d9 5s8d 0.000E+00 ( //r2// )= 0.000E+00 a0 0.0000 0.000E+00 0.000 0.000 sqrtdel= 1.0000 0.000E+00 47 -1 0.70 0.50 ag i d10 5d ag i d9 5s9d 0.000E+00 ( //r2// )= 0.000E+00 a0 0.0000 0.000E+00 0.000 0.000 sqrtdel= 1.0000 0.000E+00 47 -1 0.70 0.50 ag i d10 5d ag i d8 5s2 5d 0.000E+00 ( //r2// )= 0.000E+00 a0 0.0000 0.000E+00 0.000 0.000 sqrtdel= 1.0000 0.000E+00 47 -1 0.70 0.50 ag i d10 5d ag i d10 5g 1.161E+02 ( 5d//r2// 5g)= 1.862E+02 a0 1.0000 2.140E+02 0.363 1.000 sqrtdel= 1.0000 1.862E+02 47 -1 0.70 0.50 ag i d10 5d ag i d10 6g 6.602E+01 ( 5d//r2// 6g)= 1.059E+02 a0 0.8818 6.918E+01 0.274 0.977 sqrtdel= 1.0000 1.059E+02 47 -1 0.70 0.50 ag i d10 5d ag i d10 7g 4.388E+01 ( 5d//r2// 7g)= 7.036E+01 a0 0.7861 3.056E+01 0.211 0.951 sqrtdel= 1.0000 7.036E+01 47 -1 0.70 0.50 ag i d10 5d ag i d10 8g 3.208E+01 ( 5d//r2// 8g)= 5.145E+01 a0 0.7261 1.634E+01 0.169 0.933 sqrtdel= 1.0000 5.145E+01 47 -1 0.70 0.50 ag i d10 5d ag i d10 9g 2.492E+01 ( 5d//r2// 9g)= 3.996E+01 a0 0.6873 9.859E+00 0.139 0.920 sqrtdel= 1.0000 3.996E+01 47 -1 0.70 0.50 ag i d10 5d ag i d9 5s5g 0.000E+00 ( //r2// )= 0.000E+00 a0 0.0000 0.000E+00 0.000 0.000 sqrtdel= 1.0000 0.000E+00 47 -1 0.70 0.50 ag i d10 5d ag i d9 5s6g 0.000E+00 ( //r2// )= 0.000E+00 a0 0.0000 0.000E+00 0.000 0.000 sqrtdel= 1.0000 0.000E+00 47 -1 0.70 0.50 ag i d10 5d ag i d9 5s7g 0.000E+00 ( //r2// )= 0.000E+00 a0 0.0000 0.000E+00 0.000 0.000 sqrtdel= 1.0000 0.000E+00 47 -1 0.70 0.50 ag i d10 5d ag i d9 5s8g 0.000E+00 ( //r2// )= 0.000E+00 a0 0.0000 0.000E+00 0.000 0.000 sqrtdel= 1.0000 0.000E+00 47 -1 0.70 0.50 ag i d10 5d ag i d9 5s9g 0.000E+00 ( //r2// )= 0.000E+00 a0 0.0000 0.000E+00 0.000 0.000 sqrtdel= 1.0000 0.000E+00 47 -1 0.70 0.50 ag i d10 5d ag i d10 7i 0.000E+00 ( //r2// )= 0.000E+00 a0 0.0000 0.000E+00 0.000 0.000 sqrtdel= 1.0000 0.000E+00 47 -1 0.70 0.50 ag i d10 5d ag i d10 8i 0.000E+00 ( //r2// )= 0.000E+00 a0 0.0000 0.000E+00 0.000 0.000 sqrtdel= 1.0000 0.000E+00 47 -1 0.70 0.50 ag i d10 5d ag i d10 9i 0.000E+00 ( //r2// )= 0.000E+00 a0 0.0000 0.000E+00 0.000 0.000 sqrtdel= 1.0000 0.000E+00 47 -1 0.70 0.50 ag i d10 5d ag i d9 5s7i 0.000E+00 ( //r2// )= 0.000E+00 a0 0.0000 0.000E+00 0.000 0.000 sqrtdel= 1.0000 0.000E+00 47 -1 0.70 0.50 ag i d10 5d ag i d9 5s8i 0.000E+00 ( //r2// )= 0.000E+00 a0 0.0000 0.000E+00 0.000 0.000 sqrtdel= 1.0000 0.000E+00 47 -1 0.70 0.50 ag i d10 5d ag i d9 5s9i 0.000E+00 ( //r2// )= 0.000E+00 a0 0.0000 0.000E+00 0.000 0.000 sqrtdel= 1.0000 0.000E+00 47 -1 0.70 0.50 ag i d10 5d ag i d10 9l 0.000E+00 ( //r2// )= 0.000E+00 a0 0.0000 0.000E+00 0.000 0.000 sqrtdel= 1.0000 0.000E+00 47 -1 0.70 0.50 ag i d10 5d ag i d9 5s9l 0.000E+00 ( //r2// )= 0.000E+00 a0 0.0000 0.000E+00 0.000 0.000 sqrtdel= 1.0000 0.000E+00 47 -1 0.70 0.50 ag i d10 5d ag i d9 5p2 0.000E+00 ( //r2// )= 0.000E+00 a0 0.0000 0.000E+00 0.000 0.000 sqrtdel= 1.0000 0.000E+00 47 -1 0.70 0.50 ag i d10 6d ag i d10 5s 5.276E+00 ( 6d//r2// 5s)= 5.276E+00 a0 0.9487 1.856E+00 0.190 0.948 sqrtdel= 1.0000 5.276E+00 47 -1 0.70 0.50 ag i d10 6d ag i d10 6s 3.300E+01 ( 6d//r2// 6s)= 3.300E+01 a0 0.4614 7.259E+01-0.130-0.276 sqrtdel= 1.0000 3.300E+01 47 -1 0.70 0.50 ag i d10 6d ag i d10 7s -4.066E+02 ( 6d//r2// 7s)=-4.066E+02 a0 -0.9986 1.102E+04-0.914-0.984 sqrtdel= 1.0000 -4.066E+02 47 -1 0.70 0.50 ag i d10 6d ag i d10 8s 4.557E+02 ( 6d//r2// 8s)= 4.557E+02 a0 0.8458 1.384E+04 0.314 0.426 sqrtdel= 1.0000 4.557E+02 47 -1 0.70 0.50 ag i d10 6d ag i d10 9s 1.339E+01 ( 6d//r2// 9s)= 1.339E+01 a0 0.0380 1.195E+01 0.081 0.173 sqrtdel= 1.0000 1.339E+01 47 -1 0.70 0.50 ag i d10 6d ag i d9 5s2 0.000E+00 ( //r2// )= 0.000E+00 a0 0.0000 0.000E+00 0.000 0.000 sqrtdel= 1.0000 0.000E+00 47 -1 0.70 0.50 ag i d10 6d ag i d9 5s6s 0.000E+00 ( //r2// )= 0.000E+00 a0 0.0000 0.000E+00 0.000 0.000 sqrtdel= 1.0000 0.000E+00 47 -1 0.70 0.50 ag i d10 6d ag i d9 5s7s 0.000E+00 ( //r2// )= 0.000E+00 a0 0.0000 0.000E+00 0.000 0.000 sqrtdel= 1.0000 0.000E+00 47 -1 0.70 0.50 ag i d10 6d ag i d9 5s8s 0.000E+00 ( //r2// )= 0.000E+00 a0 0.0000 0.000E+00 0.000 0.000 sqrtdel= 1.0000 0.000E+00 47 -1 0.70 0.50 ag i d10 6d ag i d9 5s9s 0.000E+00 ( //r2// )= 0.000E+00 a0 0.0000 0.000E+00 0.000 0.000 sqrtdel= 1.0000 0.000E+00 47 -1 0.70 0.50 ag i d10 6d ag i d8 5s2 6s 0.000E+00 ( //r2// )= 0.000E+00 a0 0.0000 0.000E+00 0.000 0.000 sqrtdel= 1.0000 0.000E+00 47 -1 0.70 0.50 ag i d10 6d ag i d10 5d -9.505E+01 ( 6d//r2// 5d)= 1.136E+02 a0 -0.7289 6.023E+02-0.003-0.006 sqrtdel= 1.0000 1.136E+02 47 -1 0.70 0.50 ag i d10 6d ag i d10 6d 5.122E+02 ( 6d//r2// 6d)=-6.122E+02 a0 1.0000 1.749E+04 1.000 1.000 sqrtdel= 1.0000 -6.122E+02 47 -1 0.70 0.50 ag i d10 6d ag i d10 7d -3.063E+02 ( 6d//r2// 7d)= 3.661E+02 a0 -0.6494 6.256E+03-0.003-0.005 sqrtdel= 1.0000 3.661E+02 47 -1 0.70 0.50 ag i d10 6d ag i d10 8d -7.996E+01 ( 6d//r2// 8d)= 9.558E+01 a0 -0.2635 4.263E+02-0.003-0.006 sqrtdel= 1.0000 9.558E+01 47 -1 0.70 0.50 ag i d10 6d ag i d10 9d -3.902E+01 ( 6d//r2// 9d)= 4.663E+01 a0 -0.1736 1.015E+02-0.003-0.008 sqrtdel= 1.0000 4.663E+01 47 -1 0.70 0.50 ag i d10 6d ag i d9 5s5d 0.000E+00 ( //r2// )= 0.000E+00 a0 0.0000 0.000E+00 0.000 0.000 sqrtdel= 1.0000 0.000E+00 47 -1 0.70 0.50 ag i d10 6d ag i d9 5s6d -3.170E+00 ( 4d//r2// 5s)=-3.170E+00 a0 -0.9616 6.700E-01-0.449-0.676 sqrtdel= 1.0000 -3.170E+00 47 -1 0.70 0.50 ag i d10 6d ag i d9 5s7d 0.000E+00 ( //r2// )= 0.000E+00 a0 0.0000 0.000E+00 0.000 0.000 sqrtdel= 1.0000 0.000E+00 47 -1 0.70 0.50 ag i d10 6d ag i d9 5s8d 0.000E+00 ( //r2// )= 0.000E+00 a0 0.0000 0.000E+00 0.000 0.000 sqrtdel= 1.0000 0.000E+00 47 -1 0.70 0.50 ag i d10 6d ag i d9 5s9d 0.000E+00 ( //r2// )= 0.000E+00 a0 0.0000 0.000E+00 0.000 0.000 sqrtdel= 1.0000 0.000E+00 47 -1 0.70 0.50 ag i d10 6d ag i d8 5s2 5d 0.000E+00 ( //r2// )= 0.000E+00 a0 0.0000 0.000E+00 0.000 0.000 sqrtdel= 1.0000 0.000E+00 47 -1 0.70 0.50 ag i d10 6d ag i d10 5g -5.909E+02 ( 6d//r2// 5g)=-9.475E+02 a0 -0.9941 5.542E+03-0.846-0.952 sqrtdel= 1.0000 -9.475E+02 47 -1 0.70 0.50 ag i d10 6d ag i d10 6g 5.249E+01 ( 6d//r2// 6g)= 8.417E+01 a0 0.1441 4.373E+01-0.206-0.412 sqrtdel= 1.0000 8.417E+01 47 -1 0.70 0.50 ag i d10 6d ag i d10 7g 6.332E+01 ( 6d//r2// 7g)= 1.015E+02 a0 0.2486 6.365E+01-0.070-0.196 sqrtdel= 1.0000 1.015E+02 47 -1 0.70 0.50 ag i d10 6d ag i d10 8g 5.146E+01 ( 6d//r2// 8g)= 8.252E+01 a0 0.2599 4.204E+01-0.025-0.090 sqrtdel= 1.0000 8.252E+01 47 -1 0.70 0.50 ag i d10 6d ag i d10 9g 4.135E+01 ( 6d//r2// 9g)= 6.631E+01 a0 0.2568 2.714E+01-0.007-0.030 sqrtdel= 1.0000 6.631E+01 47 -1 0.70 0.50 ag i d10 6d ag i d9 5s5g 0.000E+00 ( //r2// )= 0.000E+00 a0 0.0000 0.000E+00 0.000 0.000 sqrtdel= 1.0000 0.000E+00 47 -1 0.70 0.50 ag i d10 6d ag i d9 5s6g 0.000E+00 ( //r2// )= 0.000E+00 a0 0.0000 0.000E+00 0.000 0.000 sqrtdel= 1.0000 0.000E+00 47 -1 0.70 0.50 ag i d10 6d ag i d9 5s7g 0.000E+00 ( //r2// )= 0.000E+00 a0 0.0000 0.000E+00 0.000 0.000 sqrtdel= 1.0000 0.000E+00 47 -1 0.70 0.50 ag i d10 6d ag i d9 5s8g 0.000E+00 ( //r2// )= 0.000E+00 a0 0.0000 0.000E+00 0.000 0.000 sqrtdel= 1.0000 0.000E+00 47 -1 0.70 0.50 ag i d10 6d ag i d9 5s9g 0.000E+00 ( //r2// )= 0.000E+00 a0 0.0000 0.000E+00 0.000 0.000 sqrtdel= 1.0000 0.000E+00 47 -1 0.70 0.50 ag i d10 6d ag i d10 7i 0.000E+00 ( //r2// )= 0.000E+00 a0 0.0000 0.000E+00 0.000 0.000 sqrtdel= 1.0000 0.000E+00 47 -1 0.70 0.50 ag i d10 6d ag i d10 8i 0.000E+00 ( //r2// )= 0.000E+00 a0 0.0000 0.000E+00 0.000 0.000 sqrtdel= 1.0000 0.000E+00 47 -1 0.70 0.50 ag i d10 6d ag i d10 9i 0.000E+00 ( //r2// )= 0.000E+00 a0 0.0000 0.000E+00 0.000 0.000 sqrtdel= 1.0000 0.000E+00 47 -1 0.70 0.50 ag i d10 6d ag i d9 5s7i 0.000E+00 ( //r2// )= 0.000E+00 a0 0.0000 0.000E+00 0.000 0.000 sqrtdel= 1.0000 0.000E+00 47 -1 0.70 0.50 ag i d10 6d ag i d9 5s8i 0.000E+00 ( //r2// )= 0.000E+00 a0 0.0000 0.000E+00 0.000 0.000 sqrtdel= 1.0000 0.000E+00 47 -1 0.70 0.50 ag i d10 6d ag i d9 5s9i 0.000E+00 ( //r2// )= 0.000E+00 a0 0.0000 0.000E+00 0.000 0.000 sqrtdel= 1.0000 0.000E+00 47 -1 0.70 0.50 ag i d10 6d ag i d10 9l 0.000E+00 ( //r2// )= 0.000E+00 a0 0.0000 0.000E+00 0.000 0.000 sqrtdel= 1.0000 0.000E+00 47 -1 0.70 0.50 ag i d10 6d ag i d9 5s9l 0.000E+00 ( //r2// )= 0.000E+00 a0 0.0000 0.000E+00 0.000 0.000 sqrtdel= 1.0000 0.000E+00 47 -1 0.70 0.50 ag i d10 6d ag i d9 5p2 0.000E+00 ( //r2// )= 0.000E+00 a0 0.0000 0.000E+00 0.000 0.000 sqrtdel= 1.0000 0.000E+00 47 -1 0.70 0.50 ag i d10 7d ag i d10 5s 3.437E+00 ( 7d//r2// 5s)= 3.437E+00 a0 0.9062 7.875E-01 0.135 0.941 sqrtdel= 1.0000 3.437E+00 47 -1 0.70 0.50 ag i d10 7d ag i d10 6s 1.939E+01 ( 7d//r2// 6s)= 1.939E+01 a0 0.4344 2.506E+01-0.039-0.124 sqrtdel= 1.0000 1.939E+01 47 -1 0.70 0.50 ag i d10 7d ag i d10 7s 7.254E+01 ( 7d//r2// 7s)= 7.254E+01 a0 0.2637 3.508E+02-0.219-0.400 sqrtdel= 1.0000 7.254E+01 47 -1 0.70 0.50 ag i d10 7d ag i d10 8s -1.069E+03 ( 7d//r2// 8s)=-1.069E+03 a0 -0.9921 7.615E+04-0.880-0.975 sqrtdel= 1.0000 -1.069E+03 47 -1 0.70 0.50 ag i d10 7d ag i d10 9s 1.175E+03 ( 7d//r2// 9s)= 1.175E+03 a0 0.8563 9.210E+04 0.373 0.492 sqrtdel= 1.0000 1.175E+03 47 -1 0.70 0.50 ag i d10 7d ag i d9 5s2 0.000E+00 ( //r2// )= 0.000E+00 a0 0.0000 0.000E+00 0.000 0.000 sqrtdel= 1.0000 0.000E+00 47 -1 0.70 0.50 ag i d10 7d ag i d9 5s6s 0.000E+00 ( //r2// )= 0.000E+00 a0 0.0000 0.000E+00 0.000 0.000 sqrtdel= 1.0000 0.000E+00 47 -1 0.70 0.50 ag i d10 7d ag i d9 5s7s 0.000E+00 ( //r2// )= 0.000E+00 a0 0.0000 0.000E+00 0.000 0.000 sqrtdel= 1.0000 0.000E+00 47 -1 0.70 0.50 ag i d10 7d ag i d9 5s8s 0.000E+00 ( //r2// )= 0.000E+00 a0 0.0000 0.000E+00 0.000 0.000 sqrtdel= 1.0000 0.000E+00 47 -1 0.70 0.50 ag i d10 7d ag i d9 5s9s 0.000E+00 ( //r2// )= 0.000E+00 a0 0.0000 0.000E+00 0.000 0.000 sqrtdel= 1.0000 0.000E+00 47 -1 0.70 0.50 ag i d10 7d ag i d8 5s2 6s 0.000E+00 ( //r2// )= 0.000E+00 a0 0.0000 0.000E+00 0.000 0.000 sqrtdel= 1.0000 0.000E+00 47 -1 0.70 0.50 ag i d10 7d ag i d10 5d -2.544E+01 ( 7d//r2// 5d)= 3.041E+01 a0 -0.3273 4.316E+01-0.003-0.008 sqrtdel= 1.0000 3.041E+01 47 -1 0.70 0.50 ag i d10 7d ag i d10 6d -3.063E+02 ( 7d//r2// 6d)= 3.661E+02 a0 -0.6494 6.256E+03-0.003-0.005 sqrtdel= 1.0000 3.661E+02 47 -1 0.70 0.50 ag i d10 7d ag i d10 7d 1.363E+03 ( 7d//r2// 7d)=-1.630E+03 a0 1.0000 1.239E+05 1.000 1.000 sqrtdel= 1.0000 -1.630E+03 47 -1 0.70 0.50 ag i d10 7d ag i d10 8d -7.283E+02 ( 7d//r2// 8d)= 8.705E+02 a0 -0.6007 3.536E+04-0.003-0.004 sqrtdel= 1.0000 8.705E+02 47 -1 0.70 0.50 ag i d10 7d ag i d10 9d -1.853E+02 ( 7d//r2// 9d)= 2.214E+02 a0 -0.2262 2.288E+03-0.003-0.005 sqrtdel= 1.0000 2.214E+02 47 -1 0.70 0.50 ag i d10 7d ag i d9 5s5d 0.000E+00 ( //r2// )= 0.000E+00 a0 0.0000 0.000E+00 0.000 0.000 sqrtdel= 1.0000 0.000E+00 47 -1 0.70 0.50 ag i d10 7d ag i d9 5s6d 0.000E+00 ( //r2// )= 0.000E+00 a0 0.0000 0.000E+00 0.000 0.000 sqrtdel= 1.0000 0.000E+00 47 -1 0.70 0.50 ag i d10 7d ag i d9 5s7d -3.168E+00 ( 4d//r2// 5s)=-3.168E+00 a0 -0.9615 6.690E-01-0.449-0.676 sqrtdel= 1.0000 -3.168E+00 47 -1 0.70 0.50 ag i d10 7d ag i d9 5s8d 0.000E+00 ( //r2// )= 0.000E+00 a0 0.0000 0.000E+00 0.000 0.000 sqrtdel= 1.0000 0.000E+00 47 -1 0.70 0.50 ag i d10 7d ag i d9 5s9d 0.000E+00 ( //r2// )= 0.000E+00 a0 0.0000 0.000E+00 0.000 0.000 sqrtdel= 1.0000 0.000E+00 47 -1 0.70 0.50 ag i d10 7d ag i d8 5s2 5d 0.000E+00 ( //r2// )= 0.000E+00 a0 0.0000 0.000E+00 0.000 0.000 sqrtdel= 1.0000 0.000E+00 47 -1 0.70 0.50 ag i d10 7d ag i d10 5g 7.464E+02 ( 7d//r2// 5g)= 1.197E+03 a0 0.8487 8.843E+03 0.392 0.498 sqrtdel= 1.0000 1.197E+03 47 -1 0.70 0.50 ag i d10 7d ag i d10 6g -1.393E+03 ( 7d//r2// 6g)=-2.234E+03 a0 -0.9810 3.082E+04-0.759-0.933 sqrtdel= 1.0000 -2.234E+03 47 -1 0.70 0.50 ag i d10 7d ag i d10 7g -8.073E+01 ( 7d//r2// 7g)=-1.294E+02 a0 -0.0857 1.034E+02-0.318-0.576 sqrtdel= 1.0000 -1.294E+02 47 -1 0.70 0.50 ag i d10 7d ag i d10 8g 2.537E+01 ( 7d//r2// 8g)= 4.068E+01 a0 0.0366 1.022E+01-0.177-0.420 sqrtdel= 1.0000 4.068E+01 47 -1 0.70 0.50 ag i d10 7d ag i d10 9g 3.858E+01 ( 7d//r2// 9g)= 6.186E+01 a0 0.0700 2.362E+01-0.114-0.336 sqrtdel= 1.0000 6.186E+01 47 -1 0.70 0.50 ag i d10 7d ag i d9 5s5g 0.000E+00 ( //r2// )= 0.000E+00 a0 0.0000 0.000E+00 0.000 0.000 sqrtdel= 1.0000 0.000E+00 47 -1 0.70 0.50 ag i d10 7d ag i d9 5s6g 0.000E+00 ( //r2// )= 0.000E+00 a0 0.0000 0.000E+00 0.000 0.000 sqrtdel= 1.0000 0.000E+00 47 -1 0.70 0.50 ag i d10 7d ag i d9 5s7g 0.000E+00 ( //r2// )= 0.000E+00 a0 0.0000 0.000E+00 0.000 0.000 sqrtdel= 1.0000 0.000E+00 47 -1 0.70 0.50 ag i d10 7d ag i d9 5s8g 0.000E+00 ( //r2// )= 0.000E+00 a0 0.0000 0.000E+00 0.000 0.000 sqrtdel= 1.0000 0.000E+00 47 -1 0.70 0.50 ag i d10 7d ag i d9 5s9g 0.000E+00 ( //r2// )= 0.000E+00 a0 0.0000 0.000E+00 0.000 0.000 sqrtdel= 1.0000 0.000E+00 47 -1 0.70 0.50 ag i d10 7d ag i d10 7i 0.000E+00 ( //r2// )= 0.000E+00 a0 0.0000 0.000E+00 0.000 0.000 sqrtdel= 1.0000 0.000E+00 47 -1 0.70 0.50 ag i d10 7d ag i d10 8i 0.000E+00 ( //r2// )= 0.000E+00 a0 0.0000 0.000E+00 0.000 0.000 sqrtdel= 1.0000 0.000E+00 47 -1 0.70 0.50 ag i d10 7d ag i d10 9i 0.000E+00 ( //r2// )= 0.000E+00 a0 0.0000 0.000E+00 0.000 0.000 sqrtdel= 1.0000 0.000E+00 47 -1 0.70 0.50 ag i d10 7d ag i d9 5s7i 0.000E+00 ( //r2// )= 0.000E+00 a0 0.0000 0.000E+00 0.000 0.000 sqrtdel= 1.0000 0.000E+00 47 -1 0.70 0.50 ag i d10 7d ag i d9 5s8i 0.000E+00 ( //r2// )= 0.000E+00 a0 0.0000 0.000E+00 0.000 0.000 sqrtdel= 1.0000 0.000E+00 47 -1 0.70 0.50 ag i d10 7d ag i d9 5s9i 0.000E+00 ( //r2// )= 0.000E+00 a0 0.0000 0.000E+00 0.000 0.000 sqrtdel= 1.0000 0.000E+00 47 -1 0.70 0.50 ag i d10 7d ag i d10 9l 0.000E+00 ( //r2// )= 0.000E+00 a0 0.0000 0.000E+00 0.000 0.000 sqrtdel= 1.0000 0.000E+00 47 -1 0.70 0.50 ag i d10 7d ag i d9 5s9l 0.000E+00 ( //r2// )= 0.000E+00 a0 0.0000 0.000E+00 0.000 0.000 sqrtdel= 1.0000 0.000E+00 47 -1 0.70 0.50 ag i d10 7d ag i d9 5p2 0.000E+00 ( //r2// )= 0.000E+00 a0 0.0000 0.000E+00 0.000 0.000 sqrtdel= 1.0000 0.000E+00 47 -1 0.70 0.50 ag i d10 8d ag i d10 5s 2.482E+00 ( 8d//r2// 5s)= 2.482E+00 a0 0.8802 4.108E-01 0.103 0.935 sqrtdel= 1.0000 2.482E+00 47 -1 0.70 0.50 ag i d10 8d ag i d10 6s 1.296E+01 ( 8d//r2// 6s)= 1.296E+01 a0 0.3988 1.120E+01-0.014-0.060 sqrtdel= 1.0000 1.296E+01 47 -1 0.70 0.50 ag i d10 8d ag i d10 7s 4.465E+01 ( 8d//r2// 7s)= 4.465E+01 a0 0.2436 1.329E+02-0.104-0.271 sqrtdel= 1.0000 4.465E+01 47 -1 0.70 0.50 ag i d10 8d ag i d10 8s 1.340E+02 ( 8d//r2// 8s)= 1.340E+02 a0 0.1774 1.197E+03-0.248-0.420 sqrtdel= 1.0000 1.340E+02 47 -1 0.70 0.50 ag i d10 8d ag i d10 9s -2.303E+03 ( 8d//r2// 9s)=-2.303E+03 a0 -0.9841 3.536E+05-0.848-0.960 sqrtdel= 1.0000 -2.303E+03 47 -1 0.70 0.50 ag i d10 8d ag i d9 5s2 0.000E+00 ( //r2// )= 0.000E+00 a0 0.0000 0.000E+00 0.000 0.000 sqrtdel= 1.0000 0.000E+00 47 -1 0.70 0.50 ag i d10 8d ag i d9 5s6s 0.000E+00 ( //r2// )= 0.000E+00 a0 0.0000 0.000E+00 0.000 0.000 sqrtdel= 1.0000 0.000E+00 47 -1 0.70 0.50 ag i d10 8d ag i d9 5s7s 0.000E+00 ( //r2// )= 0.000E+00 a0 0.0000 0.000E+00 0.000 0.000 sqrtdel= 1.0000 0.000E+00 47 -1 0.70 0.50 ag i d10 8d ag i d9 5s8s 0.000E+00 ( //r2// )= 0.000E+00 a0 0.0000 0.000E+00 0.000 0.000 sqrtdel= 1.0000 0.000E+00 47 -1 0.70 0.50 ag i d10 8d ag i d9 5s9s 0.000E+00 ( //r2// )= 0.000E+00 a0 0.0000 0.000E+00 0.000 0.000 sqrtdel= 1.0000 0.000E+00 47 -1 0.70 0.50 ag i d10 8d ag i d8 5s2 6s 0.000E+00 ( //r2// )= 0.000E+00 a0 0.0000 0.000E+00 0.000 0.000 sqrtdel= 1.0000 0.000E+00 47 -1 0.70 0.50 ag i d10 8d ag i d10 5d -1.268E+01 ( 8d//r2// 5d)= 1.516E+01 a0 -0.2283 1.072E+01-0.003-0.010 sqrtdel= 1.0000 1.516E+01 47 -1 0.70 0.50 ag i d10 8d ag i d10 6d -7.996E+01 ( 8d//r2// 6d)= 9.558E+01 a0 -0.2635 4.263E+02-0.003-0.006 sqrtdel= 1.0000 9.558E+01 47 -1 0.70 0.50 ag i d10 8d ag i d10 7d -7.283E+02 ( 8d//r2// 7d)= 8.705E+02 a0 -0.6007 3.536E+04-0.003-0.004 sqrtdel= 1.0000 8.705E+02 47 -1 0.70 0.50 ag i d10 8d ag i d10 8d 2.952E+03 ( 8d//r2// 8d)=-3.529E+03 a0 1.0000 5.811E+05 1.000 1.000 sqrtdel= 1.0000 -3.529E+03 47 -1 0.70 0.50 ag i d10 8d ag i d10 9d -1.468E+03 ( 8d//r2// 9d)= 1.754E+03 a0 -0.5695 1.436E+05-0.003-0.004 sqrtdel= 1.0000 1.754E+03 47 -1 0.70 0.50 ag i d10 8d ag i d9 5s5d 0.000E+00 ( //r2// )= 0.000E+00 a0 0.0000 0.000E+00 0.000 0.000 sqrtdel= 1.0000 0.000E+00 47 -1 0.70 0.50 ag i d10 8d ag i d9 5s6d 0.000E+00 ( //r2// )= 0.000E+00 a0 0.0000 0.000E+00 0.000 0.000 sqrtdel= 1.0000 0.000E+00 47 -1 0.70 0.50 ag i d10 8d ag i d9 5s7d 0.000E+00 ( //r2// )= 0.000E+00 a0 0.0000 0.000E+00 0.000 0.000 sqrtdel= 1.0000 0.000E+00 47 -1 0.70 0.50 ag i d10 8d ag i d9 5s8d -3.167E+00 ( 4d//r2// 5s)=-3.167E+00 a0 -0.9615 6.686E-01-0.449-0.676 sqrtdel= 1.0000 -3.167E+00 47 -1 0.70 0.50 ag i d10 8d ag i d9 5s9d 0.000E+00 ( //r2// )= 0.000E+00 a0 0.0000 0.000E+00 0.000 0.000 sqrtdel= 1.0000 0.000E+00 47 -1 0.70 0.50 ag i d10 8d ag i d8 5s2 5d 0.000E+00 ( //r2// )= 0.000E+00 a0 0.0000 0.000E+00 0.000 0.000 sqrtdel= 1.0000 0.000E+00 47 -1 0.70 0.50 ag i d10 8d ag i d10 5g -1.402E+02 ( 8d//r2// 5g)=-2.248E+02 a0 -0.2137 3.121E+02 0.040 0.076 sqrtdel= 1.0000 -2.248E+02 47 -1 0.70 0.50 ag i d10 8d ag i d10 6g 2.085E+03 ( 8d//r2// 6g)= 3.343E+03 a0 0.9223 6.899E+04 0.552 0.663 sqrtdel= 1.0000 3.343E+03 47 -1 0.70 0.50 ag i d10 8d ag i d10 7g -2.661E+03 ( 8d//r2// 7g)=-4.267E+03 a0 -0.9325 1.124E+05-0.644-0.847 sqrtdel= 1.0000 -4.267E+03 47 -1 0.70 0.50 ag i d10 8d ag i d10 8g -3.125E+02 ( 8d//r2// 8g)=-5.011E+02 a0 -0.1561 1.550E+03-0.324-0.579 sqrtdel= 1.0000 -5.011E+02 47 -1 0.70 0.50 ag i d10 8d ag i d10 9g -5.599E+01 ( 8d//r2// 9g)=-8.978E+01 a0 -0.0368 4.975E+01-0.204-0.455 sqrtdel= 1.0000 -8.978E+01 47 -1 0.70 0.50 ag i d10 8d ag i d9 5s5g 0.000E+00 ( //r2// )= 0.000E+00 a0 0.0000 0.000E+00 0.000 0.000 sqrtdel= 1.0000 0.000E+00 47 -1 0.70 0.50 ag i d10 8d ag i d9 5s6g 0.000E+00 ( //r2// )= 0.000E+00 a0 0.0000 0.000E+00 0.000 0.000 sqrtdel= 1.0000 0.000E+00 47 -1 0.70 0.50 ag i d10 8d ag i d9 5s7g 0.000E+00 ( //r2// )= 0.000E+00 a0 0.0000 0.000E+00 0.000 0.000 sqrtdel= 1.0000 0.000E+00 47 -1 0.70 0.50 ag i d10 8d ag i d9 5s8g 0.000E+00 ( //r2// )= 0.000E+00 a0 0.0000 0.000E+00 0.000 0.000 sqrtdel= 1.0000 0.000E+00 47 -1 0.70 0.50 ag i d10 8d ag i d9 5s9g 0.000E+00 ( //r2// )= 0.000E+00 a0 0.0000 0.000E+00 0.000 0.000 sqrtdel= 1.0000 0.000E+00 47 -1 0.70 0.50 ag i d10 8d ag i d10 7i 0.000E+00 ( //r2// )= 0.000E+00 a0 0.0000 0.000E+00 0.000 0.000 sqrtdel= 1.0000 0.000E+00 47 -1 0.70 0.50 ag i d10 8d ag i d10 8i 0.000E+00 ( //r2// )= 0.000E+00 a0 0.0000 0.000E+00 0.000 0.000 sqrtdel= 1.0000 0.000E+00 47 -1 0.70 0.50 ag i d10 8d ag i d10 9i 0.000E+00 ( //r2// )= 0.000E+00 a0 0.0000 0.000E+00 0.000 0.000 sqrtdel= 1.0000 0.000E+00 47 -1 0.70 0.50 ag i d10 8d ag i d9 5s7i 0.000E+00 ( //r2// )= 0.000E+00 a0 0.0000 0.000E+00 0.000 0.000 sqrtdel= 1.0000 0.000E+00 47 -1 0.70 0.50 ag i d10 8d ag i d9 5s8i 0.000E+00 ( //r2// )= 0.000E+00 a0 0.0000 0.000E+00 0.000 0.000 sqrtdel= 1.0000 0.000E+00 47 -1 0.70 0.50 ag i d10 8d ag i d9 5s9i 0.000E+00 ( //r2// )= 0.000E+00 a0 0.0000 0.000E+00 0.000 0.000 sqrtdel= 1.0000 0.000E+00 47 -1 0.70 0.50 ag i d10 8d ag i d10 9l 0.000E+00 ( //r2// )= 0.000E+00 a0 0.0000 0.000E+00 0.000 0.000 sqrtdel= 1.0000 0.000E+00 47 -1 0.70 0.50 ag i d10 8d ag i d9 5s9l 0.000E+00 ( //r2// )= 0.000E+00 a0 0.0000 0.000E+00 0.000 0.000 sqrtdel= 1.0000 0.000E+00 47 -1 0.70 0.50 ag i d10 8d ag i d9 5p2 0.000E+00 ( //r2// )= 0.000E+00 a0 0.0000 0.000E+00 0.000 0.000 sqrtdel= 1.0000 0.000E+00 47 -1 0.70 0.50 ag i d10 9d ag i d10 5s 1.908E+00 ( 9d//r2// 5s)= 1.908E+00 a0 0.8632 2.428E-01 0.081 0.932 sqrtdel= 1.0000 1.908E+00 47 -1 0.70 0.50 ag i d10 9d ag i d10 6s 9.500E+00 ( 9d//r2// 6s)= 9.500E+00 a0 0.3767 6.017E+00-0.004-0.025 sqrtdel= 1.0000 9.500E+00 47 -1 0.70 0.50 ag i d10 9d ag i d10 7s 3.018E+01 ( 9d//r2// 7s)= 3.018E+01 a0 0.2178 6.070E+01-0.062-0.213 sqrtdel= 1.0000 3.018E+01 47 -1 0.70 0.50 ag i d10 9d ag i d10 8s 8.492E+01 ( 9d//r2// 8s)= 8.492E+01 a0 0.1610 4.808E+02-0.130-0.301 sqrtdel= 1.0000 8.492E+01 47 -1 0.70 0.50 ag i d10 9d ag i d10 9s 2.241E+02 ( 9d//r2// 9s)= 2.241E+02 a0 0.1321 3.348E+03-0.258-0.417 sqrtdel= 1.0000 2.241E+02 47 -1 0.70 0.50 ag i d10 9d ag i d9 5s2 0.000E+00 ( //r2// )= 0.000E+00 a0 0.0000 0.000E+00 0.000 0.000 sqrtdel= 1.0000 0.000E+00 47 -1 0.70 0.50 ag i d10 9d ag i d9 5s6s 0.000E+00 ( //r2// )= 0.000E+00 a0 0.0000 0.000E+00 0.000 0.000 sqrtdel= 1.0000 0.000E+00 47 -1 0.70 0.50 ag i d10 9d ag i d9 5s7s 0.000E+00 ( //r2// )= 0.000E+00 a0 0.0000 0.000E+00 0.000 0.000 sqrtdel= 1.0000 0.000E+00 47 -1 0.70 0.50 ag i d10 9d ag i d9 5s8s 0.000E+00 ( //r2// )= 0.000E+00 a0 0.0000 0.000E+00 0.000 0.000 sqrtdel= 1.0000 0.000E+00 47 -1 0.70 0.50 ag i d10 9d ag i d9 5s9s 0.000E+00 ( //r2// )= 0.000E+00 a0 0.0000 0.000E+00 0.000 0.000 sqrtdel= 1.0000 0.000E+00 47 -1 0.70 0.50 ag i d10 9d ag i d8 5s2 6s 0.000E+00 ( //r2// )= 0.000E+00 a0 0.0000 0.000E+00 0.000 0.000 sqrtdel= 1.0000 0.000E+00 47 -1 0.70 0.50 ag i d10 9d ag i d10 5d -7.986E+00 ( 9d//r2// 5d)= 9.545E+00 a0 -0.1866 4.252E+00-0.003-0.012 sqrtdel= 1.0000 9.545E+00 47 -1 0.70 0.50 ag i d10 9d ag i d10 6d -3.902E+01 ( 9d//r2// 6d)= 4.663E+01 a0 -0.1736 1.015E+02-0.003-0.008 sqrtdel= 1.0000 4.663E+01 47 -1 0.70 0.50 ag i d10 9d ag i d10 7d -1.853E+02 ( 9d//r2// 7d)= 2.214E+02 a0 -0.2262 2.288E+03-0.003-0.005 sqrtdel= 1.0000 2.214E+02 47 -1 0.70 0.50 ag i d10 9d ag i d10 8d -1.468E+03 ( 9d//r2// 8d)= 1.754E+03 a0 -0.5695 1.436E+05-0.003-0.004 sqrtdel= 1.0000 1.754E+03 47 -1 0.70 0.50 ag i d10 9d ag i d10 9d 5.607E+03 ( 9d//r2// 9d)=-6.702E+03 a0 1.0000 2.096E+06 1.000 1.000 sqrtdel= 1.0000 -6.702E+03 47 -1 0.70 0.50 ag i d10 9d ag i d9 5s5d 0.000E+00 ( //r2// )= 0.000E+00 a0 0.0000 0.000E+00 0.000 0.000 sqrtdel= 1.0000 0.000E+00 47 -1 0.70 0.50 ag i d10 9d ag i d9 5s6d 0.000E+00 ( //r2// )= 0.000E+00 a0 0.0000 0.000E+00 0.000 0.000 sqrtdel= 1.0000 0.000E+00 47 -1 0.70 0.50 ag i d10 9d ag i d9 5s7d 0.000E+00 ( //r2// )= 0.000E+00 a0 0.0000 0.000E+00 0.000 0.000 sqrtdel= 1.0000 0.000E+00 47 -1 0.70 0.50 ag i d10 9d ag i d9 5s8d 0.000E+00 ( //r2// )= 0.000E+00 a0 0.0000 0.000E+00 0.000 0.000 sqrtdel= 1.0000 0.000E+00 47 -1 0.70 0.50 ag i d10 9d ag i d9 5s9d -3.166E+00 ( 4d//r2// 5s)=-3.166E+00 a0 -0.9614 6.683E-01-0.449-0.676 sqrtdel= 1.0000 -3.166E+00 47 -1 0.70 0.50 ag i d10 9d ag i d8 5s2 5d 0.000E+00 ( //r2// )= 0.000E+00 a0 0.0000 0.000E+00 0.000 0.000 sqrtdel= 1.0000 0.000E+00 47 -1 0.70 0.50 ag i d10 9d ag i d10 5g -3.624E+01 ( 9d//r2// 5g)=-5.811E+01 a0 -0.0785 2.085E+01 0.019 0.050 sqrtdel= 1.0000 -5.811E+01 47 -1 0.70 0.50 ag i d10 9d ag i d10 6g -4.368E+02 ( 9d//r2// 6g)=-7.004E+02 a0 -0.2479 3.028E+03 0.058 0.099 sqrtdel= 1.0000 -7.004E+02 47 -1 0.70 0.50 ag i d10 9d ag i d10 7g 4.442E+03 ( 9d//r2// 7g)= 7.123E+03 a0 0.9549 3.132E+05 0.655 0.763 sqrtdel= 1.0000 7.123E+03 47 -1 0.70 0.50 ag i d10 9d ag i d10 8g -4.550E+03 ( 9d//r2// 8g)=-7.296E+03 a0 -0.8790 3.286E+05-0.547-0.746 sqrtdel= 1.0000 -7.296E+03 47 -1 0.70 0.50 ag i d10 9d ag i d10 9g -6.760E+02 ( 9d//r2// 9g)=-1.084E+03 a0 -0.1795 7.254E+03-0.302-0.540 sqrtdel= 1.0000 -1.084E+03 47 -1 0.70 0.50 ag i d10 9d ag i d9 5s5g 0.000E+00 ( //r2// )= 0.000E+00 a0 0.0000 0.000E+00 0.000 0.000 sqrtdel= 1.0000 0.000E+00 47 -1 0.70 0.50 ag i d10 9d ag i d9 5s6g 0.000E+00 ( //r2// )= 0.000E+00 a0 0.0000 0.000E+00 0.000 0.000 sqrtdel= 1.0000 0.000E+00 47 -1 0.70 0.50 ag i d10 9d ag i d9 5s7g 0.000E+00 ( //r2// )= 0.000E+00 a0 0.0000 0.000E+00 0.000 0.000 sqrtdel= 1.0000 0.000E+00 47 -1 0.70 0.50 ag i d10 9d ag i d9 5s8g 0.000E+00 ( //r2// )= 0.000E+00 a0 0.0000 0.000E+00 0.000 0.000 sqrtdel= 1.0000 0.000E+00 47 -1 0.70 0.50 ag i d10 9d ag i d9 5s9g 0.000E+00 ( //r2// )= 0.000E+00 a0 0.0000 0.000E+00 0.000 0.000 sqrtdel= 1.0000 0.000E+00 47 -1 0.70 0.50 ag i d10 9d ag i d10 7i 0.000E+00 ( //r2// )= 0.000E+00 a0 0.0000 0.000E+00 0.000 0.000 sqrtdel= 1.0000 0.000E+00 47 -1 0.70 0.50 ag i d10 9d ag i d10 8i 0.000E+00 ( //r2// )= 0.000E+00 a0 0.0000 0.000E+00 0.000 0.000 sqrtdel= 1.0000 0.000E+00 47 -1 0.70 0.50 ag i d10 9d ag i d10 9i 0.000E+00 ( //r2// )= 0.000E+00 a0 0.0000 0.000E+00 0.000 0.000 sqrtdel= 1.0000 0.000E+00 47 -1 0.70 0.50 ag i d10 9d ag i d9 5s7i 0.000E+00 ( //r2// )= 0.000E+00 a0 0.0000 0.000E+00 0.000 0.000 sqrtdel= 1.0000 0.000E+00 47 -1 0.70 0.50 ag i d10 9d ag i d9 5s8i 0.000E+00 ( //r2// )= 0.000E+00 a0 0.0000 0.000E+00 0.000 0.000 sqrtdel= 1.0000 0.000E+00 47 -1 0.70 0.50 ag i d10 9d ag i d9 5s9i 0.000E+00 ( //r2// )= 0.000E+00 a0 0.0000 0.000E+00 0.000 0.000 sqrtdel= 1.0000 0.000E+00 47 -1 0.70 0.50 ag i d10 9d ag i d10 9l 0.000E+00 ( //r2// )= 0.000E+00 a0 0.0000 0.000E+00 0.000 0.000 sqrtdel= 1.0000 0.000E+00 47 -1 0.70 0.50 ag i d10 9d ag i d9 5s9l 0.000E+00 ( //r2// )= 0.000E+00 a0 0.0000 0.000E+00 0.000 0.000 sqrtdel= 1.0000 0.000E+00 47 -1 0.70 0.50 ag i d10 9d ag i d9 5p2 0.000E+00 ( //r2// )= 0.000E+00 a0 0.0000 0.000E+00 0.000 0.000 sqrtdel= 1.0000 0.000E+00 47 -1 0.70 0.50 ag i d9 5s5d ag i d10 5s -1.035E+00 ( 5d//r2// 4d)= 1.237E+00 a0 -0.9011 7.136E-02-0.015-0.132 sqrtdel= 1.0000 1.237E+00 47 -1 0.70 0.50 ag i d9 5s5d ag i d10 6s 0.000E+00 ( //r2// )= 0.000E+00 a0 0.0000 0.000E+00 0.000 0.000 sqrtdel= 1.0000 0.000E+00 47 -1 0.70 0.50 ag i d9 5s5d ag i d10 7s 0.000E+00 ( //r2// )= 0.000E+00 a0 0.0000 0.000E+00 0.000 0.000 sqrtdel= 1.0000 0.000E+00 47 -1 0.70 0.50 ag i d9 5s5d ag i d10 8s 0.000E+00 ( //r2// )= 0.000E+00 a0 0.0000 0.000E+00 0.000 0.000 sqrtdel= 1.0000 0.000E+00 47 -1 0.70 0.50 ag i d9 5s5d ag i d10 9s 0.000E+00 ( //r2// )= 0.000E+00 a0 0.0000 0.000E+00 0.000 0.000 sqrtdel= 1.0000 0.000E+00 47 -1 0.70 0.50 ag i d9 5s5d ag i d9 5s2 8.933E+00 ( 5d//r2// 5s)= 8.933E+00 a0 0.9972 5.320E+00 0.304 0.964 sqrtdel= 1.0000 8.933E+00 47 -1 0.70 0.50 ag i d9 5s5d ag i d9 5s6s -9.752E+01 ( 5d//r2// 6s)=-9.752E+01 a0 -0.9978 6.340E+02-0.925-0.967 sqrtdel= 1.0000 -9.752E+01 47 -1 0.70 0.50 ag i d9 5s5d ag i d9 5s7s 1.171E+02 ( 5d//r2// 7s)= 1.171E+02 a0 0.8418 9.138E+02 0.230 0.340 sqrtdel= 1.0000 1.171E+02 47 -1 0.70 0.50 ag i d9 5s5d ag i d9 5s8s 3.733E+00 ( 5d//r2// 8s)= 3.733E+00 a0 0.0442 9.288E-01 0.053 0.131 sqrtdel= 1.0000 3.733E+00 47 -1 0.70 0.50 ag i d9 5s5d ag i d9 5s9s 1.151E+00 ( 5d//r2// 9s)= 1.151E+00 a0 0.0203 8.838E-02 0.026 0.093 sqrtdel= 1.0000 1.151E+00 47 -1 0.70 0.50 ag i d9 5s5d ag i d8 5s2 6s 0.000E+00 ( //r2// )= 0.000E+00 a0 0.0000 0.000E+00 0.000 0.000 sqrtdel= 1.0000 0.000E+00 47 -1 0.70 0.50 ag i d9 5s5d ag i d10 5d -3.175E+00 ( 5s//r2// 4d)=-3.175E+00 a0 -0.9617 6.721E-01-0.448-0.677 sqrtdel= 1.0000 -3.175E+00 47 -1 0.70 0.50 ag i d9 5s5d ag i d10 6d 0.000E+00 ( //r2// )= 0.000E+00 a0 0.0000 0.000E+00 0.000 0.000 sqrtdel= 1.0000 0.000E+00 47 -1 0.70 0.50 ag i d9 5s5d ag i d10 7d 0.000E+00 ( //r2// )= 0.000E+00 a0 0.0000 0.000E+00 0.000 0.000 sqrtdel= 1.0000 0.000E+00 47 -1 0.70 0.50 ag i d9 5s5d ag i d10 8d 0.000E+00 ( //r2// )= 0.000E+00 a0 0.0000 0.000E+00 0.000 0.000 sqrtdel= 1.0000 0.000E+00 47 -1 0.70 0.50 ag i d9 5s5d ag i d10 9d 0.000E+00 ( //r2// )= 0.000E+00 a0 0.0000 0.000E+00 0.000 0.000 sqrtdel= 1.0000 0.000E+00 47 -1 0.70 0.50 ag i d9 5s5d ag i d9 5s5d 1.194E+02 ( 5d//r2// 5d)=-1.427E+02 a0 1.0000 9.507E+02 1.000 1.000 sqrtdel= 1.0000 -1.427E+02 47 -1 0.70 0.50 ag i d9 5s5d ag i d9 5s6d -9.118E+01 ( 5d//r2// 6d)= 1.090E+02 a0 -0.7451 5.542E+02-0.009-0.015 sqrtdel= 1.0000 1.090E+02 47 -1 0.70 0.50 ag i d9 5s5d ag i d9 5s7d -2.364E+01 ( 5d//r2// 7d)= 2.825E+01 a0 -0.3243 3.725E+01-0.008-0.022 sqrtdel= 1.0000 2.825E+01 47 -1 0.70 0.50 ag i d9 5s5d ag i d9 5s8d -1.149E+01 ( 5d//r2// 8d)= 1.374E+01 a0 -0.2212 8.808E+00-0.007-0.027 sqrtdel= 1.0000 1.374E+01 47 -1 0.70 0.50 ag i d9 5s5d ag i d9 5s9d -7.106E+00 ( 5d//r2// 9d)= 8.494E+00 a0 -0.1777 3.367E+00-0.007-0.031 sqrtdel= 1.0000 8.494E+00 47 -1 0.70 0.50 ag i d9 5s5d ag i d8 5s2 5d -2.799E+00 ( 4d//r2// 5s)=-2.799E+00 a0 -0.9545 5.222E-01-0.423-0.648 sqrtdel= 1.0000 -2.799E+00 47 -1 0.70 0.50 ag i d9 5s5d ag i d10 5g 0.000E+00 ( //r2// )= 0.000E+00 a0 0.0000 0.000E+00 0.000 0.000 sqrtdel= 1.0000 0.000E+00 47 -1 0.70 0.50 ag i d9 5s5d ag i d10 6g 0.000E+00 ( //r2// )= 0.000E+00 a0 0.0000 0.000E+00 0.000 0.000 sqrtdel= 1.0000 0.000E+00 47 -1 0.70 0.50 ag i d9 5s5d ag i d10 7g 0.000E+00 ( //r2// )= 0.000E+00 a0 0.0000 0.000E+00 0.000 0.000 sqrtdel= 1.0000 0.000E+00 47 -1 0.70 0.50 ag i d9 5s5d ag i d10 8g 0.000E+00 ( //r2// )= 0.000E+00 a0 0.0000 0.000E+00 0.000 0.000 sqrtdel= 1.0000 0.000E+00 47 -1 0.70 0.50 ag i d9 5s5d ag i d10 9g 0.000E+00 ( //r2// )= 0.000E+00 a0 0.0000 0.000E+00 0.000 0.000 sqrtdel= 1.0000 0.000E+00 47 -1 0.70 0.50 ag i d9 5s5d ag i d9 5s5g 1.047E+02 ( 5d//r2// 5g)= 1.678E+02 a0 1.0000 1.739E+02 0.338 1.000 sqrtdel= 1.0000 1.678E+02 47 -1 0.70 0.50 ag i d9 5s5d ag i d9 5s6g 6.123E+01 ( 5d//r2// 6g)= 9.819E+01 a0 0.8955 5.951E+01 0.258 0.980 sqrtdel= 1.0000 9.819E+01 47 -1 0.70 0.50 ag i d9 5s5d ag i d9 5s7g 4.130E+01 ( 5d//r2// 7g)= 6.622E+01 a0 0.8072 2.707E+01 0.201 0.957 sqrtdel= 1.0000 6.622E+01 47 -1 0.70 0.50 ag i d9 5s5d ag i d9 5s8g 3.046E+01 ( 5d//r2// 8g)= 4.884E+01 a0 0.7509 1.472E+01 0.161 0.941 sqrtdel= 1.0000 4.884E+01 47 -1 0.70 0.50 ag i d9 5s5d ag i d9 5s9g 2.379E+01 ( 5d//r2// 9g)= 3.815E+01 a0 0.7141 8.985E+00 0.133 0.929 sqrtdel= 1.0000 3.815E+01 47 -1 0.70 0.50 ag i d9 5s5d ag i d10 7i 0.000E+00 ( //r2// )= 0.000E+00 a0 0.0000 0.000E+00 0.000 0.000 sqrtdel= 1.0000 0.000E+00 47 -1 0.70 0.50 ag i d9 5s5d ag i d10 8i 0.000E+00 ( //r2// )= 0.000E+00 a0 0.0000 0.000E+00 0.000 0.000 sqrtdel= 1.0000 0.000E+00 47 -1 0.70 0.50 ag i d9 5s5d ag i d10 9i 0.000E+00 ( //r2// )= 0.000E+00 a0 0.0000 0.000E+00 0.000 0.000 sqrtdel= 1.0000 0.000E+00 47 -1 0.70 0.50 ag i d9 5s5d ag i d9 5s7i 0.000E+00 ( //r2// )= 0.000E+00 a0 0.0000 0.000E+00 0.000 0.000 sqrtdel= 1.0000 0.000E+00 47 -1 0.70 0.50 ag i d9 5s5d ag i d9 5s8i 0.000E+00 ( //r2// )= 0.000E+00 a0 0.0000 0.000E+00 0.000 0.000 sqrtdel= 1.0000 0.000E+00 47 -1 0.70 0.50 ag i d9 5s5d ag i d9 5s9i 0.000E+00 ( //r2// )= 0.000E+00 a0 0.0000 0.000E+00 0.000 0.000 sqrtdel= 1.0000 0.000E+00 47 -1 0.70 0.50 ag i d9 5s5d ag i d10 9l 0.000E+00 ( //r2// )= 0.000E+00 a0 0.0000 0.000E+00 0.000 0.000 sqrtdel= 1.0000 0.000E+00 47 -1 0.70 0.50 ag i d9 5s5d ag i d9 5s9l 0.000E+00 ( //r2// )= 0.000E+00 a0 0.0000 0.000E+00 0.000 0.000 sqrtdel= 1.0000 0.000E+00 47 -1 0.70 0.50 ag i d9 5s5d ag i d9 5p2 0.000E+00 ( //r2// )= 0.000E+00 a0 0.0000 0.000E+00 0.000 0.000 sqrtdel= 1.0000 0.000E+00 47 -1 0.70 0.50 ag i d9 5s6d ag i d10 5s -6.810E-01 ( 6d//r2// 4d)= 8.140E-01 a0 -0.8885 3.092E-02-0.010-0.120 sqrtdel= 1.0000 8.140E-01 47 -1 0.70 0.50 ag i d9 5s6d ag i d10 6s 0.000E+00 ( //r2// )= 0.000E+00 a0 0.0000 0.000E+00 0.000 0.000 sqrtdel= 1.0000 0.000E+00 47 -1 0.70 0.50 ag i d9 5s6d ag i d10 7s 0.000E+00 ( //r2// )= 0.000E+00 a0 0.0000 0.000E+00 0.000 0.000 sqrtdel= 1.0000 0.000E+00 47 -1 0.70 0.50 ag i d9 5s6d ag i d10 8s 0.000E+00 ( //r2// )= 0.000E+00 a0 0.0000 0.000E+00 0.000 0.000 sqrtdel= 1.0000 0.000E+00 47 -1 0.70 0.50 ag i d9 5s6d ag i d10 9s 0.000E+00 ( //r2// )= 0.000E+00 a0 0.0000 0.000E+00 0.000 0.000 sqrtdel= 1.0000 0.000E+00 47 -1 0.70 0.50 ag i d9 5s6d ag i d9 5s2 4.813E+00 ( 6d//r2// 5s)= 4.813E+00 a0 0.9527 1.545E+00 0.200 0.956 sqrtdel= 1.0000 4.813E+00 47 -1 0.70 0.50 ag i d9 5s6d ag i d9 5s6s 3.063E+01 ( 6d//r2// 6s)= 3.063E+01 a0 0.4720 6.254E+01-0.129-0.276 sqrtdel= 1.0000 3.063E+01 47 -1 0.70 0.50 ag i d9 5s6d ag i d9 5s7s -3.800E+02 ( 6d//r2// 7s)=-3.800E+02 a0 -0.9987 9.629E+03-0.913-0.983 sqrtdel= 1.0000 -3.800E+02 47 -1 0.70 0.50 ag i d9 5s6d ag i d9 5s8s 4.318E+02 ( 6d//r2// 8s)= 4.318E+02 a0 0.8491 1.243E+04 0.316 0.429 sqrtdel= 1.0000 4.318E+02 47 -1 0.70 0.50 ag i d9 5s6d ag i d9 5s9s 1.067E+01 ( 6d//r2// 9s)= 1.067E+01 a0 0.0321 7.593E+00 0.081 0.173 sqrtdel= 1.0000 1.067E+01 47 -1 0.70 0.50 ag i d9 5s6d ag i d8 5s2 6s 0.000E+00 ( //r2// )= 0.000E+00 a0 0.0000 0.000E+00 0.000 0.000 sqrtdel= 1.0000 0.000E+00 47 -1 0.70 0.50 ag i d9 5s6d ag i d10 5d 0.000E+00 ( //r2// )= 0.000E+00 a0 0.0000 0.000E+00 0.000 0.000 sqrtdel= 1.0000 0.000E+00 47 -1 0.70 0.50 ag i d9 5s6d ag i d10 6d -3.170E+00 ( 5s//r2// 4d)=-3.170E+00 a0 -0.9616 6.700E-01-0.449-0.676 sqrtdel= 1.0000 -3.170E+00 47 -1 0.70 0.50 ag i d9 5s6d ag i d10 7d 0.000E+00 ( //r2// )= 0.000E+00 a0 0.0000 0.000E+00 0.000 0.000 sqrtdel= 1.0000 0.000E+00 47 -1 0.70 0.50 ag i d9 5s6d ag i d10 8d 0.000E+00 ( //r2// )= 0.000E+00 a0 0.0000 0.000E+00 0.000 0.000 sqrtdel= 1.0000 0.000E+00 47 -1 0.70 0.50 ag i d9 5s6d ag i d10 9d 0.000E+00 ( //r2// )= 0.000E+00 a0 0.0000 0.000E+00 0.000 0.000 sqrtdel= 1.0000 0.000E+00 47 -1 0.70 0.50 ag i d9 5s6d ag i d9 5s5d -9.118E+01 ( 6d//r2// 5d)= 1.090E+02 a0 -0.7451 5.542E+02-0.009-0.015 sqrtdel= 1.0000 1.090E+02 47 -1 0.70 0.50 ag i d9 5s6d ag i d9 5s6d 4.799E+02 ( 6d//r2// 6d)=-5.736E+02 a0 1.0000 1.536E+04 1.000 1.000 sqrtdel= 1.0000 -5.736E+02 47 -1 0.70 0.50 ag i d9 5s6d ag i d9 5s7d -2.946E+02 ( 6d//r2// 7d)= 3.521E+02 a0 -0.6614 5.787E+03-0.009-0.013 sqrtdel= 1.0000 3.521E+02 47 -1 0.70 0.50 ag i d9 5s6d ag i d9 5s8d -7.560E+01 ( 6d//r2// 8d)= 9.036E+01 a0 -0.2641 3.810E+02-0.008-0.018 sqrtdel= 1.0000 9.036E+01 47 -1 0.70 0.50 ag i d9 5s6d ag i d9 5s9d -3.637E+01 ( 6d//r2// 9d)= 4.347E+01 a0 -0.1719 8.820E+01-0.007-0.021 sqrtdel= 1.0000 4.347E+01 47 -1 0.70 0.50 ag i d9 5s6d ag i d8 5s2 5d 0.000E+00 ( //r2// )= 0.000E+00 a0 0.0000 0.000E+00 0.000 0.000 sqrtdel= 1.0000 0.000E+00 47 -1 0.70 0.50 ag i d9 5s6d ag i d10 5g 0.000E+00 ( //r2// )= 0.000E+00 a0 0.0000 0.000E+00 0.000 0.000 sqrtdel= 1.0000 0.000E+00 47 -1 0.70 0.50 ag i d9 5s6d ag i d10 6g 0.000E+00 ( //r2// )= 0.000E+00 a0 0.0000 0.000E+00 0.000 0.000 sqrtdel= 1.0000 0.000E+00 47 -1 0.70 0.50 ag i d9 5s6d ag i d10 7g 0.000E+00 ( //r2// )= 0.000E+00 a0 0.0000 0.000E+00 0.000 0.000 sqrtdel= 1.0000 0.000E+00 47 -1 0.70 0.50 ag i d9 5s6d ag i d10 8g 0.000E+00 ( //r2// )= 0.000E+00 a0 0.0000 0.000E+00 0.000 0.000 sqrtdel= 1.0000 0.000E+00 47 -1 0.70 0.50 ag i d9 5s6d ag i d10 9g 0.000E+00 ( //r2// )= 0.000E+00 a0 0.0000 0.000E+00 0.000 0.000 sqrtdel= 1.0000 0.000E+00 47 -1 0.70 0.50 ag i d9 5s6d ag i d9 5s5g -5.608E+02 ( 6d//r2// 5g)=-8.993E+02 a0 -0.9954 4.993E+03-0.838-0.960 sqrtdel= 1.0000 -8.993E+02 47 -1 0.70 0.50 ag i d9 5s6d ag i d9 5s6g 2.156E+01 ( 6d//r2// 6g)= 3.457E+01 a0 0.0639 7.379E+00-0.240-0.487 sqrtdel= 1.0000 3.457E+01 47 -1 0.70 0.50 ag i d9 5s6d ag i d9 5s7g 4.566E+01 ( 6d//r2// 7g)= 7.322E+01 a0 0.1926 3.309E+01-0.099-0.280 sqrtdel= 1.0000 7.322E+01 47 -1 0.70 0.50 ag i d9 5s6d ag i d9 5s8g 4.029E+01 ( 6d//r2// 8g)= 6.461E+01 a0 0.2185 2.577E+01-0.049-0.176 sqrtdel= 1.0000 6.461E+01 47 -1 0.70 0.50 ag i d9 5s6d ag i d9 5s9g 3.356E+01 ( 6d//r2// 9g)= 5.381E+01 a0 0.2237 1.787E+01-0.026-0.115 sqrtdel= 1.0000 5.381E+01 47 -1 0.70 0.50 ag i d9 5s6d ag i d10 7i 0.000E+00 ( //r2// )= 0.000E+00 a0 0.0000 0.000E+00 0.000 0.000 sqrtdel= 1.0000 0.000E+00 47 -1 0.70 0.50 ag i d9 5s6d ag i d10 8i 0.000E+00 ( //r2// )= 0.000E+00 a0 0.0000 0.000E+00 0.000 0.000 sqrtdel= 1.0000 0.000E+00 47 -1 0.70 0.50 ag i d9 5s6d ag i d10 9i 0.000E+00 ( //r2// )= 0.000E+00 a0 0.0000 0.000E+00 0.000 0.000 sqrtdel= 1.0000 0.000E+00 47 -1 0.70 0.50 ag i d9 5s6d ag i d9 5s7i 0.000E+00 ( //r2// )= 0.000E+00 a0 0.0000 0.000E+00 0.000 0.000 sqrtdel= 1.0000 0.000E+00 47 -1 0.70 0.50 ag i d9 5s6d ag i d9 5s8i 0.000E+00 ( //r2// )= 0.000E+00 a0 0.0000 0.000E+00 0.000 0.000 sqrtdel= 1.0000 0.000E+00 47 -1 0.70 0.50 ag i d9 5s6d ag i d9 5s9i 0.000E+00 ( //r2// )= 0.000E+00 a0 0.0000 0.000E+00 0.000 0.000 sqrtdel= 1.0000 0.000E+00 47 -1 0.70 0.50 ag i d9 5s6d ag i d10 9l 0.000E+00 ( //r2// )= 0.000E+00 a0 0.0000 0.000E+00 0.000 0.000 sqrtdel= 1.0000 0.000E+00 47 -1 0.70 0.50 ag i d9 5s6d ag i d9 5s9l 0.000E+00 ( //r2// )= 0.000E+00 a0 0.0000 0.000E+00 0.000 0.000 sqrtdel= 1.0000 0.000E+00 47 -1 0.70 0.50 ag i d9 5s6d ag i d9 5p2 0.000E+00 ( //r2// )= 0.000E+00 a0 0.0000 0.000E+00 0.000 0.000 sqrtdel= 1.0000 0.000E+00 47 -1 0.70 0.50 ag i d9 5s7d ag i d10 5s -4.840E-01 ( 7d//r2// 4d)= 5.784E-01 a0 -0.8797 1.561E-02-0.007-0.116 sqrtdel= 1.0000 5.784E-01 47 -1 0.70 0.50 ag i d9 5s7d ag i d10 6s 0.000E+00 ( //r2// )= 0.000E+00 a0 0.0000 0.000E+00 0.000 0.000 sqrtdel= 1.0000 0.000E+00 47 -1 0.70 0.50 ag i d9 5s7d ag i d10 7s 0.000E+00 ( //r2// )= 0.000E+00 a0 0.0000 0.000E+00 0.000 0.000 sqrtdel= 1.0000 0.000E+00 47 -1 0.70 0.50 ag i d9 5s7d ag i d10 8s 0.000E+00 ( //r2// )= 0.000E+00 a0 0.0000 0.000E+00 0.000 0.000 sqrtdel= 1.0000 0.000E+00 47 -1 0.70 0.50 ag i d9 5s7d ag i d10 9s 0.000E+00 ( //r2// )= 0.000E+00 a0 0.0000 0.000E+00 0.000 0.000 sqrtdel= 1.0000 0.000E+00 47 -1 0.70 0.50 ag i d9 5s7d ag i d9 5s2 3.115E+00 ( 7d//r2// 5s)= 3.115E+00 a0 0.9086 6.471E-01 0.143 0.949 sqrtdel= 1.0000 3.115E+00 47 -1 0.70 0.50 ag i d9 5s7d ag i d9 5s6s 1.852E+01 ( 7d//r2// 6s)= 1.852E+01 a0 0.4567 2.287E+01-0.033-0.106 sqrtdel= 1.0000 1.852E+01 47 -1 0.70 0.50 ag i d9 5s7d ag i d9 5s7s 7.099E+01 ( 7d//r2// 7s)= 7.099E+01 a0 0.2760 3.360E+02-0.215-0.394 sqrtdel= 1.0000 7.099E+01 47 -1 0.70 0.50 ag i d9 5s7d ag i d9 5s8s -1.014E+03 ( 7d//r2// 8s)=-1.014E+03 a0 -0.9928 6.856E+04-0.882-0.975 sqrtdel= 1.0000 -1.014E+03 47 -1 0.70 0.50 ag i d9 5s7d ag i d9 5s9s 1.115E+03 ( 7d//r2// 9s)= 1.115E+03 a0 0.8558 8.283E+04 0.369 0.487 sqrtdel= 1.0000 1.115E+03 47 -1 0.70 0.50 ag i d9 5s7d ag i d8 5s2 6s 0.000E+00 ( //r2// )= 0.000E+00 a0 0.0000 0.000E+00 0.000 0.000 sqrtdel= 1.0000 0.000E+00 47 -1 0.70 0.50 ag i d9 5s7d ag i d10 5d 0.000E+00 ( //r2// )= 0.000E+00 a0 0.0000 0.000E+00 0.000 0.000 sqrtdel= 1.0000 0.000E+00 47 -1 0.70 0.50 ag i d9 5s7d ag i d10 6d 0.000E+00 ( //r2// )= 0.000E+00 a0 0.0000 0.000E+00 0.000 0.000 sqrtdel= 1.0000 0.000E+00 47 -1 0.70 0.50 ag i d9 5s7d ag i d10 7d -3.168E+00 ( 5s//r2// 4d)=-3.168E+00 a0 -0.9615 6.690E-01-0.449-0.676 sqrtdel= 1.0000 -3.168E+00 47 -1 0.70 0.50 ag i d9 5s7d ag i d10 8d 0.000E+00 ( //r2// )= 0.000E+00 a0 0.0000 0.000E+00 0.000 0.000 sqrtdel= 1.0000 0.000E+00 47 -1 0.70 0.50 ag i d9 5s7d ag i d10 9d 0.000E+00 ( //r2// )= 0.000E+00 a0 0.0000 0.000E+00 0.000 0.000 sqrtdel= 1.0000 0.000E+00 47 -1 0.70 0.50 ag i d9 5s7d ag i d9 5s5d -2.364E+01 ( 7d//r2// 5d)= 2.825E+01 a0 -0.3243 3.725E+01-0.008-0.022 sqrtdel= 1.0000 2.825E+01 47 -1 0.70 0.50 ag i d9 5s7d ag i d9 5s6d -2.946E+02 ( 7d//r2// 6d)= 3.521E+02 a0 -0.6614 5.787E+03-0.009-0.013 sqrtdel= 1.0000 3.521E+02 47 -1 0.70 0.50 ag i d9 5s7d ag i d9 5s7d 1.290E+03 ( 7d//r2// 7d)=-1.542E+03 a0 1.0000 1.109E+05 1.000 1.000 sqrtdel= 1.0000 -1.542E+03 47 -1 0.70 0.50 ag i d9 5s7d ag i d9 5s8d -7.018E+02 ( 7d//r2// 8d)= 8.388E+02 a0 -0.6093 3.284E+04-0.007-0.011 sqrtdel= 1.0000 8.388E+02 47 -1 0.70 0.50 ag i d9 5s7d ag i d9 5s9d -1.767E+02 ( 7d//r2// 9d)= 2.112E+02 a0 -0.2273 2.081E+03-0.007-0.014 sqrtdel= 1.0000 2.112E+02 47 -1 0.70 0.50 ag i d9 5s7d ag i d8 5s2 5d 0.000E+00 ( //r2// )= 0.000E+00 a0 0.0000 0.000E+00 0.000 0.000 sqrtdel= 1.0000 0.000E+00 47 -1 0.70 0.50 ag i d9 5s7d ag i d10 5g 0.000E+00 ( //r2// )= 0.000E+00 a0 0.0000 0.000E+00 0.000 0.000 sqrtdel= 1.0000 0.000E+00 47 -1 0.70 0.50 ag i d9 5s7d ag i d10 6g 0.000E+00 ( //r2// )= 0.000E+00 a0 0.0000 0.000E+00 0.000 0.000 sqrtdel= 1.0000 0.000E+00 47 -1 0.70 0.50 ag i d9 5s7d ag i d10 7g 0.000E+00 ( //r2// )= 0.000E+00 a0 0.0000 0.000E+00 0.000 0.000 sqrtdel= 1.0000 0.000E+00 47 -1 0.70 0.50 ag i d9 5s7d ag i d10 8g 0.000E+00 ( //r2// )= 0.000E+00 a0 0.0000 0.000E+00 0.000 0.000 sqrtdel= 1.0000 0.000E+00 47 -1 0.70 0.50 ag i d9 5s7d ag i d10 9g 0.000E+00 ( //r2// )= 0.000E+00 a0 0.0000 0.000E+00 0.000 0.000 sqrtdel= 1.0000 0.000E+00 47 -1 0.70 0.50 ag i d9 5s7d ag i d9 5s5g 7.657E+02 ( 7d//r2// 5g)= 1.228E+03 a0 0.8694 9.305E+03 0.437 0.543 sqrtdel= 1.0000 1.228E+03 47 -1 0.70 0.50 ag i d9 5s7d ag i d9 5s6g -1.286E+03 ( 7d//r2// 6g)=-2.062E+03 a0 -0.9709 2.625E+04-0.712-0.913 sqrtdel= 1.0000 -2.062E+03 47 -1 0.70 0.50 ag i d9 5s7d ag i d9 5s7g -1.356E+02 ( 7d//r2// 7g)=-2.174E+02 a0 -0.1554 2.917E+02-0.331-0.619 sqrtdel= 1.0000 -2.174E+02 47 -1 0.70 0.50 ag i d9 5s7d ag i d9 5s8g -1.102E+01 ( 7d//r2// 8g)=-1.767E+01 a0 -0.0171 1.928E+00-0.196-0.475 sqrtdel= 1.0000 -1.767E+01 47 -1 0.70 0.50 ag i d9 5s7d ag i d9 5s9g 1.397E+01 ( 7d//r2// 9g)= 2.240E+01 a0 0.0271 3.098E+00-0.132-0.396 sqrtdel= 1.0000 2.240E+01 47 -1 0.70 0.50 ag i d9 5s7d ag i d10 7i 0.000E+00 ( //r2// )= 0.000E+00 a0 0.0000 0.000E+00 0.000 0.000 sqrtdel= 1.0000 0.000E+00 47 -1 0.70 0.50 ag i d9 5s7d ag i d10 8i 0.000E+00 ( //r2// )= 0.000E+00 a0 0.0000 0.000E+00 0.000 0.000 sqrtdel= 1.0000 0.000E+00 47 -1 0.70 0.50 ag i d9 5s7d ag i d10 9i 0.000E+00 ( //r2// )= 0.000E+00 a0 0.0000 0.000E+00 0.000 0.000 sqrtdel= 1.0000 0.000E+00 47 -1 0.70 0.50 ag i d9 5s7d ag i d9 5s7i 0.000E+00 ( //r2// )= 0.000E+00 a0 0.0000 0.000E+00 0.000 0.000 sqrtdel= 1.0000 0.000E+00 47 -1 0.70 0.50 ag i d9 5s7d ag i d9 5s8i 0.000E+00 ( //r2// )= 0.000E+00 a0 0.0000 0.000E+00 0.000 0.000 sqrtdel= 1.0000 0.000E+00 47 -1 0.70 0.50 ag i d9 5s7d ag i d9 5s9i 0.000E+00 ( //r2// )= 0.000E+00 a0 0.0000 0.000E+00 0.000 0.000 sqrtdel= 1.0000 0.000E+00 47 -1 0.70 0.50 ag i d9 5s7d ag i d10 9l 0.000E+00 ( //r2// )= 0.000E+00 a0 0.0000 0.000E+00 0.000 0.000 sqrtdel= 1.0000 0.000E+00 47 -1 0.70 0.50 ag i d9 5s7d ag i d9 5s9l 0.000E+00 ( //r2// )= 0.000E+00 a0 0.0000 0.000E+00 0.000 0.000 sqrtdel= 1.0000 0.000E+00 47 -1 0.70 0.50 ag i d9 5s7d ag i d9 5p2 0.000E+00 ( //r2// )= 0.000E+00 a0 0.0000 0.000E+00 0.000 0.000 sqrtdel= 1.0000 0.000E+00 47 -1 0.70 0.50 ag i d9 5s8d ag i d10 5s -3.652E-01 ( 8d//r2// 4d)= 4.365E-01 a0 -0.8736 8.893E-03-0.005-0.114 sqrtdel= 1.0000 4.365E-01 47 -1 0.70 0.50 ag i d9 5s8d ag i d10 6s 0.000E+00 ( //r2// )= 0.000E+00 a0 0.0000 0.000E+00 0.000 0.000 sqrtdel= 1.0000 0.000E+00 47 -1 0.70 0.50 ag i d9 5s8d ag i d10 7s 0.000E+00 ( //r2// )= 0.000E+00 a0 0.0000 0.000E+00 0.000 0.000 sqrtdel= 1.0000 0.000E+00 47 -1 0.70 0.50 ag i d9 5s8d ag i d10 8s 0.000E+00 ( //r2// )= 0.000E+00 a0 0.0000 0.000E+00 0.000 0.000 sqrtdel= 1.0000 0.000E+00 47 -1 0.70 0.50 ag i d9 5s8d ag i d10 9s 0.000E+00 ( //r2// )= 0.000E+00 a0 0.0000 0.000E+00 0.000 0.000 sqrtdel= 1.0000 0.000E+00 47 -1 0.70 0.50 ag i d9 5s8d ag i d9 5s2 2.230E+00 ( 8d//r2// 5s)= 2.230E+00 a0 0.8797 3.316E-01 0.108 0.943 sqrtdel= 1.0000 2.230E+00 47 -1 0.70 0.50 ag i d9 5s8d ag i d9 5s6s 1.248E+01 ( 8d//r2// 6s)= 1.248E+01 a0 0.4231 1.039E+01-0.007-0.030 sqrtdel= 1.0000 1.248E+01 47 -1 0.70 0.50 ag i d9 5s8d ag i d9 5s7s 4.427E+01 ( 8d//r2// 7s)= 4.427E+01 a0 0.2587 1.307E+02-0.098-0.256 sqrtdel= 1.0000 4.427E+01 47 -1 0.70 0.50 ag i d9 5s8d ag i d9 5s8s 1.370E+02 ( 8d//r2// 8s)= 1.370E+02 a0 0.1909 1.251E+03-0.244-0.413 sqrtdel= 1.0000 1.370E+02 47 -1 0.70 0.50 ag i d9 5s8d ag i d9 5s9s -2.209E+03 ( 8d//r2// 9s)=-2.209E+03 a0 -0.9855 3.252E+05-0.855-0.963 sqrtdel= 1.0000 -2.209E+03 47 -1 0.70 0.50 ag i d9 5s8d ag i d8 5s2 6s 0.000E+00 ( //r2// )= 0.000E+00 a0 0.0000 0.000E+00 0.000 0.000 sqrtdel= 1.0000 0.000E+00 47 -1 0.70 0.50 ag i d9 5s8d ag i d10 5d 0.000E+00 ( //r2// )= 0.000E+00 a0 0.0000 0.000E+00 0.000 0.000 sqrtdel= 1.0000 0.000E+00 47 -1 0.70 0.50 ag i d9 5s8d ag i d10 6d 0.000E+00 ( //r2// )= 0.000E+00 a0 0.0000 0.000E+00 0.000 0.000 sqrtdel= 1.0000 0.000E+00 47 -1 0.70 0.50 ag i d9 5s8d ag i d10 7d 0.000E+00 ( //r2// )= 0.000E+00 a0 0.0000 0.000E+00 0.000 0.000 sqrtdel= 1.0000 0.000E+00 47 -1 0.70 0.50 ag i d9 5s8d ag i d10 8d -3.167E+00 ( 5s//r2// 4d)=-3.167E+00 a0 -0.9615 6.686E-01-0.449-0.676 sqrtdel= 1.0000 -3.167E+00 47 -1 0.70 0.50 ag i d9 5s8d ag i d10 9d 0.000E+00 ( //r2// )= 0.000E+00 a0 0.0000 0.000E+00 0.000 0.000 sqrtdel= 1.0000 0.000E+00 47 -1 0.70 0.50 ag i d9 5s8d ag i d9 5s5d -1.149E+01 ( 8d//r2// 5d)= 1.374E+01 a0 -0.2212 8.808E+00-0.007-0.027 sqrtdel= 1.0000 1.374E+01 47 -1 0.70 0.50 ag i d9 5s8d ag i d9 5s6d -7.560E+01 ( 8d//r2// 6d)= 9.036E+01 a0 -0.2641 3.810E+02-0.008-0.018 sqrtdel= 1.0000 9.036E+01 47 -1 0.70 0.50 ag i d9 5s8d ag i d9 5s7d -7.018E+02 ( 8d//r2// 7d)= 8.388E+02 a0 -0.6093 3.284E+04-0.007-0.011 sqrtdel= 1.0000 8.388E+02 47 -1 0.70 0.50 ag i d9 5s8d ag i d9 5s8d 2.812E+03 ( 8d//r2// 8d)=-3.361E+03 a0 1.0000 5.272E+05 1.000 1.000 sqrtdel= 1.0000 -3.361E+03 47 -1 0.70 0.50 ag i d9 5s8d ag i d9 5s9d -1.417E+03 ( 8d//r2// 9d)= 1.693E+03 a0 -0.5749 1.338E+05-0.006-0.009 sqrtdel= 1.0000 1.693E+03 47 -1 0.70 0.50 ag i d9 5s8d ag i d8 5s2 5d 0.000E+00 ( //r2// )= 0.000E+00 a0 0.0000 0.000E+00 0.000 0.000 sqrtdel= 1.0000 0.000E+00 47 -1 0.70 0.50 ag i d9 5s8d ag i d10 5g 0.000E+00 ( //r2// )= 0.000E+00 a0 0.0000 0.000E+00 0.000 0.000 sqrtdel= 1.0000 0.000E+00 47 -1 0.70 0.50 ag i d9 5s8d ag i d10 6g 0.000E+00 ( //r2// )= 0.000E+00 a0 0.0000 0.000E+00 0.000 0.000 sqrtdel= 1.0000 0.000E+00 47 -1 0.70 0.50 ag i d9 5s8d ag i d10 7g 0.000E+00 ( //r2// )= 0.000E+00 a0 0.0000 0.000E+00 0.000 0.000 sqrtdel= 1.0000 0.000E+00 47 -1 0.70 0.50 ag i d9 5s8d ag i d10 8g 0.000E+00 ( //r2// )= 0.000E+00 a0 0.0000 0.000E+00 0.000 0.000 sqrtdel= 1.0000 0.000E+00 47 -1 0.70 0.50 ag i d9 5s8d ag i d10 9g 0.000E+00 ( //r2// )= 0.000E+00 a0 0.0000 0.000E+00 0.000 0.000 sqrtdel= 1.0000 0.000E+00 47 -1 0.70 0.50 ag i d9 5s8d ag i d9 5s5g -1.787E+02 ( 8d//r2// 5g)=-2.865E+02 a0 -0.2651 5.067E+02 0.036 0.066 sqrtdel= 1.0000 -2.865E+02 47 -1 0.70 0.50 ag i d9 5s8d ag i d9 5s6g 2.131E+03 ( 8d//r2// 6g)= 3.417E+03 a0 0.9417 7.207E+04 0.610 0.716 sqrtdel= 1.0000 3.417E+03 47 -1 0.70 0.50 ag i d9 5s8d ag i d9 5s7g -2.401E+03 ( 8d//r2// 7g)=-3.851E+03 a0 -0.9037 9.154E+04-0.572-0.787 sqrtdel= 1.0000 -3.851E+03 47 -1 0.70 0.50 ag i d9 5s8d ag i d9 5s8g -3.940E+02 ( 8d//r2// 8g)=-6.318E+02 a0 -0.2124 2.464E+03-0.318-0.592 sqrtdel= 1.0000 -6.318E+02 47 -1 0.70 0.50 ag i d9 5s8d ag i d9 5s9g -1.166E+02 ( 8d//r2// 9g)=-1.869E+02 a0 -0.0821 2.157E+02-0.210-0.485 sqrtdel= 1.0000 -1.869E+02 47 -1 0.70 0.50 ag i d9 5s8d ag i d10 7i 0.000E+00 ( //r2// )= 0.000E+00 a0 0.0000 0.000E+00 0.000 0.000 sqrtdel= 1.0000 0.000E+00 47 -1 0.70 0.50 ag i d9 5s8d ag i d10 8i 0.000E+00 ( //r2// )= 0.000E+00 a0 0.0000 0.000E+00 0.000 0.000 sqrtdel= 1.0000 0.000E+00 47 -1 0.70 0.50 ag i d9 5s8d ag i d10 9i 0.000E+00 ( //r2// )= 0.000E+00 a0 0.0000 0.000E+00 0.000 0.000 sqrtdel= 1.0000 0.000E+00 47 -1 0.70 0.50 ag i d9 5s8d ag i d9 5s7i 0.000E+00 ( //r2// )= 0.000E+00 a0 0.0000 0.000E+00 0.000 0.000 sqrtdel= 1.0000 0.000E+00 47 -1 0.70 0.50 ag i d9 5s8d ag i d9 5s8i 0.000E+00 ( //r2// )= 0.000E+00 a0 0.0000 0.000E+00 0.000 0.000 sqrtdel= 1.0000 0.000E+00 47 -1 0.70 0.50 ag i d9 5s8d ag i d9 5s9i 0.000E+00 ( //r2// )= 0.000E+00 a0 0.0000 0.000E+00 0.000 0.000 sqrtdel= 1.0000 0.000E+00 47 -1 0.70 0.50 ag i d9 5s8d ag i d10 9l 0.000E+00 ( //r2// )= 0.000E+00 a0 0.0000 0.000E+00 0.000 0.000 sqrtdel= 1.0000 0.000E+00 47 -1 0.70 0.50 ag i d9 5s8d ag i d9 5s9l 0.000E+00 ( //r2// )= 0.000E+00 a0 0.0000 0.000E+00 0.000 0.000 sqrtdel= 1.0000 0.000E+00 47 -1 0.70 0.50 ag i d9 5s8d ag i d9 5p2 0.000E+00 ( //r2// )= 0.000E+00 a0 0.0000 0.000E+00 0.000 0.000 sqrtdel= 1.0000 0.000E+00 47 -1 0.70 0.50 ag i d9 5s9d ag i d10 5s -2.879E-01 ( 9d//r2// 4d)= 3.441E-01 a0 -0.8693 5.524E-03-0.004-0.112 sqrtdel= 1.0000 3.441E-01 47 -1 0.70 0.50 ag i d9 5s9d ag i d10 6s 0.000E+00 ( //r2// )= 0.000E+00 a0 0.0000 0.000E+00 0.000 0.000 sqrtdel= 1.0000 0.000E+00 47 -1 0.70 0.50 ag i d9 5s9d ag i d10 7s 0.000E+00 ( //r2// )= 0.000E+00 a0 0.0000 0.000E+00 0.000 0.000 sqrtdel= 1.0000 0.000E+00 47 -1 0.70 0.50 ag i d9 5s9d ag i d10 8s 0.000E+00 ( //r2// )= 0.000E+00 a0 0.0000 0.000E+00 0.000 0.000 sqrtdel= 1.0000 0.000E+00 47 -1 0.70 0.50 ag i d9 5s9d ag i d10 9s 0.000E+00 ( //r2// )= 0.000E+00 a0 0.0000 0.000E+00 0.000 0.000 sqrtdel= 1.0000 0.000E+00 47 -1 0.70 0.50 ag i d9 5s9d ag i d9 5s2 1.700E+00 ( 9d//r2// 5s)= 1.700E+00 a0 0.8598 1.926E-01 0.085 0.940 sqrtdel= 1.0000 1.700E+00 47 -1 0.70 0.50 ag i d9 5s9d ag i d9 5s6s 9.173E+00 ( 9d//r2// 6s)= 9.173E+00 a0 0.4011 5.610E+00 0.002 0.013 sqrtdel= 1.0000 9.173E+00 47 -1 0.70 0.50 ag i d9 5s9d ag i d9 5s7s 3.003E+01 ( 9d//r2// 7s)= 3.003E+01 a0 0.2326 6.011E+01-0.056-0.193 sqrtdel= 1.0000 3.003E+01 47 -1 0.70 0.50 ag i d9 5s9d ag i d9 5s8s 8.636E+01 ( 9d//r2// 8s)= 8.636E+01 a0 0.1728 4.971E+02-0.125-0.289 sqrtdel= 1.0000 8.636E+01 47 -1 0.70 0.50 ag i d9 5s9d ag i d9 5s9s 2.376E+02 ( 9d//r2// 9s)= 2.376E+02 a0 0.1458 3.764E+03-0.254-0.410 sqrtdel= 1.0000 2.376E+02 47 -1 0.70 0.50 ag i d9 5s9d ag i d8 5s2 6s 0.000E+00 ( //r2// )= 0.000E+00 a0 0.0000 0.000E+00 0.000 0.000 sqrtdel= 1.0000 0.000E+00 47 -1 0.70 0.50 ag i d9 5s9d ag i d10 5d 0.000E+00 ( //r2// )= 0.000E+00 a0 0.0000 0.000E+00 0.000 0.000 sqrtdel= 1.0000 0.000E+00 47 -1 0.70 0.50 ag i d9 5s9d ag i d10 6d 0.000E+00 ( //r2// )= 0.000E+00 a0 0.0000 0.000E+00 0.000 0.000 sqrtdel= 1.0000 0.000E+00 47 -1 0.70 0.50 ag i d9 5s9d ag i d10 7d 0.000E+00 ( //r2// )= 0.000E+00 a0 0.0000 0.000E+00 0.000 0.000 sqrtdel= 1.0000 0.000E+00 47 -1 0.70 0.50 ag i d9 5s9d ag i d10 8d 0.000E+00 ( //r2// )= 0.000E+00 a0 0.0000 0.000E+00 0.000 0.000 sqrtdel= 1.0000 0.000E+00 47 -1 0.70 0.50 ag i d9 5s9d ag i d10 9d -3.166E+00 ( 5s//r2// 4d)=-3.166E+00 a0 -0.9614 6.683E-01-0.449-0.676 sqrtdel= 1.0000 -3.166E+00 47 -1 0.70 0.50 ag i d9 5s9d ag i d9 5s5d -7.106E+00 ( 9d//r2// 5d)= 8.494E+00 a0 -0.1777 3.367E+00-0.007-0.031 sqrtdel= 1.0000 8.494E+00 47 -1 0.70 0.50 ag i d9 5s9d ag i d9 5s6d -3.637E+01 ( 9d//r2// 6d)= 4.347E+01 a0 -0.1719 8.820E+01-0.007-0.021 sqrtdel= 1.0000 4.347E+01 47 -1 0.70 0.50 ag i d9 5s9d ag i d9 5s7d -1.767E+02 ( 9d//r2// 7d)= 2.112E+02 a0 -0.2273 2.081E+03-0.007-0.014 sqrtdel= 1.0000 2.112E+02 47 -1 0.70 0.50 ag i d9 5s9d ag i d9 5s8d -1.417E+03 ( 9d//r2// 8d)= 1.693E+03 a0 -0.5749 1.338E+05-0.006-0.009 sqrtdel= 1.0000 1.693E+03 47 -1 0.70 0.50 ag i d9 5s9d ag i d9 5s9d 5.370E+03 ( 9d//r2// 9d)=-6.418E+03 a0 1.0000 1.922E+06 1.000 1.000 sqrtdel= 1.0000 -6.418E+03 47 -1 0.70 0.50 ag i d9 5s9d ag i d8 5s2 5d 0.000E+00 ( //r2// )= 0.000E+00 a0 0.0000 0.000E+00 0.000 0.000 sqrtdel= 1.0000 0.000E+00 47 -1 0.70 0.50 ag i d9 5s9d ag i d10 5g 0.000E+00 ( //r2// )= 0.000E+00 a0 0.0000 0.000E+00 0.000 0.000 sqrtdel= 1.0000 0.000E+00 47 -1 0.70 0.50 ag i d9 5s9d ag i d10 6g 0.000E+00 ( //r2// )= 0.000E+00 a0 0.0000 0.000E+00 0.000 0.000 sqrtdel= 1.0000 0.000E+00 47 -1 0.70 0.50 ag i d9 5s9d ag i d10 7g 0.000E+00 ( //r2// )= 0.000E+00 a0 0.0000 0.000E+00 0.000 0.000 sqrtdel= 1.0000 0.000E+00 47 -1 0.70 0.50 ag i d9 5s9d ag i d10 8g 0.000E+00 ( //r2// )= 0.000E+00 a0 0.0000 0.000E+00 0.000 0.000 sqrtdel= 1.0000 0.000E+00 47 -1 0.70 0.50 ag i d9 5s9d ag i d10 9g 0.000E+00 ( //r2// )= 0.000E+00 a0 0.0000 0.000E+00 0.000 0.000 sqrtdel= 1.0000 0.000E+00 47 -1 0.70 0.50 ag i d9 5s9d ag i d9 5s5g -4.269E+01 ( 9d//r2// 5g)=-6.845E+01 a0 -0.0905 2.892E+01 0.018 0.045 sqrtdel= 1.0000 -6.845E+01 47 -1 0.70 0.50 ag i d9 5s9d ag i d9 5s6g -5.556E+02 ( 9d//r2// 6g)=-8.910E+02 a0 -0.3064 4.900E+03 0.048 0.079 sqrtdel= 1.0000 -8.910E+02 47 -1 0.70 0.50 ag i d9 5s9d ag i d9 5s7g 4.525E+03 ( 9d//r2// 7g)= 7.256E+03 a0 0.9702 3.250E+05 0.717 0.812 sqrtdel= 1.0000 7.256E+03 47 -1 0.70 0.50 ag i d9 5s9d ag i d9 5s8g -4.033E+03 ( 9d//r2// 8g)=-6.467E+03 a0 -0.8330 2.582E+05-0.459-0.650 sqrtdel= 1.0000 -6.467E+03 47 -1 0.70 0.50 ag i d9 5s9d ag i d9 5s9g -7.845E+02 ( 9d//r2// 9g)=-1.258E+03 a0 -0.2240 9.768E+03-0.281-0.525 sqrtdel= 1.0000 -1.258E+03 47 -1 0.70 0.50 ag i d9 5s9d ag i d10 7i 0.000E+00 ( //r2// )= 0.000E+00 a0 0.0000 0.000E+00 0.000 0.000 sqrtdel= 1.0000 0.000E+00 47 -1 0.70 0.50 ag i d9 5s9d ag i d10 8i 0.000E+00 ( //r2// )= 0.000E+00 a0 0.0000 0.000E+00 0.000 0.000 sqrtdel= 1.0000 0.000E+00 47 -1 0.70 0.50 ag i d9 5s9d ag i d10 9i 0.000E+00 ( //r2// )= 0.000E+00 a0 0.0000 0.000E+00 0.000 0.000 sqrtdel= 1.0000 0.000E+00 47 -1 0.70 0.50 ag i d9 5s9d ag i d9 5s7i 0.000E+00 ( //r2// )= 0.000E+00 a0 0.0000 0.000E+00 0.000 0.000 sqrtdel= 1.0000 0.000E+00 47 -1 0.70 0.50 ag i d9 5s9d ag i d9 5s8i 0.000E+00 ( //r2// )= 0.000E+00 a0 0.0000 0.000E+00 0.000 0.000 sqrtdel= 1.0000 0.000E+00 47 -1 0.70 0.50 ag i d9 5s9d ag i d9 5s9i 0.000E+00 ( //r2// )= 0.000E+00 a0 0.0000 0.000E+00 0.000 0.000 sqrtdel= 1.0000 0.000E+00 47 -1 0.70 0.50 ag i d9 5s9d ag i d10 9l 0.000E+00 ( //r2// )= 0.000E+00 a0 0.0000 0.000E+00 0.000 0.000 sqrtdel= 1.0000 0.000E+00 47 -1 0.70 0.50 ag i d9 5s9d ag i d9 5s9l 0.000E+00 ( //r2// )= 0.000E+00 a0 0.0000 0.000E+00 0.000 0.000 sqrtdel= 1.0000 0.000E+00 47 -1 0.70 0.50 ag i d9 5s9d ag i d9 5p2 0.000E+00 ( //r2// )= 0.000E+00 a0 0.0000 0.000E+00 0.000 0.000 sqrtdel= 1.0000 0.000E+00 47 -1 0.70 0.50 ag i d8 5s2 5d ag i d10 5s 0.000E+00 ( //r2// )= 0.000E+00 a0 0.0000 0.000E+00 0.000 0.000 sqrtdel= 1.0000 0.000E+00 47 -1 0.70 0.50 ag i d8 5s2 5d ag i d10 6s 0.000E+00 ( //r2// )= 0.000E+00 a0 0.0000 0.000E+00 0.000 0.000 sqrtdel= 1.0000 0.000E+00 47 -1 0.70 0.50 ag i d8 5s2 5d ag i d10 7s 0.000E+00 ( //r2// )= 0.000E+00 a0 0.0000 0.000E+00 0.000 0.000 sqrtdel= 1.0000 0.000E+00 47 -1 0.70 0.50 ag i d8 5s2 5d ag i d10 8s 0.000E+00 ( //r2// )= 0.000E+00 a0 0.0000 0.000E+00 0.000 0.000 sqrtdel= 1.0000 0.000E+00 47 -1 0.70 0.50 ag i d8 5s2 5d ag i d10 9s 0.000E+00 ( //r2// )= 0.000E+00 a0 0.0000 0.000E+00 0.000 0.000 sqrtdel= 1.0000 0.000E+00 47 -1 0.70 0.50 ag i d8 5s2 5d ag i d9 5s2 -6.327E-01 ( 5d//r2// 4d)= 7.562E-01 a0 -0.7873 2.669E-02 0.020 0.186 sqrtdel= 1.0000 7.562E-01 47 -1 0.70 0.50 ag i d8 5s2 5d ag i d9 5s6s 0.000E+00 ( //r2// )= 0.000E+00 a0 0.0000 0.000E+00 0.000 0.000 sqrtdel= 1.0000 0.000E+00 47 -1 0.70 0.50 ag i d8 5s2 5d ag i d9 5s7s 0.000E+00 ( //r2// )= 0.000E+00 a0 0.0000 0.000E+00 0.000 0.000 sqrtdel= 1.0000 0.000E+00 47 -1 0.70 0.50 ag i d8 5s2 5d ag i d9 5s8s 0.000E+00 ( //r2// )= 0.000E+00 a0 0.0000 0.000E+00 0.000 0.000 sqrtdel= 1.0000 0.000E+00 47 -1 0.70 0.50 ag i d8 5s2 5d ag i d9 5s9s 0.000E+00 ( //r2// )= 0.000E+00 a0 0.0000 0.000E+00 0.000 0.000 sqrtdel= 1.0000 0.000E+00 47 -1 0.70 0.50 ag i d8 5s2 5d ag i d8 5s2 6s -9.143E+01 ( 5d//r2// 6s)=-9.143E+01 a0 -0.9985 5.572E+02-0.925-0.976 sqrtdel= 1.0000 -9.143E+01 47 -1 0.70 0.50 ag i d8 5s2 5d ag i d10 5d 0.000E+00 ( //r2// )= 0.000E+00 a0 0.0000 0.000E+00 0.000 0.000 sqrtdel= 1.0000 0.000E+00 47 -1 0.70 0.50 ag i d8 5s2 5d ag i d10 6d 0.000E+00 ( //r2// )= 0.000E+00 a0 0.0000 0.000E+00 0.000 0.000 sqrtdel= 1.0000 0.000E+00 47 -1 0.70 0.50 ag i d8 5s2 5d ag i d10 7d 0.000E+00 ( //r2// )= 0.000E+00 a0 0.0000 0.000E+00 0.000 0.000 sqrtdel= 1.0000 0.000E+00 47 -1 0.70 0.50 ag i d8 5s2 5d ag i d10 8d 0.000E+00 ( //r2// )= 0.000E+00 a0 0.0000 0.000E+00 0.000 0.000 sqrtdel= 1.0000 0.000E+00 47 -1 0.70 0.50 ag i d8 5s2 5d ag i d10 9d 0.000E+00 ( //r2// )= 0.000E+00 a0 0.0000 0.000E+00 0.000 0.000 sqrtdel= 1.0000 0.000E+00 47 -1 0.70 0.50 ag i d8 5s2 5d ag i d9 5s5d -2.799E+00 ( 5s//r2// 4d)=-2.799E+00 a0 -0.9545 5.222E-01-0.423-0.648 sqrtdel= 1.0000 -2.799E+00 47 -1 0.70 0.50 ag i d8 5s2 5d ag i d9 5s6d 0.000E+00 ( //r2// )= 0.000E+00 a0 0.0000 0.000E+00 0.000 0.000 sqrtdel= 1.0000 0.000E+00 47 -1 0.70 0.50 ag i d8 5s2 5d ag i d9 5s7d 0.000E+00 ( //r2// )= 0.000E+00 a0 0.0000 0.000E+00 0.000 0.000 sqrtdel= 1.0000 0.000E+00 47 -1 0.70 0.50 ag i d8 5s2 5d ag i d9 5s8d 0.000E+00 ( //r2// )= 0.000E+00 a0 0.0000 0.000E+00 0.000 0.000 sqrtdel= 1.0000 0.000E+00 47 -1 0.70 0.50 ag i d8 5s2 5d ag i d9 5s9d 0.000E+00 ( //r2// )= 0.000E+00 a0 0.0000 0.000E+00 0.000 0.000 sqrtdel= 1.0000 0.000E+00 47 -1 0.70 0.50 ag i d8 5s2 5d ag i d8 5s2 5d 1.184E+02 ( 5d//r2// 5d)=-1.415E+02 a0 1.0000 9.346E+02 1.000 1.000 sqrtdel= 1.0000 -1.415E+02 47 -1 0.70 0.50 ag i d8 5s2 5d ag i d10 5g 0.000E+00 ( //r2// )= 0.000E+00 a0 0.0000 0.000E+00 0.000 0.000 sqrtdel= 1.0000 0.000E+00 47 -1 0.70 0.50 ag i d8 5s2 5d ag i d10 6g 0.000E+00 ( //r2// )= 0.000E+00 a0 0.0000 0.000E+00 0.000 0.000 sqrtdel= 1.0000 0.000E+00 47 -1 0.70 0.50 ag i d8 5s2 5d ag i d10 7g 0.000E+00 ( //r2// )= 0.000E+00 a0 0.0000 0.000E+00 0.000 0.000 sqrtdel= 1.0000 0.000E+00 47 -1 0.70 0.50 ag i d8 5s2 5d ag i d10 8g 0.000E+00 ( //r2// )= 0.000E+00 a0 0.0000 0.000E+00 0.000 0.000 sqrtdel= 1.0000 0.000E+00 47 -1 0.70 0.50 ag i d8 5s2 5d ag i d10 9g 0.000E+00 ( //r2// )= 0.000E+00 a0 0.0000 0.000E+00 0.000 0.000 sqrtdel= 1.0000 0.000E+00 47 -1 0.70 0.50 ag i d8 5s2 5d ag i d9 5s5g 0.000E+00 ( //r2// )= 0.000E+00 a0 0.0000 0.000E+00 0.000 0.000 sqrtdel= 1.0000 0.000E+00 47 -1 0.70 0.50 ag i d8 5s2 5d ag i d9 5s6g 0.000E+00 ( //r2// )= 0.000E+00 a0 0.0000 0.000E+00 0.000 0.000 sqrtdel= 1.0000 0.000E+00 47 -1 0.70 0.50 ag i d8 5s2 5d ag i d9 5s7g 0.000E+00 ( //r2// )= 0.000E+00 a0 0.0000 0.000E+00 0.000 0.000 sqrtdel= 1.0000 0.000E+00 47 -1 0.70 0.50 ag i d8 5s2 5d ag i d9 5s8g 0.000E+00 ( //r2// )= 0.000E+00 a0 0.0000 0.000E+00 0.000 0.000 sqrtdel= 1.0000 0.000E+00 47 -1 0.70 0.50 ag i d8 5s2 5d ag i d9 5s9g 0.000E+00 ( //r2// )= 0.000E+00 a0 0.0000 0.000E+00 0.000 0.000 sqrtdel= 1.0000 0.000E+00 47 -1 0.70 0.50 ag i d8 5s2 5d ag i d10 7i 0.000E+00 ( //r2// )= 0.000E+00 a0 0.0000 0.000E+00 0.000 0.000 sqrtdel= 1.0000 0.000E+00 47 -1 0.70 0.50 ag i d8 5s2 5d ag i d10 8i 0.000E+00 ( //r2// )= 0.000E+00 a0 0.0000 0.000E+00 0.000 0.000 sqrtdel= 1.0000 0.000E+00 47 -1 0.70 0.50 ag i d8 5s2 5d ag i d10 9i 0.000E+00 ( //r2// )= 0.000E+00 a0 0.0000 0.000E+00 0.000 0.000 sqrtdel= 1.0000 0.000E+00 47 -1 0.70 0.50 ag i d8 5s2 5d ag i d9 5s7i 0.000E+00 ( //r2// )= 0.000E+00 a0 0.0000 0.000E+00 0.000 0.000 sqrtdel= 1.0000 0.000E+00 47 -1 0.70 0.50 ag i d8 5s2 5d ag i d9 5s8i 0.000E+00 ( //r2// )= 0.000E+00 a0 0.0000 0.000E+00 0.000 0.000 sqrtdel= 1.0000 0.000E+00 47 -1 0.70 0.50 ag i d8 5s2 5d ag i d9 5s9i 0.000E+00 ( //r2// )= 0.000E+00 a0 0.0000 0.000E+00 0.000 0.000 sqrtdel= 1.0000 0.000E+00 47 -1 0.70 0.50 ag i d8 5s2 5d ag i d10 9l 0.000E+00 ( //r2// )= 0.000E+00 a0 0.0000 0.000E+00 0.000 0.000 sqrtdel= 1.0000 0.000E+00 47 -1 0.70 0.50 ag i d8 5s2 5d ag i d9 5s9l 0.000E+00 ( //r2// )= 0.000E+00 a0 0.0000 0.000E+00 0.000 0.000 sqrtdel= 1.0000 0.000E+00 47 -1 0.70 0.50 ag i d8 5s2 5d ag i d9 5p2 0.000E+00 ( //r2// )= 0.000E+00 a0 0.0000 0.000E+00 0.000 0.000 sqrtdel= 1.0000 0.000E+00 47 -1 0.70 0.50 ag i d10 5g ag i d10 5s 0.000E+00 ( //r2// )= 0.000E+00 a0 0.0000 0.000E+00 0.000 0.000 sqrtdel= 1.0000 0.000E+00 47 -1 0.70 0.50 ag i d10 5g ag i d10 6s 0.000E+00 ( //r2// )= 0.000E+00 a0 0.0000 0.000E+00 0.000 0.000 sqrtdel= 1.0000 0.000E+00 47 -1 0.70 0.50 ag i d10 5g ag i d10 7s 0.000E+00 ( //r2// )= 0.000E+00 a0 0.0000 0.000E+00 0.000 0.000 sqrtdel= 1.0000 0.000E+00 47 -1 0.70 0.50 ag i d10 5g ag i d10 8s 0.000E+00 ( //r2// )= 0.000E+00 a0 0.0000 0.000E+00 0.000 0.000 sqrtdel= 1.0000 0.000E+00 47 -1 0.70 0.50 ag i d10 5g ag i d10 9s 0.000E+00 ( //r2// )= 0.000E+00 a0 0.0000 0.000E+00 0.000 0.000 sqrtdel= 1.0000 0.000E+00 47 -1 0.70 0.50 ag i d10 5g ag i d9 5s2 0.000E+00 ( //r2// )= 0.000E+00 a0 0.0000 0.000E+00 0.000 0.000 sqrtdel= 1.0000 0.000E+00 47 -1 0.70 0.50 ag i d10 5g ag i d9 5s6s 0.000E+00 ( //r2// )= 0.000E+00 a0 0.0000 0.000E+00 0.000 0.000 sqrtdel= 1.0000 0.000E+00 47 -1 0.70 0.50 ag i d10 5g ag i d9 5s7s 0.000E+00 ( //r2// )= 0.000E+00 a0 0.0000 0.000E+00 0.000 0.000 sqrtdel= 1.0000 0.000E+00 47 -1 0.70 0.50 ag i d10 5g ag i d9 5s8s 0.000E+00 ( //r2// )= 0.000E+00 a0 0.0000 0.000E+00 0.000 0.000 sqrtdel= 1.0000 0.000E+00 47 -1 0.70 0.50 ag i d10 5g ag i d9 5s9s 0.000E+00 ( //r2// )= 0.000E+00 a0 0.0000 0.000E+00 0.000 0.000 sqrtdel= 1.0000 0.000E+00 47 -1 0.70 0.50 ag i d10 5g ag i d8 5s2 6s 0.000E+00 ( //r2// )= 0.000E+00 a0 0.0000 0.000E+00 0.000 0.000 sqrtdel= 1.0000 0.000E+00 47 -1 0.70 0.50 ag i d10 5g ag i d10 5d 1.161E+02 ( 5g//r2// 5d)= 1.862E+02 a0 1.0000 2.140E+02 0.363 1.000 sqrtdel= 1.0000 1.862E+02 47 -1 0.70 0.50 ag i d10 5g ag i d10 6d -5.909E+02 ( 5g//r2// 6d)=-9.475E+02 a0 -0.9941 5.542E+03-0.846-0.952 sqrtdel= 1.0000 -9.475E+02 47 -1 0.70 0.50 ag i d10 5g ag i d10 7d 7.464E+02 ( 5g//r2// 7d)= 1.197E+03 a0 0.8487 8.843E+03 0.392 0.498 sqrtdel= 1.0000 1.197E+03 47 -1 0.70 0.50 ag i d10 5g ag i d10 8d -1.402E+02 ( 5g//r2// 8d)=-2.248E+02 a0 -0.2137 3.121E+02 0.040 0.076 sqrtdel= 1.0000 -2.248E+02 47 -1 0.70 0.50 ag i d10 5g ag i d10 9d -3.624E+01 ( 5g//r2// 9d)=-5.811E+01 a0 -0.0785 2.085E+01 0.019 0.050 sqrtdel= 1.0000 -5.811E+01 47 -1 0.70 0.50 ag i d10 5g ag i d9 5s5d 0.000E+00 ( //r2// )= 0.000E+00 a0 0.0000 0.000E+00 0.000 0.000 sqrtdel= 1.0000 0.000E+00 47 -1 0.70 0.50 ag i d10 5g ag i d9 5s6d 0.000E+00 ( //r2// )= 0.000E+00 a0 0.0000 0.000E+00 0.000 0.000 sqrtdel= 1.0000 0.000E+00 47 -1 0.70 0.50 ag i d10 5g ag i d9 5s7d 0.000E+00 ( //r2// )= 0.000E+00 a0 0.0000 0.000E+00 0.000 0.000 sqrtdel= 1.0000 0.000E+00 47 -1 0.70 0.50 ag i d10 5g ag i d9 5s8d 0.000E+00 ( //r2// )= 0.000E+00 a0 0.0000 0.000E+00 0.000 0.000 sqrtdel= 1.0000 0.000E+00 47 -1 0.70 0.50 ag i d10 5g ag i d9 5s9d 0.000E+00 ( //r2// )= 0.000E+00 a0 0.0000 0.000E+00 0.000 0.000 sqrtdel= 1.0000 0.000E+00 47 -1 0.70 0.50 ag i d10 5g ag i d8 5s2 5d 0.000E+00 ( //r2// )= 0.000E+00 a0 0.0000 0.000E+00 0.000 0.000 sqrtdel= 1.0000 0.000E+00 47 -1 0.70 0.50 ag i d10 5g ag i d10 5g 8.250E+02 ( 5g//r2// 5g)=-1.261E+03 a0 1.0000 1.080E+04 1.000 1.000 sqrtdel= 1.0000 -1.261E+03 47 -1 0.70 0.50 ag i d10 5g ag i d10 6g -4.923E+02 ( 5g//r2// 6g)= 7.528E+02 a0 -0.6324 3.848E+03 0.000 0.000 sqrtdel= 1.0000 7.528E+02 47 -1 0.70 0.50 ag i d10 5g ag i d10 7g -1.066E+02 ( 5g//r2// 7g)= 1.629E+02 a0 -0.2041 1.802E+02 0.000 0.000 sqrtdel= 1.0000 1.629E+02 47 -1 0.70 0.50 ag i d10 5g ag i d10 8g -4.667E+01 ( 5g//r2// 8g)= 7.135E+01 a0 -0.1181 3.457E+01 0.000 0.000 sqrtdel= 1.0000 7.135E+01 47 -1 0.70 0.50 ag i d10 5g ag i d10 9g -2.706E+01 ( 5g//r2// 9g)= 4.137E+01 a0 -0.0850 1.162E+01 0.000 0.000 sqrtdel= 1.0000 4.137E+01 47 -1 0.70 0.50 ag i d10 5g ag i d9 5s5g -3.165E+00 ( 4d//r2// 5s)=-3.165E+00 a0 -0.9614 6.679E-01-0.449-0.676 sqrtdel= 1.0000 -3.165E+00 47 -1 0.70 0.50 ag i d10 5g ag i d9 5s6g 0.000E+00 ( //r2// )= 0.000E+00 a0 0.0000 0.000E+00 0.000 0.000 sqrtdel= 1.0000 0.000E+00 47 -1 0.70 0.50 ag i d10 5g ag i d9 5s7g 0.000E+00 ( //r2// )= 0.000E+00 a0 0.0000 0.000E+00 0.000 0.000 sqrtdel= 1.0000 0.000E+00 47 -1 0.70 0.50 ag i d10 5g ag i d9 5s8g 0.000E+00 ( //r2// )= 0.000E+00 a0 0.0000 0.000E+00 0.000 0.000 sqrtdel= 1.0000 0.000E+00 47 -1 0.70 0.50 ag i d10 5g ag i d9 5s9g 0.000E+00 ( //r2// )= 0.000E+00 a0 0.0000 0.000E+00 0.000 0.000 sqrtdel= 1.0000 0.000E+00 47 -1 0.70 0.50 ag i d10 5g ag i d10 7i 7.842E+02 ( 5g//r2// 7i)= 1.586E+03 a0 1.0000 4.301E+03 0.507 1.000 sqrtdel= 1.0000 1.586E+03 47 -1 0.70 0.50 ag i d10 5g ag i d10 8i 3.955E+02 ( 5g//r2// 8i)= 7.998E+02 a0 0.7567 1.094E+03 0.373 0.933 sqrtdel= 1.0000 7.998E+02 47 -1 0.70 0.50 ag i d10 5g ag i d10 9i 2.426E+02 ( 5g//r2// 9i)= 4.906E+02 a0 0.5999 4.114E+02 0.284 0.868 sqrtdel= 1.0000 4.906E+02 47 -1 0.70 0.50 ag i d10 5g ag i d9 5s7i 0.000E+00 ( //r2// )= 0.000E+00 a0 0.0000 0.000E+00 0.000 0.000 sqrtdel= 1.0000 0.000E+00 47 -1 0.70 0.50 ag i d10 5g ag i d9 5s8i 0.000E+00 ( //r2// )= 0.000E+00 a0 0.0000 0.000E+00 0.000 0.000 sqrtdel= 1.0000 0.000E+00 47 -1 0.70 0.50 ag i d10 5g ag i d9 5s9i 0.000E+00 ( //r2// )= 0.000E+00 a0 0.0000 0.000E+00 0.000 0.000 sqrtdel= 1.0000 0.000E+00 47 -1 0.70 0.50 ag i d10 5g ag i d10 9l 0.000E+00 ( //r2// )= 0.000E+00 a0 0.0000 0.000E+00 0.000 0.000 sqrtdel= 1.0000 0.000E+00 47 -1 0.70 0.50 ag i d10 5g ag i d9 5s9l 0.000E+00 ( //r2// )= 0.000E+00 a0 0.0000 0.000E+00 0.000 0.000 sqrtdel= 1.0000 0.000E+00 47 -1 0.70 0.50 ag i d10 5g ag i d9 5p2 0.000E+00 ( //r2// )= 0.000E+00 a0 0.0000 0.000E+00 0.000 0.000 sqrtdel= 1.0000 0.000E+00 47 -1 0.70 0.50 ag i d10 6g ag i d10 5s 0.000E+00 ( //r2// )= 0.000E+00 a0 0.0000 0.000E+00 0.000 0.000 sqrtdel= 1.0000 0.000E+00 47 -1 0.70 0.50 ag i d10 6g ag i d10 6s 0.000E+00 ( //r2// )= 0.000E+00 a0 0.0000 0.000E+00 0.000 0.000 sqrtdel= 1.0000 0.000E+00 47 -1 0.70 0.50 ag i d10 6g ag i d10 7s 0.000E+00 ( //r2// )= 0.000E+00 a0 0.0000 0.000E+00 0.000 0.000 sqrtdel= 1.0000 0.000E+00 47 -1 0.70 0.50 ag i d10 6g ag i d10 8s 0.000E+00 ( //r2// )= 0.000E+00 a0 0.0000 0.000E+00 0.000 0.000 sqrtdel= 1.0000 0.000E+00 47 -1 0.70 0.50 ag i d10 6g ag i d10 9s 0.000E+00 ( //r2// )= 0.000E+00 a0 0.0000 0.000E+00 0.000 0.000 sqrtdel= 1.0000 0.000E+00 47 -1 0.70 0.50 ag i d10 6g ag i d9 5s2 0.000E+00 ( //r2// )= 0.000E+00 a0 0.0000 0.000E+00 0.000 0.000 sqrtdel= 1.0000 0.000E+00 47 -1 0.70 0.50 ag i d10 6g ag i d9 5s6s 0.000E+00 ( //r2// )= 0.000E+00 a0 0.0000 0.000E+00 0.000 0.000 sqrtdel= 1.0000 0.000E+00 47 -1 0.70 0.50 ag i d10 6g ag i d9 5s7s 0.000E+00 ( //r2// )= 0.000E+00 a0 0.0000 0.000E+00 0.000 0.000 sqrtdel= 1.0000 0.000E+00 47 -1 0.70 0.50 ag i d10 6g ag i d9 5s8s 0.000E+00 ( //r2// )= 0.000E+00 a0 0.0000 0.000E+00 0.000 0.000 sqrtdel= 1.0000 0.000E+00 47 -1 0.70 0.50 ag i d10 6g ag i d9 5s9s 0.000E+00 ( //r2// )= 0.000E+00 a0 0.0000 0.000E+00 0.000 0.000 sqrtdel= 1.0000 0.000E+00 47 -1 0.70 0.50 ag i d10 6g ag i d8 5s2 6s 0.000E+00 ( //r2// )= 0.000E+00 a0 0.0000 0.000E+00 0.000 0.000 sqrtdel= 1.0000 0.000E+00 47 -1 0.70 0.50 ag i d10 6g ag i d10 5d 6.602E+01 ( 6g//r2// 5d)= 1.059E+02 a0 0.8818 6.918E+01 0.274 0.977 sqrtdel= 1.0000 1.059E+02 47 -1 0.70 0.50 ag i d10 6g ag i d10 6d 5.249E+01 ( 6g//r2// 6d)= 8.417E+01 a0 0.1441 4.373E+01-0.206-0.412 sqrtdel= 1.0000 8.417E+01 47 -1 0.70 0.50 ag i d10 6g ag i d10 7d -1.393E+03 ( 6g//r2// 7d)=-2.234E+03 a0 -0.9810 3.082E+04-0.759-0.933 sqrtdel= 1.0000 -2.234E+03 47 -1 0.70 0.50 ag i d10 6g ag i d10 8d 2.085E+03 ( 6g//r2// 8d)= 3.343E+03 a0 0.9223 6.899E+04 0.552 0.663 sqrtdel= 1.0000 3.343E+03 47 -1 0.70 0.50 ag i d10 6g ag i d10 9d -4.368E+02 ( 6g//r2// 9d)=-7.004E+02 a0 -0.2479 3.028E+03 0.058 0.099 sqrtdel= 1.0000 -7.004E+02 47 -1 0.70 0.50 ag i d10 6g ag i d9 5s5d 0.000E+00 ( //r2// )= 0.000E+00 a0 0.0000 0.000E+00 0.000 0.000 sqrtdel= 1.0000 0.000E+00 47 -1 0.70 0.50 ag i d10 6g ag i d9 5s6d 0.000E+00 ( //r2// )= 0.000E+00 a0 0.0000 0.000E+00 0.000 0.000 sqrtdel= 1.0000 0.000E+00 47 -1 0.70 0.50 ag i d10 6g ag i d9 5s7d 0.000E+00 ( //r2// )= 0.000E+00 a0 0.0000 0.000E+00 0.000 0.000 sqrtdel= 1.0000 0.000E+00 47 -1 0.70 0.50 ag i d10 6g ag i d9 5s8d 0.000E+00 ( //r2// )= 0.000E+00 a0 0.0000 0.000E+00 0.000 0.000 sqrtdel= 1.0000 0.000E+00 47 -1 0.70 0.50 ag i d10 6g ag i d9 5s9d 0.000E+00 ( //r2// )= 0.000E+00 a0 0.0000 0.000E+00 0.000 0.000 sqrtdel= 1.0000 0.000E+00 47 -1 0.70 0.50 ag i d10 6g ag i d8 5s2 5d 0.000E+00 ( //r2// )= 0.000E+00 a0 0.0000 0.000E+00 0.000 0.000 sqrtdel= 1.0000 0.000E+00 47 -1 0.70 0.50 ag i d10 6g ag i d10 5g -4.923E+02 ( 6g//r2// 5g)= 7.528E+02 a0 -0.6324 3.848E+03 0.000 0.000 sqrtdel= 1.0000 7.528E+02 47 -1 0.70 0.50 ag i d10 6g ag i d10 6g 2.178E+03 ( 6g//r2// 6g)=-3.330E+03 a0 1.0000 7.529E+04 1.000 1.000 sqrtdel= 1.0000 -3.330E+03 47 -1 0.70 0.50 ag i d10 6g ag i d10 7g -1.185E+03 ( 6g//r2// 7g)= 1.811E+03 a0 -0.6019 2.228E+04 0.000 0.000 sqrtdel= 1.0000 1.811E+03 47 -1 0.70 0.50 ag i d10 6g ag i d10 8g -2.665E+02 ( 6g//r2// 8g)= 4.074E+02 a0 -0.1941 1.127E+03 0.000 0.000 sqrtdel= 1.0000 4.074E+02 47 -1 0.70 0.50 ag i d10 6g ag i d10 9g -1.180E+02 ( 6g//r2// 9g)= 1.805E+02 a0 -0.1114 2.211E+02 0.000 0.000 sqrtdel= 1.0000 1.805E+02 47 -1 0.70 0.50 ag i d10 6g ag i d9 5s5g 0.000E+00 ( //r2// )= 0.000E+00 a0 0.0000 0.000E+00 0.000 0.000 sqrtdel= 1.0000 0.000E+00 47 -1 0.70 0.50 ag i d10 6g ag i d9 5s6g -3.165E+00 ( 4d//r2// 5s)=-3.165E+00 a0 -0.9614 6.679E-01-0.449-0.676 sqrtdel= 1.0000 -3.165E+00 47 -1 0.70 0.50 ag i d10 6g ag i d9 5s7g 0.000E+00 ( //r2// )= 0.000E+00 a0 0.0000 0.000E+00 0.000 0.000 sqrtdel= 1.0000 0.000E+00 47 -1 0.70 0.50 ag i d10 6g ag i d9 5s8g 0.000E+00 ( //r2// )= 0.000E+00 a0 0.0000 0.000E+00 0.000 0.000 sqrtdel= 1.0000 0.000E+00 47 -1 0.70 0.50 ag i d10 6g ag i d9 5s9g 0.000E+00 ( //r2// )= 0.000E+00 a0 0.0000 0.000E+00 0.000 0.000 sqrtdel= 1.0000 0.000E+00 47 -1 0.70 0.50 ag i d10 6g ag i d10 7i -2.370E+03 ( 6g//r2// 7i)=-4.794E+03 a0 -0.9808 3.929E+04-0.811-0.904 sqrtdel= 1.0000 -4.794E+03 47 -1 0.70 0.50 ag i d10 6g ag i d10 8i 5.632E+02 ( 6g//r2// 8i)= 1.139E+03 a0 0.3416 2.218E+03-0.046-0.086 sqrtdel= 1.0000 1.139E+03 47 -1 0.70 0.50 ag i d10 6g ag i d10 9i 4.409E+02 ( 6g//r2// 9i)= 8.918E+02 a0 0.3691 1.360E+03 0.074 0.183 sqrtdel= 1.0000 8.918E+02 47 -1 0.70 0.50 ag i d10 6g ag i d9 5s7i 0.000E+00 ( //r2// )= 0.000E+00 a0 0.0000 0.000E+00 0.000 0.000 sqrtdel= 1.0000 0.000E+00 47 -1 0.70 0.50 ag i d10 6g ag i d9 5s8i 0.000E+00 ( //r2// )= 0.000E+00 a0 0.0000 0.000E+00 0.000 0.000 sqrtdel= 1.0000 0.000E+00 47 -1 0.70 0.50 ag i d10 6g ag i d9 5s9i 0.000E+00 ( //r2// )= 0.000E+00 a0 0.0000 0.000E+00 0.000 0.000 sqrtdel= 1.0000 0.000E+00 47 -1 0.70 0.50 ag i d10 6g ag i d10 9l 0.000E+00 ( //r2// )= 0.000E+00 a0 0.0000 0.000E+00 0.000 0.000 sqrtdel= 1.0000 0.000E+00 47 -1 0.70 0.50 ag i d10 6g ag i d9 5s9l 0.000E+00 ( //r2// )= 0.000E+00 a0 0.0000 0.000E+00 0.000 0.000 sqrtdel= 1.0000 0.000E+00 47 -1 0.70 0.50 ag i d10 6g ag i d9 5p2 0.000E+00 ( //r2// )= 0.000E+00 a0 0.0000 0.000E+00 0.000 0.000 sqrtdel= 1.0000 0.000E+00 47 -1 0.70 0.50 ag i d10 7g ag i d10 5s 0.000E+00 ( //r2// )= 0.000E+00 a0 0.0000 0.000E+00 0.000 0.000 sqrtdel= 1.0000 0.000E+00 47 -1 0.70 0.50 ag i d10 7g ag i d10 6s 0.000E+00 ( //r2// )= 0.000E+00 a0 0.0000 0.000E+00 0.000 0.000 sqrtdel= 1.0000 0.000E+00 47 -1 0.70 0.50 ag i d10 7g ag i d10 7s 0.000E+00 ( //r2// )= 0.000E+00 a0 0.0000 0.000E+00 0.000 0.000 sqrtdel= 1.0000 0.000E+00 47 -1 0.70 0.50 ag i d10 7g ag i d10 8s 0.000E+00 ( //r2// )= 0.000E+00 a0 0.0000 0.000E+00 0.000 0.000 sqrtdel= 1.0000 0.000E+00 47 -1 0.70 0.50 ag i d10 7g ag i d10 9s 0.000E+00 ( //r2// )= 0.000E+00 a0 0.0000 0.000E+00 0.000 0.000 sqrtdel= 1.0000 0.000E+00 47 -1 0.70 0.50 ag i d10 7g ag i d9 5s2 0.000E+00 ( //r2// )= 0.000E+00 a0 0.0000 0.000E+00 0.000 0.000 sqrtdel= 1.0000 0.000E+00 47 -1 0.70 0.50 ag i d10 7g ag i d9 5s6s 0.000E+00 ( //r2// )= 0.000E+00 a0 0.0000 0.000E+00 0.000 0.000 sqrtdel= 1.0000 0.000E+00 47 -1 0.70 0.50 ag i d10 7g ag i d9 5s7s 0.000E+00 ( //r2// )= 0.000E+00 a0 0.0000 0.000E+00 0.000 0.000 sqrtdel= 1.0000 0.000E+00 47 -1 0.70 0.50 ag i d10 7g ag i d9 5s8s 0.000E+00 ( //r2// )= 0.000E+00 a0 0.0000 0.000E+00 0.000 0.000 sqrtdel= 1.0000 0.000E+00 47 -1 0.70 0.50 ag i d10 7g ag i d9 5s9s 0.000E+00 ( //r2// )= 0.000E+00 a0 0.0000 0.000E+00 0.000 0.000 sqrtdel= 1.0000 0.000E+00 47 -1 0.70 0.50 ag i d10 7g ag i d8 5s2 6s 0.000E+00 ( //r2// )= 0.000E+00 a0 0.0000 0.000E+00 0.000 0.000 sqrtdel= 1.0000 0.000E+00 47 -1 0.70 0.50 ag i d10 7g ag i d10 5d 4.388E+01 ( 7g//r2// 5d)= 7.036E+01 a0 0.7861 3.056E+01 0.211 0.951 sqrtdel= 1.0000 7.036E+01 47 -1 0.70 0.50 ag i d10 7g ag i d10 6d 6.332E+01 ( 7g//r2// 6d)= 1.015E+02 a0 0.2486 6.365E+01-0.070-0.196 sqrtdel= 1.0000 1.015E+02 47 -1 0.70 0.50 ag i d10 7g ag i d10 7d -8.073E+01 ( 7g//r2// 7d)=-1.294E+02 a0 -0.0857 1.034E+02-0.318-0.576 sqrtdel= 1.0000 -1.294E+02 47 -1 0.70 0.50 ag i d10 7g ag i d10 8d -2.661E+03 ( 7g//r2// 8d)=-4.267E+03 a0 -0.9325 1.124E+05-0.644-0.847 sqrtdel= 1.0000 -4.267E+03 47 -1 0.70 0.50 ag i d10 7g ag i d10 9d 4.442E+03 ( 7g//r2// 9d)= 7.123E+03 a0 0.9549 3.132E+05 0.655 0.763 sqrtdel= 1.0000 7.123E+03 47 -1 0.70 0.50 ag i d10 7g ag i d9 5s5d 0.000E+00 ( //r2// )= 0.000E+00 a0 0.0000 0.000E+00 0.000 0.000 sqrtdel= 1.0000 0.000E+00 47 -1 0.70 0.50 ag i d10 7g ag i d9 5s6d 0.000E+00 ( //r2// )= 0.000E+00 a0 0.0000 0.000E+00 0.000 0.000 sqrtdel= 1.0000 0.000E+00 47 -1 0.70 0.50 ag i d10 7g ag i d9 5s7d 0.000E+00 ( //r2// )= 0.000E+00 a0 0.0000 0.000E+00 0.000 0.000 sqrtdel= 1.0000 0.000E+00 47 -1 0.70 0.50 ag i d10 7g ag i d9 5s8d 0.000E+00 ( //r2// )= 0.000E+00 a0 0.0000 0.000E+00 0.000 0.000 sqrtdel= 1.0000 0.000E+00 47 -1 0.70 0.50 ag i d10 7g ag i d9 5s9d 0.000E+00 ( //r2// )= 0.000E+00 a0 0.0000 0.000E+00 0.000 0.000 sqrtdel= 1.0000 0.000E+00 47 -1 0.70 0.50 ag i d10 7g ag i d8 5s2 5d 0.000E+00 ( //r2// )= 0.000E+00 a0 0.0000 0.000E+00 0.000 0.000 sqrtdel= 1.0000 0.000E+00 47 -1 0.70 0.50 ag i d10 7g ag i d10 5g -1.066E+02 ( 7g//r2// 5g)= 1.629E+02 a0 -0.2041 1.802E+02 0.000 0.000 sqrtdel= 1.0000 1.629E+02 47 -1 0.70 0.50 ag i d10 7g ag i d10 6g -1.185E+03 ( 7g//r2// 6g)= 1.811E+03 a0 -0.6019 2.228E+04 0.000 0.000 sqrtdel= 1.0000 1.811E+03 47 -1 0.70 0.50 ag i d10 7g ag i d10 7g 4.557E+03 ( 7g//r2// 7g)=-6.967E+03 a0 1.0000 3.296E+05 1.000 1.000 sqrtdel= 1.0000 -6.967E+03 47 -1 0.70 0.50 ag i d10 7g ag i d10 8g -2.303E+03 ( 7g//r2// 8g)= 3.521E+03 a0 -0.5728 8.419E+04 0.000 0.000 sqrtdel= 1.0000 3.521E+03 47 -1 0.70 0.50 ag i d10 7g ag i d10 9g -5.239E+02 ( 7g//r2// 9g)= 8.010E+02 a0 -0.1819 4.357E+03 0.000 0.000 sqrtdel= 1.0000 8.010E+02 47 -1 0.70 0.50 ag i d10 7g ag i d9 5s5g 0.000E+00 ( //r2// )= 0.000E+00 a0 0.0000 0.000E+00 0.000 0.000 sqrtdel= 1.0000 0.000E+00 47 -1 0.70 0.50 ag i d10 7g ag i d9 5s6g 0.000E+00 ( //r2// )= 0.000E+00 a0 0.0000 0.000E+00 0.000 0.000 sqrtdel= 1.0000 0.000E+00 47 -1 0.70 0.50 ag i d10 7g ag i d9 5s7g -3.165E+00 ( 4d//r2// 5s)=-3.165E+00 a0 -0.9614 6.679E-01-0.449-0.676 sqrtdel= 1.0000 -3.165E+00 47 -1 0.70 0.50 ag i d10 7g ag i d9 5s8g 0.000E+00 ( //r2// )= 0.000E+00 a0 0.0000 0.000E+00 0.000 0.000 sqrtdel= 1.0000 0.000E+00 47 -1 0.70 0.50 ag i d10 7g ag i d9 5s9g 0.000E+00 ( //r2// )= 0.000E+00 a0 0.0000 0.000E+00 0.000 0.000 sqrtdel= 1.0000 0.000E+00 47 -1 0.70 0.50 ag i d10 7g ag i d10 7i 2.164E+03 ( 7g//r2// 7i)= 4.377E+03 a0 0.7466 3.274E+04 0.291 0.382 sqrtdel= 1.0000 4.377E+03 47 -1 0.70 0.50 ag i d10 7g ag i d10 8i -4.740E+03 ( 7g//r2// 8i)=-9.586E+03 a0 -0.9902 1.571E+05-0.819-0.938 sqrtdel= 1.0000 -9.586E+03 47 -1 0.70 0.50 ag i d10 7g ag i d10 9i 2.137E+02 ( 7g//r2// 9i)= 4.322E+02 a0 0.0631 3.193E+02-0.243-0.399 sqrtdel= 1.0000 4.322E+02 47 -1 0.70 0.50 ag i d10 7g ag i d9 5s7i 0.000E+00 ( //r2// )= 0.000E+00 a0 0.0000 0.000E+00 0.000 0.000 sqrtdel= 1.0000 0.000E+00 47 -1 0.70 0.50 ag i d10 7g ag i d9 5s8i 0.000E+00 ( //r2// )= 0.000E+00 a0 0.0000 0.000E+00 0.000 0.000 sqrtdel= 1.0000 0.000E+00 47 -1 0.70 0.50 ag i d10 7g ag i d9 5s9i 0.000E+00 ( //r2// )= 0.000E+00 a0 0.0000 0.000E+00 0.000 0.000 sqrtdel= 1.0000 0.000E+00 47 -1 0.70 0.50 ag i d10 7g ag i d10 9l 0.000E+00 ( //r2// )= 0.000E+00 a0 0.0000 0.000E+00 0.000 0.000 sqrtdel= 1.0000 0.000E+00 47 -1 0.70 0.50 ag i d10 7g ag i d9 5s9l 0.000E+00 ( //r2// )= 0.000E+00 a0 0.0000 0.000E+00 0.000 0.000 sqrtdel= 1.0000 0.000E+00 47 -1 0.70 0.50 ag i d10 7g ag i d9 5p2 0.000E+00 ( //r2// )= 0.000E+00 a0 0.0000 0.000E+00 0.000 0.000 sqrtdel= 1.0000 0.000E+00 47 -1 0.70 0.50 ag i d10 8g ag i d10 5s 0.000E+00 ( //r2// )= 0.000E+00 a0 0.0000 0.000E+00 0.000 0.000 sqrtdel= 1.0000 0.000E+00 47 -1 0.70 0.50 ag i d10 8g ag i d10 6s 0.000E+00 ( //r2// )= 0.000E+00 a0 0.0000 0.000E+00 0.000 0.000 sqrtdel= 1.0000 0.000E+00 47 -1 0.70 0.50 ag i d10 8g ag i d10 7s 0.000E+00 ( //r2// )= 0.000E+00 a0 0.0000 0.000E+00 0.000 0.000 sqrtdel= 1.0000 0.000E+00 47 -1 0.70 0.50 ag i d10 8g ag i d10 8s 0.000E+00 ( //r2// )= 0.000E+00 a0 0.0000 0.000E+00 0.000 0.000 sqrtdel= 1.0000 0.000E+00 47 -1 0.70 0.50 ag i d10 8g ag i d10 9s 0.000E+00 ( //r2// )= 0.000E+00 a0 0.0000 0.000E+00 0.000 0.000 sqrtdel= 1.0000 0.000E+00 47 -1 0.70 0.50 ag i d10 8g ag i d9 5s2 0.000E+00 ( //r2// )= 0.000E+00 a0 0.0000 0.000E+00 0.000 0.000 sqrtdel= 1.0000 0.000E+00 47 -1 0.70 0.50 ag i d10 8g ag i d9 5s6s 0.000E+00 ( //r2// )= 0.000E+00 a0 0.0000 0.000E+00 0.000 0.000 sqrtdel= 1.0000 0.000E+00 47 -1 0.70 0.50 ag i d10 8g ag i d9 5s7s 0.000E+00 ( //r2// )= 0.000E+00 a0 0.0000 0.000E+00 0.000 0.000 sqrtdel= 1.0000 0.000E+00 47 -1 0.70 0.50 ag i d10 8g ag i d9 5s8s 0.000E+00 ( //r2// )= 0.000E+00 a0 0.0000 0.000E+00 0.000 0.000 sqrtdel= 1.0000 0.000E+00 47 -1 0.70 0.50 ag i d10 8g ag i d9 5s9s 0.000E+00 ( //r2// )= 0.000E+00 a0 0.0000 0.000E+00 0.000 0.000 sqrtdel= 1.0000 0.000E+00 47 -1 0.70 0.50 ag i d10 8g ag i d8 5s2 6s 0.000E+00 ( //r2// )= 0.000E+00 a0 0.0000 0.000E+00 0.000 0.000 sqrtdel= 1.0000 0.000E+00 47 -1 0.70 0.50 ag i d10 8g ag i d10 5d 3.208E+01 ( 8g//r2// 5d)= 5.145E+01 a0 0.7261 1.634E+01 0.169 0.933 sqrtdel= 1.0000 5.145E+01 47 -1 0.70 0.50 ag i d10 8g ag i d10 6d 5.146E+01 ( 8g//r2// 6d)= 8.252E+01 a0 0.2599 4.204E+01-0.025-0.090 sqrtdel= 1.0000 8.252E+01 47 -1 0.70 0.50 ag i d10 8g ag i d10 7d 2.537E+01 ( 8g//r2// 7d)= 4.068E+01 a0 0.0366 1.022E+01-0.177-0.420 sqrtdel= 1.0000 4.068E+01 47 -1 0.70 0.50 ag i d10 8g ag i d10 8d -3.125E+02 ( 8g//r2// 8d)=-5.011E+02 a0 -0.1561 1.550E+03-0.324-0.579 sqrtdel= 1.0000 -5.011E+02 47 -1 0.70 0.50 ag i d10 8g ag i d10 9d -4.550E+03 ( 8g//r2// 9d)=-7.296E+03 a0 -0.8790 3.286E+05-0.547-0.746 sqrtdel= 1.0000 -7.296E+03 47 -1 0.70 0.50 ag i d10 8g ag i d9 5s5d 0.000E+00 ( //r2// )= 0.000E+00 a0 0.0000 0.000E+00 0.000 0.000 sqrtdel= 1.0000 0.000E+00 47 -1 0.70 0.50 ag i d10 8g ag i d9 5s6d 0.000E+00 ( //r2// )= 0.000E+00 a0 0.0000 0.000E+00 0.000 0.000 sqrtdel= 1.0000 0.000E+00 47 -1 0.70 0.50 ag i d10 8g ag i d9 5s7d 0.000E+00 ( //r2// )= 0.000E+00 a0 0.0000 0.000E+00 0.000 0.000 sqrtdel= 1.0000 0.000E+00 47 -1 0.70 0.50 ag i d10 8g ag i d9 5s8d 0.000E+00 ( //r2// )= 0.000E+00 a0 0.0000 0.000E+00 0.000 0.000 sqrtdel= 1.0000 0.000E+00 47 -1 0.70 0.50 ag i d10 8g ag i d9 5s9d 0.000E+00 ( //r2// )= 0.000E+00 a0 0.0000 0.000E+00 0.000 0.000 sqrtdel= 1.0000 0.000E+00 47 -1 0.70 0.50 ag i d10 8g ag i d8 5s2 5d 0.000E+00 ( //r2// )= 0.000E+00 a0 0.0000 0.000E+00 0.000 0.000 sqrtdel= 1.0000 0.000E+00 47 -1 0.70 0.50 ag i d10 8g ag i d10 5g -4.667E+01 ( 8g//r2// 5g)= 7.135E+01 a0 -0.1181 3.457E+01 0.000 0.000 sqrtdel= 1.0000 7.135E+01 47 -1 0.70 0.50 ag i d10 8g ag i d10 6g -2.665E+02 ( 8g//r2// 6g)= 4.074E+02 a0 -0.1941 1.127E+03 0.000 0.000 sqrtdel= 1.0000 4.074E+02 47 -1 0.70 0.50 ag i d10 8g ag i d10 7g -2.303E+03 ( 8g//r2// 7g)= 3.521E+03 a0 -0.5728 8.419E+04 0.000 0.000 sqrtdel= 1.0000 3.521E+03 47 -1 0.70 0.50 ag i d10 8g ag i d10 8g 8.352E+03 ( 8g//r2// 8g)=-1.277E+04 a0 1.0000 1.107E+06 1.000 1.000 sqrtdel= 1.0000 -1.277E+04 47 -1 0.70 0.50 ag i d10 8g ag i d10 9g -4.000E+03 ( 8g//r2// 9g)= 6.115E+03 a0 -0.5509 2.539E+05 0.000 0.000 sqrtdel= 1.0000 6.115E+03 47 -1 0.70 0.50 ag i d10 8g ag i d9 5s5g 0.000E+00 ( //r2// )= 0.000E+00 a0 0.0000 0.000E+00 0.000 0.000 sqrtdel= 1.0000 0.000E+00 47 -1 0.70 0.50 ag i d10 8g ag i d9 5s6g 0.000E+00 ( //r2// )= 0.000E+00 a0 0.0000 0.000E+00 0.000 0.000 sqrtdel= 1.0000 0.000E+00 47 -1 0.70 0.50 ag i d10 8g ag i d9 5s7g 0.000E+00 ( //r2// )= 0.000E+00 a0 0.0000 0.000E+00 0.000 0.000 sqrtdel= 1.0000 0.000E+00 47 -1 0.70 0.50 ag i d10 8g ag i d9 5s8g -3.165E+00 ( 4d//r2// 5s)=-3.165E+00 a0 -0.9614 6.679E-01-0.449-0.676 sqrtdel= 1.0000 -3.165E+00 47 -1 0.70 0.50 ag i d10 8g ag i d9 5s9g 0.000E+00 ( //r2// )= 0.000E+00 a0 0.0000 0.000E+00 0.000 0.000 sqrtdel= 1.0000 0.000E+00 47 -1 0.70 0.50 ag i d10 8g ag i d10 7i -3.152E+02 ( 8g//r2// 7i)=-6.375E+02 a0 -0.1423 6.948E+02 0.026 0.048 sqrtdel= 1.0000 -6.375E+02 47 -1 0.70 0.50 ag i d10 8g ag i d10 8i 5.287E+03 ( 8g//r2// 8i)= 1.069E+04 a0 0.8532 1.955E+05 0.431 0.534 sqrtdel= 1.0000 1.069E+04 47 -1 0.70 0.50 ag i d10 8g ag i d10 9i -7.964E+03 ( 8g//r2// 9i)=-1.611E+04 a0 -0.9657 4.436E+05-0.754-0.911 sqrtdel= 1.0000 -1.611E+04 47 -1 0.70 0.50 ag i d10 8g ag i d9 5s7i 0.000E+00 ( //r2// )= 0.000E+00 a0 0.0000 0.000E+00 0.000 0.000 sqrtdel= 1.0000 0.000E+00 47 -1 0.70 0.50 ag i d10 8g ag i d9 5s8i 0.000E+00 ( //r2// )= 0.000E+00 a0 0.0000 0.000E+00 0.000 0.000 sqrtdel= 1.0000 0.000E+00 47 -1 0.70 0.50 ag i d10 8g ag i d9 5s9i 0.000E+00 ( //r2// )= 0.000E+00 a0 0.0000 0.000E+00 0.000 0.000 sqrtdel= 1.0000 0.000E+00 47 -1 0.70 0.50 ag i d10 8g ag i d10 9l 0.000E+00 ( //r2// )= 0.000E+00 a0 0.0000 0.000E+00 0.000 0.000 sqrtdel= 1.0000 0.000E+00 47 -1 0.70 0.50 ag i d10 8g ag i d9 5s9l 0.000E+00 ( //r2// )= 0.000E+00 a0 0.0000 0.000E+00 0.000 0.000 sqrtdel= 1.0000 0.000E+00 47 -1 0.70 0.50 ag i d10 8g ag i d9 5p2 0.000E+00 ( //r2// )= 0.000E+00 a0 0.0000 0.000E+00 0.000 0.000 sqrtdel= 1.0000 0.000E+00 47 -1 0.70 0.50 ag i d10 9g ag i d10 5s 0.000E+00 ( //r2// )= 0.000E+00 a0 0.0000 0.000E+00 0.000 0.000 sqrtdel= 1.0000 0.000E+00 47 -1 0.70 0.50 ag i d10 9g ag i d10 6s 0.000E+00 ( //r2// )= 0.000E+00 a0 0.0000 0.000E+00 0.000 0.000 sqrtdel= 1.0000 0.000E+00 47 -1 0.70 0.50 ag i d10 9g ag i d10 7s 0.000E+00 ( //r2// )= 0.000E+00 a0 0.0000 0.000E+00 0.000 0.000 sqrtdel= 1.0000 0.000E+00 47 -1 0.70 0.50 ag i d10 9g ag i d10 8s 0.000E+00 ( //r2// )= 0.000E+00 a0 0.0000 0.000E+00 0.000 0.000 sqrtdel= 1.0000 0.000E+00 47 -1 0.70 0.50 ag i d10 9g ag i d10 9s 0.000E+00 ( //r2// )= 0.000E+00 a0 0.0000 0.000E+00 0.000 0.000 sqrtdel= 1.0000 0.000E+00 47 -1 0.70 0.50 ag i d10 9g ag i d9 5s2 0.000E+00 ( //r2// )= 0.000E+00 a0 0.0000 0.000E+00 0.000 0.000 sqrtdel= 1.0000 0.000E+00 47 -1 0.70 0.50 ag i d10 9g ag i d9 5s6s 0.000E+00 ( //r2// )= 0.000E+00 a0 0.0000 0.000E+00 0.000 0.000 sqrtdel= 1.0000 0.000E+00 47 -1 0.70 0.50 ag i d10 9g ag i d9 5s7s 0.000E+00 ( //r2// )= 0.000E+00 a0 0.0000 0.000E+00 0.000 0.000 sqrtdel= 1.0000 0.000E+00 47 -1 0.70 0.50 ag i d10 9g ag i d9 5s8s 0.000E+00 ( //r2// )= 0.000E+00 a0 0.0000 0.000E+00 0.000 0.000 sqrtdel= 1.0000 0.000E+00 47 -1 0.70 0.50 ag i d10 9g ag i d9 5s9s 0.000E+00 ( //r2// )= 0.000E+00 a0 0.0000 0.000E+00 0.000 0.000 sqrtdel= 1.0000 0.000E+00 47 -1 0.70 0.50 ag i d10 9g ag i d8 5s2 6s 0.000E+00 ( //r2// )= 0.000E+00 a0 0.0000 0.000E+00 0.000 0.000 sqrtdel= 1.0000 0.000E+00 47 -1 0.70 0.50 ag i d10 9g ag i d10 5d 2.492E+01 ( 9g//r2// 5d)= 3.996E+01 a0 0.6873 9.859E+00 0.139 0.920 sqrtdel= 1.0000 3.996E+01 47 -1 0.70 0.50 ag i d10 9g ag i d10 6d 4.135E+01 ( 9g//r2// 6d)= 6.631E+01 a0 0.2568 2.714E+01-0.007-0.030 sqrtdel= 1.0000 6.631E+01 47 -1 0.70 0.50 ag i d10 9g ag i d10 7d 3.858E+01 ( 9g//r2// 7d)= 6.186E+01 a0 0.0700 2.362E+01-0.114-0.336 sqrtdel= 1.0000 6.186E+01 47 -1 0.70 0.50 ag i d10 9g ag i d10 8d -5.599E+01 ( 9g//r2// 8d)=-8.978E+01 a0 -0.0368 4.975E+01-0.204-0.455 sqrtdel= 1.0000 -8.978E+01 47 -1 0.70 0.50 ag i d10 9g ag i d10 9d -6.760E+02 ( 9g//r2// 9d)=-1.084E+03 a0 -0.1795 7.254E+03-0.302-0.540 sqrtdel= 1.0000 -1.084E+03 47 -1 0.70 0.50 ag i d10 9g ag i d9 5s5d 0.000E+00 ( //r2// )= 0.000E+00 a0 0.0000 0.000E+00 0.000 0.000 sqrtdel= 1.0000 0.000E+00 47 -1 0.70 0.50 ag i d10 9g ag i d9 5s6d 0.000E+00 ( //r2// )= 0.000E+00 a0 0.0000 0.000E+00 0.000 0.000 sqrtdel= 1.0000 0.000E+00 47 -1 0.70 0.50 ag i d10 9g ag i d9 5s7d 0.000E+00 ( //r2// )= 0.000E+00 a0 0.0000 0.000E+00 0.000 0.000 sqrtdel= 1.0000 0.000E+00 47 -1 0.70 0.50 ag i d10 9g ag i d9 5s8d 0.000E+00 ( //r2// )= 0.000E+00 a0 0.0000 0.000E+00 0.000 0.000 sqrtdel= 1.0000 0.000E+00 47 -1 0.70 0.50 ag i d10 9g ag i d9 5s9d 0.000E+00 ( //r2// )= 0.000E+00 a0 0.0000 0.000E+00 0.000 0.000 sqrtdel= 1.0000 0.000E+00 47 -1 0.70 0.50 ag i d10 9g ag i d8 5s2 5d 0.000E+00 ( //r2// )= 0.000E+00 a0 0.0000 0.000E+00 0.000 0.000 sqrtdel= 1.0000 0.000E+00 47 -1 0.70 0.50 ag i d10 9g ag i d10 5g -2.706E+01 ( 9g//r2// 5g)= 4.137E+01 a0 -0.0850 1.162E+01 0.000 0.000 sqrtdel= 1.0000 4.137E+01 47 -1 0.70 0.50 ag i d10 9g ag i d10 6g -1.180E+02 ( 9g//r2// 6g)= 1.805E+02 a0 -0.1114 2.211E+02 0.000 0.000 sqrtdel= 1.0000 1.805E+02 47 -1 0.70 0.50 ag i d10 9g ag i d10 7g -5.239E+02 ( 9g//r2// 7g)= 8.010E+02 a0 -0.1819 4.357E+03 0.000 0.000 sqrtdel= 1.0000 8.010E+02 47 -1 0.70 0.50 ag i d10 9g ag i d10 8g -4.000E+03 ( 9g//r2// 8g)= 6.115E+03 a0 -0.5509 2.539E+05 0.000 0.000 sqrtdel= 1.0000 6.115E+03 47 -1 0.70 0.50 ag i d10 9g ag i d10 9g 1.401E+04 ( 9g//r2// 9g)=-2.142E+04 a0 1.0000 3.117E+06 1.000 1.000 sqrtdel= 1.0000 -2.142E+04 47 -1 0.70 0.50 ag i d10 9g ag i d9 5s5g 0.000E+00 ( //r2// )= 0.000E+00 a0 0.0000 0.000E+00 0.000 0.000 sqrtdel= 1.0000 0.000E+00 47 -1 0.70 0.50 ag i d10 9g ag i d9 5s6g 0.000E+00 ( //r2// )= 0.000E+00 a0 0.0000 0.000E+00 0.000 0.000 sqrtdel= 1.0000 0.000E+00 47 -1 0.70 0.50 ag i d10 9g ag i d9 5s7g 0.000E+00 ( //r2// )= 0.000E+00 a0 0.0000 0.000E+00 0.000 0.000 sqrtdel= 1.0000 0.000E+00 47 -1 0.70 0.50 ag i d10 9g ag i d9 5s8g 0.000E+00 ( //r2// )= 0.000E+00 a0 0.0000 0.000E+00 0.000 0.000 sqrtdel= 1.0000 0.000E+00 47 -1 0.70 0.50 ag i d10 9g ag i d9 5s9g -3.165E+00 ( 4d//r2// 5s)=-3.165E+00 a0 -0.9614 6.679E-01-0.449-0.676 sqrtdel= 1.0000 -3.165E+00 47 -1 0.70 0.50 ag i d10 9g ag i d10 7i -6.948E+01 ( 9g//r2// 7i)=-1.405E+02 a0 -0.0419 3.375E+01 0.012 0.027 sqrtdel= 1.0000 -1.405E+02 47 -1 0.70 0.50 ag i d10 9g ag i d10 8i -8.711E+02 ( 9g//r2// 8i)=-1.762E+03 a0 -0.1779 5.306E+03 0.042 0.069 sqrtdel= 1.0000 -1.762E+03 47 -1 0.70 0.50 ag i d10 9g ag i d10 9i 1.017E+04 ( 9g//r2// 9i)= 2.056E+04 a0 0.9066 7.227E+05 0.531 0.639 sqrtdel= 1.0000 2.056E+04 47 -1 0.70 0.50 ag i d10 9g ag i d9 5s7i 0.000E+00 ( //r2// )= 0.000E+00 a0 0.0000 0.000E+00 0.000 0.000 sqrtdel= 1.0000 0.000E+00 47 -1 0.70 0.50 ag i d10 9g ag i d9 5s8i 0.000E+00 ( //r2// )= 0.000E+00 a0 0.0000 0.000E+00 0.000 0.000 sqrtdel= 1.0000 0.000E+00 47 -1 0.70 0.50 ag i d10 9g ag i d9 5s9i 0.000E+00 ( //r2// )= 0.000E+00 a0 0.0000 0.000E+00 0.000 0.000 sqrtdel= 1.0000 0.000E+00 47 -1 0.70 0.50 ag i d10 9g ag i d10 9l 0.000E+00 ( //r2// )= 0.000E+00 a0 0.0000 0.000E+00 0.000 0.000 sqrtdel= 1.0000 0.000E+00 47 -1 0.70 0.50 ag i d10 9g ag i d9 5s9l 0.000E+00 ( //r2// )= 0.000E+00 a0 0.0000 0.000E+00 0.000 0.000 sqrtdel= 1.0000 0.000E+00 47 -1 0.70 0.50 ag i d10 9g ag i d9 5p2 0.000E+00 ( //r2// )= 0.000E+00 a0 0.0000 0.000E+00 0.000 0.000 sqrtdel= 1.0000 0.000E+00 47 -1 0.70 0.50 ag i d9 5s5g ag i d10 5s -2.882E-02 ( 5g//r2// 4d)=-4.621E-02 a0 -1.0000 1.318E-05-0.001-1.000 sqrtdel= 1.0000 -4.621E-02 47 -1 0.70 0.50 ag i d9 5s5g ag i d10 6s 0.000E+00 ( //r2// )= 0.000E+00 a0 0.0000 0.000E+00 0.000 0.000 sqrtdel= 1.0000 0.000E+00 47 -1 0.70 0.50 ag i d9 5s5g ag i d10 7s 0.000E+00 ( //r2// )= 0.000E+00 a0 0.0000 0.000E+00 0.000 0.000 sqrtdel= 1.0000 0.000E+00 47 -1 0.70 0.50 ag i d9 5s5g ag i d10 8s 0.000E+00 ( //r2// )= 0.000E+00 a0 0.0000 0.000E+00 0.000 0.000 sqrtdel= 1.0000 0.000E+00 47 -1 0.70 0.50 ag i d9 5s5g ag i d10 9s 0.000E+00 ( //r2// )= 0.000E+00 a0 0.0000 0.000E+00 0.000 0.000 sqrtdel= 1.0000 0.000E+00 47 -1 0.70 0.50 ag i d9 5s5g ag i d9 5s2 0.000E+00 ( //r2// )= 0.000E+00 a0 0.0000 0.000E+00 0.000 0.000 sqrtdel= 1.0000 0.000E+00 47 -1 0.70 0.50 ag i d9 5s5g ag i d9 5s6s 0.000E+00 ( //r2// )= 0.000E+00 a0 0.0000 0.000E+00 0.000 0.000 sqrtdel= 1.0000 0.000E+00 47 -1 0.70 0.50 ag i d9 5s5g ag i d9 5s7s 0.000E+00 ( //r2// )= 0.000E+00 a0 0.0000 0.000E+00 0.000 0.000 sqrtdel= 1.0000 0.000E+00 47 -1 0.70 0.50 ag i d9 5s5g ag i d9 5s8s 0.000E+00 ( //r2// )= 0.000E+00 a0 0.0000 0.000E+00 0.000 0.000 sqrtdel= 1.0000 0.000E+00 47 -1 0.70 0.50 ag i d9 5s5g ag i d9 5s9s 0.000E+00 ( //r2// )= 0.000E+00 a0 0.0000 0.000E+00 0.000 0.000 sqrtdel= 1.0000 0.000E+00 47 -1 0.70 0.50 ag i d9 5s5g ag i d8 5s2 6s 0.000E+00 ( //r2// )= 0.000E+00 a0 0.0000 0.000E+00 0.000 0.000 sqrtdel= 1.0000 0.000E+00 47 -1 0.70 0.50 ag i d9 5s5g ag i d10 5d 0.000E+00 ( //r2// )= 0.000E+00 a0 0.0000 0.000E+00 0.000 0.000 sqrtdel= 1.0000 0.000E+00 47 -1 0.70 0.50 ag i d9 5s5g ag i d10 6d 0.000E+00 ( //r2// )= 0.000E+00 a0 0.0000 0.000E+00 0.000 0.000 sqrtdel= 1.0000 0.000E+00 47 -1 0.70 0.50 ag i d9 5s5g ag i d10 7d 0.000E+00 ( //r2// )= 0.000E+00 a0 0.0000 0.000E+00 0.000 0.000 sqrtdel= 1.0000 0.000E+00 47 -1 0.70 0.50 ag i d9 5s5g ag i d10 8d 0.000E+00 ( //r2// )= 0.000E+00 a0 0.0000 0.000E+00 0.000 0.000 sqrtdel= 1.0000 0.000E+00 47 -1 0.70 0.50 ag i d9 5s5g ag i d10 9d 0.000E+00 ( //r2// )= 0.000E+00 a0 0.0000 0.000E+00 0.000 0.000 sqrtdel= 1.0000 0.000E+00 47 -1 0.70 0.50 ag i d9 5s5g ag i d9 5s5d 1.047E+02 ( 5g//r2// 5d)= 1.678E+02 a0 1.0000 1.739E+02 0.338 1.000 sqrtdel= 1.0000 1.678E+02 47 -1 0.70 0.50 ag i d9 5s5g ag i d9 5s6d -5.608E+02 ( 5g//r2// 6d)=-8.993E+02 a0 -0.9954 4.993E+03-0.838-0.960 sqrtdel= 1.0000 -8.993E+02 47 -1 0.70 0.50 ag i d9 5s5g ag i d9 5s7d 7.657E+02 ( 5g//r2// 7d)= 1.228E+03 a0 0.8694 9.305E+03 0.437 0.543 sqrtdel= 1.0000 1.228E+03 47 -1 0.70 0.50 ag i d9 5s5g ag i d9 5s8d -1.787E+02 ( 5g//r2// 8d)=-2.865E+02 a0 -0.2651 5.067E+02 0.036 0.066 sqrtdel= 1.0000 -2.865E+02 47 -1 0.70 0.50 ag i d9 5s5g ag i d9 5s9d -4.269E+01 ( 5g//r2// 9d)=-6.845E+01 a0 -0.0905 2.892E+01 0.018 0.045 sqrtdel= 1.0000 -6.845E+01 47 -1 0.70 0.50 ag i d9 5s5g ag i d8 5s2 5d 0.000E+00 ( //r2// )= 0.000E+00 a0 0.0000 0.000E+00 0.000 0.000 sqrtdel= 1.0000 0.000E+00 47 -1 0.70 0.50 ag i d9 5s5g ag i d10 5g -3.165E+00 ( 5s//r2// 4d)=-3.165E+00 a0 -0.9614 6.679E-01-0.449-0.676 sqrtdel= 1.0000 -3.165E+00 47 -1 0.70 0.50 ag i d9 5s5g ag i d10 6g 0.000E+00 ( //r2// )= 0.000E+00 a0 0.0000 0.000E+00 0.000 0.000 sqrtdel= 1.0000 0.000E+00 47 -1 0.70 0.50 ag i d9 5s5g ag i d10 7g 0.000E+00 ( //r2// )= 0.000E+00 a0 0.0000 0.000E+00 0.000 0.000 sqrtdel= 1.0000 0.000E+00 47 -1 0.70 0.50 ag i d9 5s5g ag i d10 8g 0.000E+00 ( //r2// )= 0.000E+00 a0 0.0000 0.000E+00 0.000 0.000 sqrtdel= 1.0000 0.000E+00 47 -1 0.70 0.50 ag i d9 5s5g ag i d10 9g 0.000E+00 ( //r2// )= 0.000E+00 a0 0.0000 0.000E+00 0.000 0.000 sqrtdel= 1.0000 0.000E+00 47 -1 0.70 0.50 ag i d9 5s5g ag i d9 5s5g 8.250E+02 ( 5g//r2// 5g)=-1.261E+03 a0 1.0000 1.080E+04 1.000 1.000 sqrtdel= 1.0000 -1.261E+03 47 -1 0.70 0.50 ag i d9 5s5g ag i d9 5s6g -4.923E+02 ( 5g//r2// 6g)= 7.528E+02 a0 -0.6324 3.848E+03 0.000 0.000 sqrtdel= 1.0000 7.528E+02 47 -1 0.70 0.50 ag i d9 5s5g ag i d9 5s7g -1.065E+02 ( 5g//r2// 7g)= 1.629E+02 a0 -0.2041 1.802E+02 0.000 0.000 sqrtdel= 1.0000 1.629E+02 47 -1 0.70 0.50 ag i d9 5s5g ag i d9 5s8g -4.666E+01 ( 5g//r2// 8g)= 7.134E+01 a0 -0.1181 3.456E+01 0.000 0.000 sqrtdel= 1.0000 7.134E+01 47 -1 0.70 0.50 ag i d9 5s5g ag i d9 5s9g -2.705E+01 ( 5g//r2// 9g)= 4.136E+01 a0 -0.0850 1.161E+01 0.000 0.000 sqrtdel= 1.0000 4.136E+01 47 -1 0.70 0.50 ag i d9 5s5g ag i d10 7i 0.000E+00 ( //r2// )= 0.000E+00 a0 0.0000 0.000E+00 0.000 0.000 sqrtdel= 1.0000 0.000E+00 47 -1 0.70 0.50 ag i d9 5s5g ag i d10 8i 0.000E+00 ( //r2// )= 0.000E+00 a0 0.0000 0.000E+00 0.000 0.000 sqrtdel= 1.0000 0.000E+00 47 -1 0.70 0.50 ag i d9 5s5g ag i d10 9i 0.000E+00 ( //r2// )= 0.000E+00 a0 0.0000 0.000E+00 0.000 0.000 sqrtdel= 1.0000 0.000E+00 47 -1 0.70 0.50 ag i d9 5s5g ag i d9 5s7i 7.842E+02 ( 5g//r2// 7i)= 1.586E+03 a0 1.0000 4.300E+03 0.507 1.000 sqrtdel= 1.0000 1.586E+03 47 -1 0.70 0.50 ag i d9 5s5g ag i d9 5s8i 3.954E+02 ( 5g//r2// 8i)= 7.998E+02 a0 0.7568 1.094E+03 0.373 0.933 sqrtdel= 1.0000 7.998E+02 47 -1 0.70 0.50 ag i d9 5s5g ag i d9 5s9i 2.426E+02 ( 5g//r2// 9i)= 4.906E+02 a0 0.5999 4.114E+02 0.284 0.868 sqrtdel= 1.0000 4.906E+02 47 -1 0.70 0.50 ag i d9 5s5g ag i d10 9l 0.000E+00 ( //r2// )= 0.000E+00 a0 0.0000 0.000E+00 0.000 0.000 sqrtdel= 1.0000 0.000E+00 47 -1 0.70 0.50 ag i d9 5s5g ag i d9 5s9l 0.000E+00 ( //r2// )= 0.000E+00 a0 0.0000 0.000E+00 0.000 0.000 sqrtdel= 1.0000 0.000E+00 47 -1 0.70 0.50 ag i d9 5s5g ag i d9 5p2 0.000E+00 ( //r2// )= 0.000E+00 a0 0.0000 0.000E+00 0.000 0.000 sqrtdel= 1.0000 0.000E+00 47 -1 0.70 0.50 ag i d9 5s6g ag i d10 5s -2.944E-02 ( 6g//r2// 4d)=-4.721E-02 a0 -1.0000 1.376E-05-0.001-1.000 sqrtdel= 1.0000 -4.721E-02 47 -1 0.70 0.50 ag i d9 5s6g ag i d10 6s 0.000E+00 ( //r2// )= 0.000E+00 a0 0.0000 0.000E+00 0.000 0.000 sqrtdel= 1.0000 0.000E+00 47 -1 0.70 0.50 ag i d9 5s6g ag i d10 7s 0.000E+00 ( //r2// )= 0.000E+00 a0 0.0000 0.000E+00 0.000 0.000 sqrtdel= 1.0000 0.000E+00 47 -1 0.70 0.50 ag i d9 5s6g ag i d10 8s 0.000E+00 ( //r2// )= 0.000E+00 a0 0.0000 0.000E+00 0.000 0.000 sqrtdel= 1.0000 0.000E+00 47 -1 0.70 0.50 ag i d9 5s6g ag i d10 9s 0.000E+00 ( //r2// )= 0.000E+00 a0 0.0000 0.000E+00 0.000 0.000 sqrtdel= 1.0000 0.000E+00 47 -1 0.70 0.50 ag i d9 5s6g ag i d9 5s2 0.000E+00 ( //r2// )= 0.000E+00 a0 0.0000 0.000E+00 0.000 0.000 sqrtdel= 1.0000 0.000E+00 47 -1 0.70 0.50 ag i d9 5s6g ag i d9 5s6s 0.000E+00 ( //r2// )= 0.000E+00 a0 0.0000 0.000E+00 0.000 0.000 sqrtdel= 1.0000 0.000E+00 47 -1 0.70 0.50 ag i d9 5s6g ag i d9 5s7s 0.000E+00 ( //r2// )= 0.000E+00 a0 0.0000 0.000E+00 0.000 0.000 sqrtdel= 1.0000 0.000E+00 47 -1 0.70 0.50 ag i d9 5s6g ag i d9 5s8s 0.000E+00 ( //r2// )= 0.000E+00 a0 0.0000 0.000E+00 0.000 0.000 sqrtdel= 1.0000 0.000E+00 47 -1 0.70 0.50 ag i d9 5s6g ag i d9 5s9s 0.000E+00 ( //r2// )= 0.000E+00 a0 0.0000 0.000E+00 0.000 0.000 sqrtdel= 1.0000 0.000E+00 47 -1 0.70 0.50 ag i d9 5s6g ag i d8 5s2 6s 0.000E+00 ( //r2// )= 0.000E+00 a0 0.0000 0.000E+00 0.000 0.000 sqrtdel= 1.0000 0.000E+00 47 -1 0.70 0.50 ag i d9 5s6g ag i d10 5d 0.000E+00 ( //r2// )= 0.000E+00 a0 0.0000 0.000E+00 0.000 0.000 sqrtdel= 1.0000 0.000E+00 47 -1 0.70 0.50 ag i d9 5s6g ag i d10 6d 0.000E+00 ( //r2// )= 0.000E+00 a0 0.0000 0.000E+00 0.000 0.000 sqrtdel= 1.0000 0.000E+00 47 -1 0.70 0.50 ag i d9 5s6g ag i d10 7d 0.000E+00 ( //r2// )= 0.000E+00 a0 0.0000 0.000E+00 0.000 0.000 sqrtdel= 1.0000 0.000E+00 47 -1 0.70 0.50 ag i d9 5s6g ag i d10 8d 0.000E+00 ( //r2// )= 0.000E+00 a0 0.0000 0.000E+00 0.000 0.000 sqrtdel= 1.0000 0.000E+00 47 -1 0.70 0.50 ag i d9 5s6g ag i d10 9d 0.000E+00 ( //r2// )= 0.000E+00 a0 0.0000 0.000E+00 0.000 0.000 sqrtdel= 1.0000 0.000E+00 47 -1 0.70 0.50 ag i d9 5s6g ag i d9 5s5d 6.123E+01 ( 6g//r2// 5d)= 9.819E+01 a0 0.8955 5.951E+01 0.258 0.980 sqrtdel= 1.0000 9.819E+01 47 -1 0.70 0.50 ag i d9 5s6g ag i d9 5s6d 2.156E+01 ( 6g//r2// 6d)= 3.457E+01 a0 0.0639 7.379E+00-0.240-0.487 sqrtdel= 1.0000 3.457E+01 47 -1 0.70 0.50 ag i d9 5s6g ag i d9 5s7d -1.286E+03 ( 6g//r2// 7d)=-2.062E+03 a0 -0.9709 2.625E+04-0.712-0.913 sqrtdel= 1.0000 -2.062E+03 47 -1 0.70 0.50 ag i d9 5s6g ag i d9 5s8d 2.131E+03 ( 6g//r2// 8d)= 3.417E+03 a0 0.9417 7.207E+04 0.610 0.716 sqrtdel= 1.0000 3.417E+03 47 -1 0.70 0.50 ag i d9 5s6g ag i d9 5s9d -5.556E+02 ( 6g//r2// 9d)=-8.910E+02 a0 -0.3064 4.900E+03 0.048 0.079 sqrtdel= 1.0000 -8.910E+02 47 -1 0.70 0.50 ag i d9 5s6g ag i d8 5s2 5d 0.000E+00 ( //r2// )= 0.000E+00 a0 0.0000 0.000E+00 0.000 0.000 sqrtdel= 1.0000 0.000E+00 47 -1 0.70 0.50 ag i d9 5s6g ag i d10 5g 0.000E+00 ( //r2// )= 0.000E+00 a0 0.0000 0.000E+00 0.000 0.000 sqrtdel= 1.0000 0.000E+00 47 -1 0.70 0.50 ag i d9 5s6g ag i d10 6g -3.165E+00 ( 5s//r2// 4d)=-3.165E+00 a0 -0.9614 6.679E-01-0.449-0.676 sqrtdel= 1.0000 -3.165E+00 47 -1 0.70 0.50 ag i d9 5s6g ag i d10 7g 0.000E+00 ( //r2// )= 0.000E+00 a0 0.0000 0.000E+00 0.000 0.000 sqrtdel= 1.0000 0.000E+00 47 -1 0.70 0.50 ag i d9 5s6g ag i d10 8g 0.000E+00 ( //r2// )= 0.000E+00 a0 0.0000 0.000E+00 0.000 0.000 sqrtdel= 1.0000 0.000E+00 47 -1 0.70 0.50 ag i d9 5s6g ag i d10 9g 0.000E+00 ( //r2// )= 0.000E+00 a0 0.0000 0.000E+00 0.000 0.000 sqrtdel= 1.0000 0.000E+00 47 -1 0.70 0.50 ag i d9 5s6g ag i d9 5s5g -4.923E+02 ( 6g//r2// 5g)= 7.528E+02 a0 -0.6324 3.848E+03 0.000 0.000 sqrtdel= 1.0000 7.528E+02 47 -1 0.70 0.50 ag i d9 5s6g ag i d9 5s6g 2.178E+03 ( 6g//r2// 6g)=-3.330E+03 a0 1.0000 7.529E+04 1.000 1.000 sqrtdel= 1.0000 -3.330E+03 47 -1 0.70 0.50 ag i d9 5s6g ag i d9 5s7g -1.185E+03 ( 6g//r2// 7g)= 1.811E+03 a0 -0.6019 2.228E+04 0.000 0.000 sqrtdel= 1.0000 1.811E+03 47 -1 0.70 0.50 ag i d9 5s6g ag i d9 5s8g -2.665E+02 ( 6g//r2// 8g)= 4.074E+02 a0 -0.1941 1.127E+03 0.000 0.000 sqrtdel= 1.0000 4.074E+02 47 -1 0.70 0.50 ag i d9 5s6g ag i d9 5s9g -1.180E+02 ( 6g//r2// 9g)= 1.804E+02 a0 -0.1114 2.210E+02 0.000 0.000 sqrtdel= 1.0000 1.804E+02 47 -1 0.70 0.50 ag i d9 5s6g ag i d10 7i 0.000E+00 ( //r2// )= 0.000E+00 a0 0.0000 0.000E+00 0.000 0.000 sqrtdel= 1.0000 0.000E+00 47 -1 0.70 0.50 ag i d9 5s6g ag i d10 8i 0.000E+00 ( //r2// )= 0.000E+00 a0 0.0000 0.000E+00 0.000 0.000 sqrtdel= 1.0000 0.000E+00 47 -1 0.70 0.50 ag i d9 5s6g ag i d10 9i 0.000E+00 ( //r2// )= 0.000E+00 a0 0.0000 0.000E+00 0.000 0.000 sqrtdel= 1.0000 0.000E+00 47 -1 0.70 0.50 ag i d9 5s6g ag i d9 5s7i -2.370E+03 ( 6g//r2// 7i)=-4.794E+03 a0 -0.9808 3.928E+04-0.811-0.904 sqrtdel= 1.0000 -4.794E+03 47 -1 0.70 0.50 ag i d9 5s6g ag i d9 5s8i 5.631E+02 ( 6g//r2// 8i)= 1.139E+03 a0 0.3415 2.217E+03-0.046-0.086 sqrtdel= 1.0000 1.139E+03 47 -1 0.70 0.50 ag i d9 5s6g ag i d9 5s9i 4.409E+02 ( 6g//r2// 9i)= 8.917E+02 a0 0.3690 1.359E+03 0.074 0.183 sqrtdel= 1.0000 8.917E+02 47 -1 0.70 0.50 ag i d9 5s6g ag i d10 9l 0.000E+00 ( //r2// )= 0.000E+00 a0 0.0000 0.000E+00 0.000 0.000 sqrtdel= 1.0000 0.000E+00 47 -1 0.70 0.50 ag i d9 5s6g ag i d9 5s9l 0.000E+00 ( //r2// )= 0.000E+00 a0 0.0000 0.000E+00 0.000 0.000 sqrtdel= 1.0000 0.000E+00 47 -1 0.70 0.50 ag i d9 5s6g ag i d9 5p2 0.000E+00 ( //r2// )= 0.000E+00 a0 0.0000 0.000E+00 0.000 0.000 sqrtdel= 1.0000 0.000E+00 47 -1 0.70 0.50 ag i d9 5s7g ag i d10 5s -2.682E-02 ( 7g//r2// 4d)=-4.301E-02 a0 -1.0000 1.142E-05-0.001-1.000 sqrtdel= 1.0000 -4.301E-02 47 -1 0.70 0.50 ag i d9 5s7g ag i d10 6s 0.000E+00 ( //r2// )= 0.000E+00 a0 0.0000 0.000E+00 0.000 0.000 sqrtdel= 1.0000 0.000E+00 47 -1 0.70 0.50 ag i d9 5s7g ag i d10 7s 0.000E+00 ( //r2// )= 0.000E+00 a0 0.0000 0.000E+00 0.000 0.000 sqrtdel= 1.0000 0.000E+00 47 -1 0.70 0.50 ag i d9 5s7g ag i d10 8s 0.000E+00 ( //r2// )= 0.000E+00 a0 0.0000 0.000E+00 0.000 0.000 sqrtdel= 1.0000 0.000E+00 47 -1 0.70 0.50 ag i d9 5s7g ag i d10 9s 0.000E+00 ( //r2// )= 0.000E+00 a0 0.0000 0.000E+00 0.000 0.000 sqrtdel= 1.0000 0.000E+00 47 -1 0.70 0.50 ag i d9 5s7g ag i d9 5s2 0.000E+00 ( //r2// )= 0.000E+00 a0 0.0000 0.000E+00 0.000 0.000 sqrtdel= 1.0000 0.000E+00 47 -1 0.70 0.50 ag i d9 5s7g ag i d9 5s6s 0.000E+00 ( //r2// )= 0.000E+00 a0 0.0000 0.000E+00 0.000 0.000 sqrtdel= 1.0000 0.000E+00 47 -1 0.70 0.50 ag i d9 5s7g ag i d9 5s7s 0.000E+00 ( //r2// )= 0.000E+00 a0 0.0000 0.000E+00 0.000 0.000 sqrtdel= 1.0000 0.000E+00 47 -1 0.70 0.50 ag i d9 5s7g ag i d9 5s8s 0.000E+00 ( //r2// )= 0.000E+00 a0 0.0000 0.000E+00 0.000 0.000 sqrtdel= 1.0000 0.000E+00 47 -1 0.70 0.50 ag i d9 5s7g ag i d9 5s9s 0.000E+00 ( //r2// )= 0.000E+00 a0 0.0000 0.000E+00 0.000 0.000 sqrtdel= 1.0000 0.000E+00 47 -1 0.70 0.50 ag i d9 5s7g ag i d8 5s2 6s 0.000E+00 ( //r2// )= 0.000E+00 a0 0.0000 0.000E+00 0.000 0.000 sqrtdel= 1.0000 0.000E+00 47 -1 0.70 0.50 ag i d9 5s7g ag i d10 5d 0.000E+00 ( //r2// )= 0.000E+00 a0 0.0000 0.000E+00 0.000 0.000 sqrtdel= 1.0000 0.000E+00 47 -1 0.70 0.50 ag i d9 5s7g ag i d10 6d 0.000E+00 ( //r2// )= 0.000E+00 a0 0.0000 0.000E+00 0.000 0.000 sqrtdel= 1.0000 0.000E+00 47 -1 0.70 0.50 ag i d9 5s7g ag i d10 7d 0.000E+00 ( //r2// )= 0.000E+00 a0 0.0000 0.000E+00 0.000 0.000 sqrtdel= 1.0000 0.000E+00 47 -1 0.70 0.50 ag i d9 5s7g ag i d10 8d 0.000E+00 ( //r2// )= 0.000E+00 a0 0.0000 0.000E+00 0.000 0.000 sqrtdel= 1.0000 0.000E+00 47 -1 0.70 0.50 ag i d9 5s7g ag i d10 9d 0.000E+00 ( //r2// )= 0.000E+00 a0 0.0000 0.000E+00 0.000 0.000 sqrtdel= 1.0000 0.000E+00 47 -1 0.70 0.50 ag i d9 5s7g ag i d9 5s5d 4.130E+01 ( 7g//r2// 5d)= 6.622E+01 a0 0.8072 2.707E+01 0.201 0.957 sqrtdel= 1.0000 6.622E+01 47 -1 0.70 0.50 ag i d9 5s7g ag i d9 5s6d 4.566E+01 ( 7g//r2// 6d)= 7.322E+01 a0 0.1926 3.309E+01-0.099-0.280 sqrtdel= 1.0000 7.322E+01 47 -1 0.70 0.50 ag i d9 5s7g ag i d9 5s7d -1.356E+02 ( 7g//r2// 7d)=-2.174E+02 a0 -0.1554 2.917E+02-0.331-0.619 sqrtdel= 1.0000 -2.174E+02 47 -1 0.70 0.50 ag i d9 5s7g ag i d9 5s8d -2.401E+03 ( 7g//r2// 8d)=-3.851E+03 a0 -0.9037 9.154E+04-0.572-0.787 sqrtdel= 1.0000 -3.851E+03 47 -1 0.70 0.50 ag i d9 5s7g ag i d9 5s9d 4.525E+03 ( 7g//r2// 9d)= 7.256E+03 a0 0.9702 3.250E+05 0.717 0.812 sqrtdel= 1.0000 7.256E+03 47 -1 0.70 0.50 ag i d9 5s7g ag i d8 5s2 5d 0.000E+00 ( //r2// )= 0.000E+00 a0 0.0000 0.000E+00 0.000 0.000 sqrtdel= 1.0000 0.000E+00 47 -1 0.70 0.50 ag i d9 5s7g ag i d10 5g 0.000E+00 ( //r2// )= 0.000E+00 a0 0.0000 0.000E+00 0.000 0.000 sqrtdel= 1.0000 0.000E+00 47 -1 0.70 0.50 ag i d9 5s7g ag i d10 6g 0.000E+00 ( //r2// )= 0.000E+00 a0 0.0000 0.000E+00 0.000 0.000 sqrtdel= 1.0000 0.000E+00 47 -1 0.70 0.50 ag i d9 5s7g ag i d10 7g -3.165E+00 ( 5s//r2// 4d)=-3.165E+00 a0 -0.9614 6.679E-01-0.449-0.676 sqrtdel= 1.0000 -3.165E+00 47 -1 0.70 0.50 ag i d9 5s7g ag i d10 8g 0.000E+00 ( //r2// )= 0.000E+00 a0 0.0000 0.000E+00 0.000 0.000 sqrtdel= 1.0000 0.000E+00 47 -1 0.70 0.50 ag i d9 5s7g ag i d10 9g 0.000E+00 ( //r2// )= 0.000E+00 a0 0.0000 0.000E+00 0.000 0.000 sqrtdel= 1.0000 0.000E+00 47 -1 0.70 0.50 ag i d9 5s7g ag i d9 5s5g -1.065E+02 ( 7g//r2// 5g)= 1.629E+02 a0 -0.2041 1.802E+02 0.000 0.000 sqrtdel= 1.0000 1.629E+02 47 -1 0.70 0.50 ag i d9 5s7g ag i d9 5s6g -1.185E+03 ( 7g//r2// 6g)= 1.811E+03 a0 -0.6019 2.228E+04 0.000 0.000 sqrtdel= 1.0000 1.811E+03 47 -1 0.70 0.50 ag i d9 5s7g ag i d9 5s7g 4.557E+03 ( 7g//r2// 7g)=-6.967E+03 a0 1.0000 3.296E+05 1.000 1.000 sqrtdel= 1.0000 -6.967E+03 47 -1 0.70 0.50 ag i d9 5s7g ag i d9 5s8g -2.303E+03 ( 7g//r2// 8g)= 3.521E+03 a0 -0.5728 8.419E+04 0.000 0.000 sqrtdel= 1.0000 3.521E+03 47 -1 0.70 0.50 ag i d9 5s7g ag i d9 5s9g -5.239E+02 ( 7g//r2// 9g)= 8.010E+02 a0 -0.1819 4.356E+03 0.000 0.000 sqrtdel= 1.0000 8.010E+02 47 -1 0.70 0.50 ag i d9 5s7g ag i d10 7i 0.000E+00 ( //r2// )= 0.000E+00 a0 0.0000 0.000E+00 0.000 0.000 sqrtdel= 1.0000 0.000E+00 47 -1 0.70 0.50 ag i d9 5s7g ag i d10 8i 0.000E+00 ( //r2// )= 0.000E+00 a0 0.0000 0.000E+00 0.000 0.000 sqrtdel= 1.0000 0.000E+00 47 -1 0.70 0.50 ag i d9 5s7g ag i d10 9i 0.000E+00 ( //r2// )= 0.000E+00 a0 0.0000 0.000E+00 0.000 0.000 sqrtdel= 1.0000 0.000E+00 47 -1 0.70 0.50 ag i d9 5s7g ag i d9 5s7i 2.164E+03 ( 7g//r2// 7i)= 4.377E+03 a0 0.7467 3.275E+04 0.291 0.382 sqrtdel= 1.0000 4.377E+03 47 -1 0.70 0.50 ag i d9 5s7g ag i d9 5s8i -4.739E+03 ( 7g//r2// 8i)=-9.586E+03 a0 -0.9902 1.571E+05-0.819-0.938 sqrtdel= 1.0000 -9.586E+03 47 -1 0.70 0.50 ag i d9 5s7g ag i d9 5s9i 2.134E+02 ( 7g//r2// 9i)= 4.316E+02 a0 0.0631 3.184E+02-0.243-0.399 sqrtdel= 1.0000 4.316E+02 47 -1 0.70 0.50 ag i d9 5s7g ag i d10 9l 0.000E+00 ( //r2// )= 0.000E+00 a0 0.0000 0.000E+00 0.000 0.000 sqrtdel= 1.0000 0.000E+00 47 -1 0.70 0.50 ag i d9 5s7g ag i d9 5s9l 0.000E+00 ( //r2// )= 0.000E+00 a0 0.0000 0.000E+00 0.000 0.000 sqrtdel= 1.0000 0.000E+00 47 -1 0.70 0.50 ag i d9 5s7g ag i d9 5p2 0.000E+00 ( //r2// )= 0.000E+00 a0 0.0000 0.000E+00 0.000 0.000 sqrtdel= 1.0000 0.000E+00 47 -1 0.70 0.50 ag i d9 5s8g ag i d10 5s -2.377E-02 ( 8g//r2// 4d)=-3.811E-02 a0 -1.0000 8.967E-06-0.001-1.000 sqrtdel= 1.0000 -3.811E-02 47 -1 0.70 0.50 ag i d9 5s8g ag i d10 6s 0.000E+00 ( //r2// )= 0.000E+00 a0 0.0000 0.000E+00 0.000 0.000 sqrtdel= 1.0000 0.000E+00 47 -1 0.70 0.50 ag i d9 5s8g ag i d10 7s 0.000E+00 ( //r2// )= 0.000E+00 a0 0.0000 0.000E+00 0.000 0.000 sqrtdel= 1.0000 0.000E+00 47 -1 0.70 0.50 ag i d9 5s8g ag i d10 8s 0.000E+00 ( //r2// )= 0.000E+00 a0 0.0000 0.000E+00 0.000 0.000 sqrtdel= 1.0000 0.000E+00 47 -1 0.70 0.50 ag i d9 5s8g ag i d10 9s 0.000E+00 ( //r2// )= 0.000E+00 a0 0.0000 0.000E+00 0.000 0.000 sqrtdel= 1.0000 0.000E+00 47 -1 0.70 0.50 ag i d9 5s8g ag i d9 5s2 0.000E+00 ( //r2// )= 0.000E+00 a0 0.0000 0.000E+00 0.000 0.000 sqrtdel= 1.0000 0.000E+00 47 -1 0.70 0.50 ag i d9 5s8g ag i d9 5s6s 0.000E+00 ( //r2// )= 0.000E+00 a0 0.0000 0.000E+00 0.000 0.000 sqrtdel= 1.0000 0.000E+00 47 -1 0.70 0.50 ag i d9 5s8g ag i d9 5s7s 0.000E+00 ( //r2// )= 0.000E+00 a0 0.0000 0.000E+00 0.000 0.000 sqrtdel= 1.0000 0.000E+00 47 -1 0.70 0.50 ag i d9 5s8g ag i d9 5s8s 0.000E+00 ( //r2// )= 0.000E+00 a0 0.0000 0.000E+00 0.000 0.000 sqrtdel= 1.0000 0.000E+00 47 -1 0.70 0.50 ag i d9 5s8g ag i d9 5s9s 0.000E+00 ( //r2// )= 0.000E+00 a0 0.0000 0.000E+00 0.000 0.000 sqrtdel= 1.0000 0.000E+00 47 -1 0.70 0.50 ag i d9 5s8g ag i d8 5s2 6s 0.000E+00 ( //r2// )= 0.000E+00 a0 0.0000 0.000E+00 0.000 0.000 sqrtdel= 1.0000 0.000E+00 47 -1 0.70 0.50 ag i d9 5s8g ag i d10 5d 0.000E+00 ( //r2// )= 0.000E+00 a0 0.0000 0.000E+00 0.000 0.000 sqrtdel= 1.0000 0.000E+00 47 -1 0.70 0.50 ag i d9 5s8g ag i d10 6d 0.000E+00 ( //r2// )= 0.000E+00 a0 0.0000 0.000E+00 0.000 0.000 sqrtdel= 1.0000 0.000E+00 47 -1 0.70 0.50 ag i d9 5s8g ag i d10 7d 0.000E+00 ( //r2// )= 0.000E+00 a0 0.0000 0.000E+00 0.000 0.000 sqrtdel= 1.0000 0.000E+00 47 -1 0.70 0.50 ag i d9 5s8g ag i d10 8d 0.000E+00 ( //r2// )= 0.000E+00 a0 0.0000 0.000E+00 0.000 0.000 sqrtdel= 1.0000 0.000E+00 47 -1 0.70 0.50 ag i d9 5s8g ag i d10 9d 0.000E+00 ( //r2// )= 0.000E+00 a0 0.0000 0.000E+00 0.000 0.000 sqrtdel= 1.0000 0.000E+00 47 -1 0.70 0.50 ag i d9 5s8g ag i d9 5s5d 3.046E+01 ( 8g//r2// 5d)= 4.884E+01 a0 0.7509 1.472E+01 0.161 0.941 sqrtdel= 1.0000 4.884E+01 47 -1 0.70 0.50 ag i d9 5s8g ag i d9 5s6d 4.029E+01 ( 8g//r2// 6d)= 6.461E+01 a0 0.2185 2.577E+01-0.049-0.176 sqrtdel= 1.0000 6.461E+01 47 -1 0.70 0.50 ag i d9 5s8g ag i d9 5s7d -1.102E+01 ( 8g//r2// 7d)=-1.767E+01 a0 -0.0171 1.928E+00-0.196-0.475 sqrtdel= 1.0000 -1.767E+01 47 -1 0.70 0.50 ag i d9 5s8g ag i d9 5s8d -3.940E+02 ( 8g//r2// 8d)=-6.318E+02 a0 -0.2124 2.464E+03-0.318-0.592 sqrtdel= 1.0000 -6.318E+02 47 -1 0.70 0.50 ag i d9 5s8g ag i d9 5s9d -4.033E+03 ( 8g//r2// 9d)=-6.467E+03 a0 -0.8330 2.582E+05-0.459-0.650 sqrtdel= 1.0000 -6.467E+03 47 -1 0.70 0.50 ag i d9 5s8g ag i d8 5s2 5d 0.000E+00 ( //r2// )= 0.000E+00 a0 0.0000 0.000E+00 0.000 0.000 sqrtdel= 1.0000 0.000E+00 47 -1 0.70 0.50 ag i d9 5s8g ag i d10 5g 0.000E+00 ( //r2// )= 0.000E+00 a0 0.0000 0.000E+00 0.000 0.000 sqrtdel= 1.0000 0.000E+00 47 -1 0.70 0.50 ag i d9 5s8g ag i d10 6g 0.000E+00 ( //r2// )= 0.000E+00 a0 0.0000 0.000E+00 0.000 0.000 sqrtdel= 1.0000 0.000E+00 47 -1 0.70 0.50 ag i d9 5s8g ag i d10 7g 0.000E+00 ( //r2// )= 0.000E+00 a0 0.0000 0.000E+00 0.000 0.000 sqrtdel= 1.0000 0.000E+00 47 -1 0.70 0.50 ag i d9 5s8g ag i d10 8g -3.165E+00 ( 5s//r2// 4d)=-3.165E+00 a0 -0.9614 6.679E-01-0.449-0.676 sqrtdel= 1.0000 -3.165E+00 47 -1 0.70 0.50 ag i d9 5s8g ag i d10 9g 0.000E+00 ( //r2// )= 0.000E+00 a0 0.0000 0.000E+00 0.000 0.000 sqrtdel= 1.0000 0.000E+00 47 -1 0.70 0.50 ag i d9 5s8g ag i d9 5s5g -4.666E+01 ( 8g//r2// 5g)= 7.134E+01 a0 -0.1181 3.456E+01 0.000 0.000 sqrtdel= 1.0000 7.134E+01 47 -1 0.70 0.50 ag i d9 5s8g ag i d9 5s6g -2.665E+02 ( 8g//r2// 6g)= 4.074E+02 a0 -0.1941 1.127E+03 0.000 0.000 sqrtdel= 1.0000 4.074E+02 47 -1 0.70 0.50 ag i d9 5s8g ag i d9 5s7g -2.303E+03 ( 8g//r2// 7g)= 3.521E+03 a0 -0.5728 8.419E+04 0.000 0.000 sqrtdel= 1.0000 3.521E+03 47 -1 0.70 0.50 ag i d9 5s8g ag i d9 5s8g 8.351E+03 ( 8g//r2// 8g)=-1.277E+04 a0 1.0000 1.107E+06 1.000 1.000 sqrtdel= 1.0000 -1.277E+04 47 -1 0.70 0.50 ag i d9 5s8g ag i d9 5s9g -4.000E+03 ( 8g//r2// 9g)= 6.115E+03 a0 -0.5509 2.539E+05 0.000 0.000 sqrtdel= 1.0000 6.115E+03 47 -1 0.70 0.50 ag i d9 5s8g ag i d10 7i 0.000E+00 ( //r2// )= 0.000E+00 a0 0.0000 0.000E+00 0.000 0.000 sqrtdel= 1.0000 0.000E+00 47 -1 0.70 0.50 ag i d9 5s8g ag i d10 8i 0.000E+00 ( //r2// )= 0.000E+00 a0 0.0000 0.000E+00 0.000 0.000 sqrtdel= 1.0000 0.000E+00 47 -1 0.70 0.50 ag i d9 5s8g ag i d10 9i 0.000E+00 ( //r2// )= 0.000E+00 a0 0.0000 0.000E+00 0.000 0.000 sqrtdel= 1.0000 0.000E+00 47 -1 0.70 0.50 ag i d9 5s8g ag i d9 5s7i -3.153E+02 ( 8g//r2// 7i)=-6.378E+02 a0 -0.1424 6.954E+02 0.026 0.048 sqrtdel= 1.0000 -6.378E+02 47 -1 0.70 0.50 ag i d9 5s8g ag i d9 5s8i 5.288E+03 ( 8g//r2// 8i)= 1.069E+04 a0 0.8532 1.955E+05 0.431 0.535 sqrtdel= 1.0000 1.069E+04 47 -1 0.70 0.50 ag i d9 5s8g ag i d9 5s9i -7.963E+03 ( 8g//r2// 9i)=-1.611E+04 a0 -0.9657 4.435E+05-0.754-0.911 sqrtdel= 1.0000 -1.611E+04 47 -1 0.70 0.50 ag i d9 5s8g ag i d10 9l 0.000E+00 ( //r2// )= 0.000E+00 a0 0.0000 0.000E+00 0.000 0.000 sqrtdel= 1.0000 0.000E+00 47 -1 0.70 0.50 ag i d9 5s8g ag i d9 5s9l 0.000E+00 ( //r2// )= 0.000E+00 a0 0.0000 0.000E+00 0.000 0.000 sqrtdel= 1.0000 0.000E+00 47 -1 0.70 0.50 ag i d9 5s8g ag i d9 5p2 0.000E+00 ( //r2// )= 0.000E+00 a0 0.0000 0.000E+00 0.000 0.000 sqrtdel= 1.0000 0.000E+00 47 -1 0.70 0.50 ag i d9 5s9g ag i d10 5s -2.096E-02 ( 9g//r2// 4d)=-3.362E-02 a0 -1.0000 6.975E-06-0.001-1.000 sqrtdel= 1.0000 -3.362E-02 47 -1 0.70 0.50 ag i d9 5s9g ag i d10 6s 0.000E+00 ( //r2// )= 0.000E+00 a0 0.0000 0.000E+00 0.000 0.000 sqrtdel= 1.0000 0.000E+00 47 -1 0.70 0.50 ag i d9 5s9g ag i d10 7s 0.000E+00 ( //r2// )= 0.000E+00 a0 0.0000 0.000E+00 0.000 0.000 sqrtdel= 1.0000 0.000E+00 47 -1 0.70 0.50 ag i d9 5s9g ag i d10 8s 0.000E+00 ( //r2// )= 0.000E+00 a0 0.0000 0.000E+00 0.000 0.000 sqrtdel= 1.0000 0.000E+00 47 -1 0.70 0.50 ag i d9 5s9g ag i d10 9s 0.000E+00 ( //r2// )= 0.000E+00 a0 0.0000 0.000E+00 0.000 0.000 sqrtdel= 1.0000 0.000E+00 47 -1 0.70 0.50 ag i d9 5s9g ag i d9 5s2 0.000E+00 ( //r2// )= 0.000E+00 a0 0.0000 0.000E+00 0.000 0.000 sqrtdel= 1.0000 0.000E+00 47 -1 0.70 0.50 ag i d9 5s9g ag i d9 5s6s 0.000E+00 ( //r2// )= 0.000E+00 a0 0.0000 0.000E+00 0.000 0.000 sqrtdel= 1.0000 0.000E+00 47 -1 0.70 0.50 ag i d9 5s9g ag i d9 5s7s 0.000E+00 ( //r2// )= 0.000E+00 a0 0.0000 0.000E+00 0.000 0.000 sqrtdel= 1.0000 0.000E+00 47 -1 0.70 0.50 ag i d9 5s9g ag i d9 5s8s 0.000E+00 ( //r2// )= 0.000E+00 a0 0.0000 0.000E+00 0.000 0.000 sqrtdel= 1.0000 0.000E+00 47 -1 0.70 0.50 ag i d9 5s9g ag i d9 5s9s 0.000E+00 ( //r2// )= 0.000E+00 a0 0.0000 0.000E+00 0.000 0.000 sqrtdel= 1.0000 0.000E+00 47 -1 0.70 0.50 ag i d9 5s9g ag i d8 5s2 6s 0.000E+00 ( //r2// )= 0.000E+00 a0 0.0000 0.000E+00 0.000 0.000 sqrtdel= 1.0000 0.000E+00 47 -1 0.70 0.50 ag i d9 5s9g ag i d10 5d 0.000E+00 ( //r2// )= 0.000E+00 a0 0.0000 0.000E+00 0.000 0.000 sqrtdel= 1.0000 0.000E+00 47 -1 0.70 0.50 ag i d9 5s9g ag i d10 6d 0.000E+00 ( //r2// )= 0.000E+00 a0 0.0000 0.000E+00 0.000 0.000 sqrtdel= 1.0000 0.000E+00 47 -1 0.70 0.50 ag i d9 5s9g ag i d10 7d 0.000E+00 ( //r2// )= 0.000E+00 a0 0.0000 0.000E+00 0.000 0.000 sqrtdel= 1.0000 0.000E+00 47 -1 0.70 0.50 ag i d9 5s9g ag i d10 8d 0.000E+00 ( //r2// )= 0.000E+00 a0 0.0000 0.000E+00 0.000 0.000 sqrtdel= 1.0000 0.000E+00 47 -1 0.70 0.50 ag i d9 5s9g ag i d10 9d 0.000E+00 ( //r2// )= 0.000E+00 a0 0.0000 0.000E+00 0.000 0.000 sqrtdel= 1.0000 0.000E+00 47 -1 0.70 0.50 ag i d9 5s9g ag i d9 5s5d 2.379E+01 ( 9g//r2// 5d)= 3.815E+01 a0 0.7141 8.985E+00 0.133 0.929 sqrtdel= 1.0000 3.815E+01 47 -1 0.70 0.50 ag i d9 5s9g ag i d9 5s6d 3.356E+01 ( 9g//r2// 6d)= 5.381E+01 a0 0.2237 1.787E+01-0.026-0.115 sqrtdel= 1.0000 5.381E+01 47 -1 0.70 0.50 ag i d9 5s9g ag i d9 5s7d 1.397E+01 ( 9g//r2// 7d)= 2.240E+01 a0 0.0271 3.098E+00-0.132-0.396 sqrtdel= 1.0000 2.240E+01 47 -1 0.70 0.50 ag i d9 5s9g ag i d9 5s8d -1.166E+02 ( 9g//r2// 8d)=-1.869E+02 a0 -0.0821 2.157E+02-0.210-0.485 sqrtdel= 1.0000 -1.869E+02 47 -1 0.70 0.50 ag i d9 5s9g ag i d9 5s9d -7.845E+02 ( 9g//r2// 9d)=-1.258E+03 a0 -0.2240 9.768E+03-0.281-0.525 sqrtdel= 1.0000 -1.258E+03 47 -1 0.70 0.50 ag i d9 5s9g ag i d8 5s2 5d 0.000E+00 ( //r2// )= 0.000E+00 a0 0.0000 0.000E+00 0.000 0.000 sqrtdel= 1.0000 0.000E+00 47 -1 0.70 0.50 ag i d9 5s9g ag i d10 5g 0.000E+00 ( //r2// )= 0.000E+00 a0 0.0000 0.000E+00 0.000 0.000 sqrtdel= 1.0000 0.000E+00 47 -1 0.70 0.50 ag i d9 5s9g ag i d10 6g 0.000E+00 ( //r2// )= 0.000E+00 a0 0.0000 0.000E+00 0.000 0.000 sqrtdel= 1.0000 0.000E+00 47 -1 0.70 0.50 ag i d9 5s9g ag i d10 7g 0.000E+00 ( //r2// )= 0.000E+00 a0 0.0000 0.000E+00 0.000 0.000 sqrtdel= 1.0000 0.000E+00 47 -1 0.70 0.50 ag i d9 5s9g ag i d10 8g 0.000E+00 ( //r2// )= 0.000E+00 a0 0.0000 0.000E+00 0.000 0.000 sqrtdel= 1.0000 0.000E+00 47 -1 0.70 0.50 ag i d9 5s9g ag i d10 9g -3.165E+00 ( 5s//r2// 4d)=-3.165E+00 a0 -0.9614 6.679E-01-0.449-0.676 sqrtdel= 1.0000 -3.165E+00 47 -1 0.70 0.50 ag i d9 5s9g ag i d9 5s5g -2.705E+01 ( 9g//r2// 5g)= 4.136E+01 a0 -0.0850 1.161E+01 0.000 0.000 sqrtdel= 1.0000 4.136E+01 47 -1 0.70 0.50 ag i d9 5s9g ag i d9 5s6g -1.180E+02 ( 9g//r2// 6g)= 1.804E+02 a0 -0.1114 2.210E+02 0.000 0.000 sqrtdel= 1.0000 1.804E+02 47 -1 0.70 0.50 ag i d9 5s9g ag i d9 5s7g -5.239E+02 ( 9g//r2// 7g)= 8.010E+02 a0 -0.1819 4.356E+03 0.000 0.000 sqrtdel= 1.0000 8.010E+02 47 -1 0.70 0.50 ag i d9 5s9g ag i d9 5s8g -4.000E+03 ( 9g//r2// 8g)= 6.115E+03 a0 -0.5509 2.539E+05 0.000 0.000 sqrtdel= 1.0000 6.115E+03 47 -1 0.70 0.50 ag i d9 5s9g ag i d9 5s9g 1.401E+04 ( 9g//r2// 9g)=-2.142E+04 a0 1.0000 3.116E+06 1.000 1.000 sqrtdel= 1.0000 -2.142E+04 47 -1 0.70 0.50 ag i d9 5s9g ag i d10 7i 0.000E+00 ( //r2// )= 0.000E+00 a0 0.0000 0.000E+00 0.000 0.000 sqrtdel= 1.0000 0.000E+00 47 -1 0.70 0.50 ag i d9 5s9g ag i d10 8i 0.000E+00 ( //r2// )= 0.000E+00 a0 0.0000 0.000E+00 0.000 0.000 sqrtdel= 1.0000 0.000E+00 47 -1 0.70 0.50 ag i d9 5s9g ag i d10 9i 0.000E+00 ( //r2// )= 0.000E+00 a0 0.0000 0.000E+00 0.000 0.000 sqrtdel= 1.0000 0.000E+00 47 -1 0.70 0.50 ag i d9 5s9g ag i d9 5s7i -6.951E+01 ( 9g//r2// 7i)=-1.406E+02 a0 -0.0419 3.378E+01 0.012 0.027 sqrtdel= 1.0000 -1.406E+02 47 -1 0.70 0.50 ag i d9 5s9g ag i d9 5s8i -8.716E+02 ( 9g//r2// 8i)=-1.763E+03 a0 -0.1779 5.312E+03 0.042 0.069 sqrtdel= 1.0000 -1.763E+03 47 -1 0.70 0.50 ag i d9 5s9g ag i d9 5s9i 1.017E+04 ( 9g//r2// 9i)= 2.056E+04 a0 0.9067 7.228E+05 0.531 0.639 sqrtdel= 1.0000 2.056E+04 47 -1 0.70 0.50 ag i d9 5s9g ag i d10 9l 0.000E+00 ( //r2// )= 0.000E+00 a0 0.0000 0.000E+00 0.000 0.000 sqrtdel= 1.0000 0.000E+00 47 -1 0.70 0.50 ag i d9 5s9g ag i d9 5s9l 0.000E+00 ( //r2// )= 0.000E+00 a0 0.0000 0.000E+00 0.000 0.000 sqrtdel= 1.0000 0.000E+00 47 -1 0.70 0.50 ag i d9 5s9g ag i d9 5p2 0.000E+00 ( //r2// )= 0.000E+00 a0 0.0000 0.000E+00 0.000 0.000 sqrtdel= 1.0000 0.000E+00 47 -1 0.70 0.50 ag i d10 7i ag i d10 5s 0.000E+00 ( //r2// )= 0.000E+00 a0 0.0000 0.000E+00 0.000 0.000 sqrtdel= 1.0000 0.000E+00 47 -1 0.70 0.50 ag i d10 7i ag i d10 6s 0.000E+00 ( //r2// )= 0.000E+00 a0 0.0000 0.000E+00 0.000 0.000 sqrtdel= 1.0000 0.000E+00 47 -1 0.70 0.50 ag i d10 7i ag i d10 7s 0.000E+00 ( //r2// )= 0.000E+00 a0 0.0000 0.000E+00 0.000 0.000 sqrtdel= 1.0000 0.000E+00 47 -1 0.70 0.50 ag i d10 7i ag i d10 8s 0.000E+00 ( //r2// )= 0.000E+00 a0 0.0000 0.000E+00 0.000 0.000 sqrtdel= 1.0000 0.000E+00 47 -1 0.70 0.50 ag i d10 7i ag i d10 9s 0.000E+00 ( //r2// )= 0.000E+00 a0 0.0000 0.000E+00 0.000 0.000 sqrtdel= 1.0000 0.000E+00 47 -1 0.70 0.50 ag i d10 7i ag i d9 5s2 0.000E+00 ( //r2// )= 0.000E+00 a0 0.0000 0.000E+00 0.000 0.000 sqrtdel= 1.0000 0.000E+00 47 -1 0.70 0.50 ag i d10 7i ag i d9 5s6s 0.000E+00 ( //r2// )= 0.000E+00 a0 0.0000 0.000E+00 0.000 0.000 sqrtdel= 1.0000 0.000E+00 47 -1 0.70 0.50 ag i d10 7i ag i d9 5s7s 0.000E+00 ( //r2// )= 0.000E+00 a0 0.0000 0.000E+00 0.000 0.000 sqrtdel= 1.0000 0.000E+00 47 -1 0.70 0.50 ag i d10 7i ag i d9 5s8s 0.000E+00 ( //r2// )= 0.000E+00 a0 0.0000 0.000E+00 0.000 0.000 sqrtdel= 1.0000 0.000E+00 47 -1 0.70 0.50 ag i d10 7i ag i d9 5s9s 0.000E+00 ( //r2// )= 0.000E+00 a0 0.0000 0.000E+00 0.000 0.000 sqrtdel= 1.0000 0.000E+00 47 -1 0.70 0.50 ag i d10 7i ag i d8 5s2 6s 0.000E+00 ( //r2// )= 0.000E+00 a0 0.0000 0.000E+00 0.000 0.000 sqrtdel= 1.0000 0.000E+00 47 -1 0.70 0.50 ag i d10 7i ag i d10 5d 0.000E+00 ( //r2// )= 0.000E+00 a0 0.0000 0.000E+00 0.000 0.000 sqrtdel= 1.0000 0.000E+00 47 -1 0.70 0.50 ag i d10 7i ag i d10 6d 0.000E+00 ( //r2// )= 0.000E+00 a0 0.0000 0.000E+00 0.000 0.000 sqrtdel= 1.0000 0.000E+00 47 -1 0.70 0.50 ag i d10 7i ag i d10 7d 0.000E+00 ( //r2// )= 0.000E+00 a0 0.0000 0.000E+00 0.000 0.000 sqrtdel= 1.0000 0.000E+00 47 -1 0.70 0.50 ag i d10 7i ag i d10 8d 0.000E+00 ( //r2// )= 0.000E+00 a0 0.0000 0.000E+00 0.000 0.000 sqrtdel= 1.0000 0.000E+00 47 -1 0.70 0.50 ag i d10 7i ag i d10 9d 0.000E+00 ( //r2// )= 0.000E+00 a0 0.0000 0.000E+00 0.000 0.000 sqrtdel= 1.0000 0.000E+00 47 -1 0.70 0.50 ag i d10 7i ag i d9 5s5d 0.000E+00 ( //r2// )= 0.000E+00 a0 0.0000 0.000E+00 0.000 0.000 sqrtdel= 1.0000 0.000E+00 47 -1 0.70 0.50 ag i d10 7i ag i d9 5s6d 0.000E+00 ( //r2// )= 0.000E+00 a0 0.0000 0.000E+00 0.000 0.000 sqrtdel= 1.0000 0.000E+00 47 -1 0.70 0.50 ag i d10 7i ag i d9 5s7d 0.000E+00 ( //r2// )= 0.000E+00 a0 0.0000 0.000E+00 0.000 0.000 sqrtdel= 1.0000 0.000E+00 47 -1 0.70 0.50 ag i d10 7i ag i d9 5s8d 0.000E+00 ( //r2// )= 0.000E+00 a0 0.0000 0.000E+00 0.000 0.000 sqrtdel= 1.0000 0.000E+00 47 -1 0.70 0.50 ag i d10 7i ag i d9 5s9d 0.000E+00 ( //r2// )= 0.000E+00 a0 0.0000 0.000E+00 0.000 0.000 sqrtdel= 1.0000 0.000E+00 47 -1 0.70 0.50 ag i d10 7i ag i d8 5s2 5d 0.000E+00 ( //r2// )= 0.000E+00 a0 0.0000 0.000E+00 0.000 0.000 sqrtdel= 1.0000 0.000E+00 47 -1 0.70 0.50 ag i d10 7i ag i d10 5g 7.842E+02 ( 7i//r2// 5g)= 1.586E+03 a0 1.0000 4.301E+03 0.507 1.000 sqrtdel= 1.0000 1.586E+03 47 -1 0.70 0.50 ag i d10 7i ag i d10 6g -2.370E+03 ( 7i//r2// 6g)=-4.794E+03 a0 -0.9808 3.929E+04-0.811-0.904 sqrtdel= 1.0000 -4.794E+03 47 -1 0.70 0.50 ag i d10 7i ag i d10 7g 2.164E+03 ( 7i//r2// 7g)= 4.377E+03 a0 0.7466 3.274E+04 0.291 0.382 sqrtdel= 1.0000 4.377E+03 47 -1 0.70 0.50 ag i d10 7i ag i d10 8g -3.152E+02 ( 7i//r2// 8g)=-6.375E+02 a0 -0.1423 6.948E+02 0.026 0.048 sqrtdel= 1.0000 -6.375E+02 47 -1 0.70 0.50 ag i d10 7i ag i d10 9g -6.948E+01 ( 7i//r2// 9g)=-1.405E+02 a0 -0.0419 3.375E+01 0.012 0.027 sqrtdel= 1.0000 -1.405E+02 47 -1 0.70 0.50 ag i d10 7i ag i d9 5s5g 0.000E+00 ( //r2// )= 0.000E+00 a0 0.0000 0.000E+00 0.000 0.000 sqrtdel= 1.0000 0.000E+00 47 -1 0.70 0.50 ag i d10 7i ag i d9 5s6g 0.000E+00 ( //r2// )= 0.000E+00 a0 0.0000 0.000E+00 0.000 0.000 sqrtdel= 1.0000 0.000E+00 47 -1 0.70 0.50 ag i d10 7i ag i d9 5s7g 0.000E+00 ( //r2// )= 0.000E+00 a0 0.0000 0.000E+00 0.000 0.000 sqrtdel= 1.0000 0.000E+00 47 -1 0.70 0.50 ag i d10 7i ag i d9 5s8g 0.000E+00 ( //r2// )= 0.000E+00 a0 0.0000 0.000E+00 0.000 0.000 sqrtdel= 1.0000 0.000E+00 47 -1 0.70 0.50 ag i d10 7i ag i d9 5s9g 0.000E+00 ( //r2// )= 0.000E+00 a0 0.0000 0.000E+00 0.000 0.000 sqrtdel= 1.0000 0.000E+00 47 -1 0.70 0.50 ag i d10 7i ag i d10 7i 2.940E+03 ( 7i//r2// 7i)=-5.348E+03 a0 1.0000 6.045E+04 1.000 1.000 sqrtdel= 1.0000 -5.348E+03 47 -1 0.70 0.50 ag i d10 7i ag i d10 8i -1.510E+03 ( 7i//r2// 8i)= 2.746E+03 a0 -0.5653 1.594E+04 0.000 0.000 sqrtdel= 1.0000 2.746E+03 47 -1 0.70 0.50 ag i d10 7i ag i d10 9i -2.801E+02 ( 7i//r2// 9i)= 5.096E+02 a0 -0.1471 5.487E+02 0.000 0.000 sqrtdel= 1.0000 5.096E+02 47 -1 0.70 0.50 ag i d10 7i ag i d9 5s7i -3.165E+00 ( 4d//r2// 5s)=-3.165E+00 a0 -0.9614 6.679E-01-0.449-0.676 sqrtdel= 1.0000 -3.165E+00 47 -1 0.70 0.50 ag i d10 7i ag i d9 5s8i 0.000E+00 ( //r2// )= 0.000E+00 a0 0.0000 0.000E+00 0.000 0.000 sqrtdel= 1.0000 0.000E+00 47 -1 0.70 0.50 ag i d10 7i ag i d9 5s9i 0.000E+00 ( //r2// )= 0.000E+00 a0 0.0000 0.000E+00 0.000 0.000 sqrtdel= 1.0000 0.000E+00 47 -1 0.70 0.50 ag i d10 7i ag i d10 9l 1.293E+03 ( 7i//r2//10l)= 3.060E+03 a0 0.6607 6.558E+03 0.424 0.885 sqrtdel= 1.0000 3.060E+03 47 -1 0.70 0.50 ag i d10 7i ag i d9 5s9l 0.000E+00 ( //r2// )= 0.000E+00 a0 0.0000 0.000E+00 0.000 0.000 sqrtdel= 1.0000 0.000E+00 47 -1 0.70 0.50 ag i d10 7i ag i d9 5p2 0.000E+00 ( //r2// )= 0.000E+00 a0 0.0000 0.000E+00 0.000 0.000 sqrtdel= 1.0000 0.000E+00 47 -1 0.70 0.50 ag i d10 8i ag i d10 5s 0.000E+00 ( //r2// )= 0.000E+00 a0 0.0000 0.000E+00 0.000 0.000 sqrtdel= 1.0000 0.000E+00 47 -1 0.70 0.50 ag i d10 8i ag i d10 6s 0.000E+00 ( //r2// )= 0.000E+00 a0 0.0000 0.000E+00 0.000 0.000 sqrtdel= 1.0000 0.000E+00 47 -1 0.70 0.50 ag i d10 8i ag i d10 7s 0.000E+00 ( //r2// )= 0.000E+00 a0 0.0000 0.000E+00 0.000 0.000 sqrtdel= 1.0000 0.000E+00 47 -1 0.70 0.50 ag i d10 8i ag i d10 8s 0.000E+00 ( //r2// )= 0.000E+00 a0 0.0000 0.000E+00 0.000 0.000 sqrtdel= 1.0000 0.000E+00 47 -1 0.70 0.50 ag i d10 8i ag i d10 9s 0.000E+00 ( //r2// )= 0.000E+00 a0 0.0000 0.000E+00 0.000 0.000 sqrtdel= 1.0000 0.000E+00 47 -1 0.70 0.50 ag i d10 8i ag i d9 5s2 0.000E+00 ( //r2// )= 0.000E+00 a0 0.0000 0.000E+00 0.000 0.000 sqrtdel= 1.0000 0.000E+00 47 -1 0.70 0.50 ag i d10 8i ag i d9 5s6s 0.000E+00 ( //r2// )= 0.000E+00 a0 0.0000 0.000E+00 0.000 0.000 sqrtdel= 1.0000 0.000E+00 47 -1 0.70 0.50 ag i d10 8i ag i d9 5s7s 0.000E+00 ( //r2// )= 0.000E+00 a0 0.0000 0.000E+00 0.000 0.000 sqrtdel= 1.0000 0.000E+00 47 -1 0.70 0.50 ag i d10 8i ag i d9 5s8s 0.000E+00 ( //r2// )= 0.000E+00 a0 0.0000 0.000E+00 0.000 0.000 sqrtdel= 1.0000 0.000E+00 47 -1 0.70 0.50 ag i d10 8i ag i d9 5s9s 0.000E+00 ( //r2// )= 0.000E+00 a0 0.0000 0.000E+00 0.000 0.000 sqrtdel= 1.0000 0.000E+00 47 -1 0.70 0.50 ag i d10 8i ag i d8 5s2 6s 0.000E+00 ( //r2// )= 0.000E+00 a0 0.0000 0.000E+00 0.000 0.000 sqrtdel= 1.0000 0.000E+00 47 -1 0.70 0.50 ag i d10 8i ag i d10 5d 0.000E+00 ( //r2// )= 0.000E+00 a0 0.0000 0.000E+00 0.000 0.000 sqrtdel= 1.0000 0.000E+00 47 -1 0.70 0.50 ag i d10 8i ag i d10 6d 0.000E+00 ( //r2// )= 0.000E+00 a0 0.0000 0.000E+00 0.000 0.000 sqrtdel= 1.0000 0.000E+00 47 -1 0.70 0.50 ag i d10 8i ag i d10 7d 0.000E+00 ( //r2// )= 0.000E+00 a0 0.0000 0.000E+00 0.000 0.000 sqrtdel= 1.0000 0.000E+00 47 -1 0.70 0.50 ag i d10 8i ag i d10 8d 0.000E+00 ( //r2// )= 0.000E+00 a0 0.0000 0.000E+00 0.000 0.000 sqrtdel= 1.0000 0.000E+00 47 -1 0.70 0.50 ag i d10 8i ag i d10 9d 0.000E+00 ( //r2// )= 0.000E+00 a0 0.0000 0.000E+00 0.000 0.000 sqrtdel= 1.0000 0.000E+00 47 -1 0.70 0.50 ag i d10 8i ag i d9 5s5d 0.000E+00 ( //r2// )= 0.000E+00 a0 0.0000 0.000E+00 0.000 0.000 sqrtdel= 1.0000 0.000E+00 47 -1 0.70 0.50 ag i d10 8i ag i d9 5s6d 0.000E+00 ( //r2// )= 0.000E+00 a0 0.0000 0.000E+00 0.000 0.000 sqrtdel= 1.0000 0.000E+00 47 -1 0.70 0.50 ag i d10 8i ag i d9 5s7d 0.000E+00 ( //r2// )= 0.000E+00 a0 0.0000 0.000E+00 0.000 0.000 sqrtdel= 1.0000 0.000E+00 47 -1 0.70 0.50 ag i d10 8i ag i d9 5s8d 0.000E+00 ( //r2// )= 0.000E+00 a0 0.0000 0.000E+00 0.000 0.000 sqrtdel= 1.0000 0.000E+00 47 -1 0.70 0.50 ag i d10 8i ag i d9 5s9d 0.000E+00 ( //r2// )= 0.000E+00 a0 0.0000 0.000E+00 0.000 0.000 sqrtdel= 1.0000 0.000E+00 47 -1 0.70 0.50 ag i d10 8i ag i d8 5s2 5d 0.000E+00 ( //r2// )= 0.000E+00 a0 0.0000 0.000E+00 0.000 0.000 sqrtdel= 1.0000 0.000E+00 47 -1 0.70 0.50 ag i d10 8i ag i d10 5g 3.955E+02 ( 8i//r2// 5g)= 7.998E+02 a0 0.7567 1.094E+03 0.373 0.933 sqrtdel= 1.0000 7.998E+02 47 -1 0.70 0.50 ag i d10 8i ag i d10 6g 5.632E+02 ( 8i//r2// 6g)= 1.139E+03 a0 0.3416 2.218E+03-0.046-0.086 sqrtdel= 1.0000 1.139E+03 47 -1 0.70 0.50 ag i d10 8i ag i d10 7g -4.740E+03 ( 8i//r2// 7g)=-9.586E+03 a0 -0.9902 1.571E+05-0.819-0.938 sqrtdel= 1.0000 -9.586E+03 47 -1 0.70 0.50 ag i d10 8i ag i d10 8g 5.287E+03 ( 8i//r2// 8g)= 1.069E+04 a0 0.8532 1.955E+05 0.431 0.534 sqrtdel= 1.0000 1.069E+04 47 -1 0.70 0.50 ag i d10 8i ag i d10 9g -8.711E+02 ( 8i//r2// 9g)=-1.762E+03 a0 -0.1779 5.306E+03 0.042 0.069 sqrtdel= 1.0000 -1.762E+03 47 -1 0.70 0.50 ag i d10 8i ag i d9 5s5g 0.000E+00 ( //r2// )= 0.000E+00 a0 0.0000 0.000E+00 0.000 0.000 sqrtdel= 1.0000 0.000E+00 47 -1 0.70 0.50 ag i d10 8i ag i d9 5s6g 0.000E+00 ( //r2// )= 0.000E+00 a0 0.0000 0.000E+00 0.000 0.000 sqrtdel= 1.0000 0.000E+00 47 -1 0.70 0.50 ag i d10 8i ag i d9 5s7g 0.000E+00 ( //r2// )= 0.000E+00 a0 0.0000 0.000E+00 0.000 0.000 sqrtdel= 1.0000 0.000E+00 47 -1 0.70 0.50 ag i d10 8i ag i d9 5s8g 0.000E+00 ( //r2// )= 0.000E+00 a0 0.0000 0.000E+00 0.000 0.000 sqrtdel= 1.0000 0.000E+00 47 -1 0.70 0.50 ag i d10 8i ag i d9 5s9g 0.000E+00 ( //r2// )= 0.000E+00 a0 0.0000 0.000E+00 0.000 0.000 sqrtdel= 1.0000 0.000E+00 47 -1 0.70 0.50 ag i d10 8i ag i d10 7i -1.510E+03 ( 8i//r2// 7i)= 2.746E+03 a0 -0.5653 1.594E+04 0.000 0.000 sqrtdel= 1.0000 2.746E+03 47 -1 0.70 0.50 ag i d10 8i ag i d10 8i 6.240E+03 ( 8i//r2// 8i)=-1.135E+04 a0 1.0000 2.723E+05 1.000 1.000 sqrtdel= 1.0000 -1.135E+04 47 -1 0.70 0.50 ag i d10 8i ag i d10 9i -3.159E+03 ( 8i//r2// 9i)= 5.747E+03 a0 -0.5679 6.979E+04 0.000 0.000 sqrtdel= 1.0000 5.747E+03 47 -1 0.70 0.50 ag i d10 8i ag i d9 5s7i 0.000E+00 ( //r2// )= 0.000E+00 a0 0.0000 0.000E+00 0.000 0.000 sqrtdel= 1.0000 0.000E+00 47 -1 0.70 0.50 ag i d10 8i ag i d9 5s8i -3.165E+00 ( 4d//r2// 5s)=-3.165E+00 a0 -0.9614 6.679E-01-0.449-0.676 sqrtdel= 1.0000 -3.165E+00 47 -1 0.70 0.50 ag i d10 8i ag i d9 5s9i 0.000E+00 ( //r2// )= 0.000E+00 a0 0.0000 0.000E+00 0.000 0.000 sqrtdel= 1.0000 0.000E+00 47 -1 0.70 0.50 ag i d10 8i ag i d10 9l 2.340E+03 ( 8i//r2//10l)= 5.538E+03 a0 0.4783 2.148E+04 0.095 0.166 sqrtdel= 1.0000 5.538E+03 47 -1 0.70 0.50 ag i d10 8i ag i d9 5s9l 0.000E+00 ( //r2// )= 0.000E+00 a0 0.0000 0.000E+00 0.000 0.000 sqrtdel= 1.0000 0.000E+00 47 -1 0.70 0.50 ag i d10 8i ag i d9 5p2 0.000E+00 ( //r2// )= 0.000E+00 a0 0.0000 0.000E+00 0.000 0.000 sqrtdel= 1.0000 0.000E+00 47 -1 0.70 0.50 ag i d10 9i ag i d10 5s 0.000E+00 ( //r2// )= 0.000E+00 a0 0.0000 0.000E+00 0.000 0.000 sqrtdel= 1.0000 0.000E+00 47 -1 0.70 0.50 ag i d10 9i ag i d10 6s 0.000E+00 ( //r2// )= 0.000E+00 a0 0.0000 0.000E+00 0.000 0.000 sqrtdel= 1.0000 0.000E+00 47 -1 0.70 0.50 ag i d10 9i ag i d10 7s 0.000E+00 ( //r2// )= 0.000E+00 a0 0.0000 0.000E+00 0.000 0.000 sqrtdel= 1.0000 0.000E+00 47 -1 0.70 0.50 ag i d10 9i ag i d10 8s 0.000E+00 ( //r2// )= 0.000E+00 a0 0.0000 0.000E+00 0.000 0.000 sqrtdel= 1.0000 0.000E+00 47 -1 0.70 0.50 ag i d10 9i ag i d10 9s 0.000E+00 ( //r2// )= 0.000E+00 a0 0.0000 0.000E+00 0.000 0.000 sqrtdel= 1.0000 0.000E+00 47 -1 0.70 0.50 ag i d10 9i ag i d9 5s2 0.000E+00 ( //r2// )= 0.000E+00 a0 0.0000 0.000E+00 0.000 0.000 sqrtdel= 1.0000 0.000E+00 47 -1 0.70 0.50 ag i d10 9i ag i d9 5s6s 0.000E+00 ( //r2// )= 0.000E+00 a0 0.0000 0.000E+00 0.000 0.000 sqrtdel= 1.0000 0.000E+00 47 -1 0.70 0.50 ag i d10 9i ag i d9 5s7s 0.000E+00 ( //r2// )= 0.000E+00 a0 0.0000 0.000E+00 0.000 0.000 sqrtdel= 1.0000 0.000E+00 47 -1 0.70 0.50 ag i d10 9i ag i d9 5s8s 0.000E+00 ( //r2// )= 0.000E+00 a0 0.0000 0.000E+00 0.000 0.000 sqrtdel= 1.0000 0.000E+00 47 -1 0.70 0.50 ag i d10 9i ag i d9 5s9s 0.000E+00 ( //r2// )= 0.000E+00 a0 0.0000 0.000E+00 0.000 0.000 sqrtdel= 1.0000 0.000E+00 47 -1 0.70 0.50 ag i d10 9i ag i d8 5s2 6s 0.000E+00 ( //r2// )= 0.000E+00 a0 0.0000 0.000E+00 0.000 0.000 sqrtdel= 1.0000 0.000E+00 47 -1 0.70 0.50 ag i d10 9i ag i d10 5d 0.000E+00 ( //r2// )= 0.000E+00 a0 0.0000 0.000E+00 0.000 0.000 sqrtdel= 1.0000 0.000E+00 47 -1 0.70 0.50 ag i d10 9i ag i d10 6d 0.000E+00 ( //r2// )= 0.000E+00 a0 0.0000 0.000E+00 0.000 0.000 sqrtdel= 1.0000 0.000E+00 47 -1 0.70 0.50 ag i d10 9i ag i d10 7d 0.000E+00 ( //r2// )= 0.000E+00 a0 0.0000 0.000E+00 0.000 0.000 sqrtdel= 1.0000 0.000E+00 47 -1 0.70 0.50 ag i d10 9i ag i d10 8d 0.000E+00 ( //r2// )= 0.000E+00 a0 0.0000 0.000E+00 0.000 0.000 sqrtdel= 1.0000 0.000E+00 47 -1 0.70 0.50 ag i d10 9i ag i d10 9d 0.000E+00 ( //r2// )= 0.000E+00 a0 0.0000 0.000E+00 0.000 0.000 sqrtdel= 1.0000 0.000E+00 47 -1 0.70 0.50 ag i d10 9i ag i d9 5s5d 0.000E+00 ( //r2// )= 0.000E+00 a0 0.0000 0.000E+00 0.000 0.000 sqrtdel= 1.0000 0.000E+00 47 -1 0.70 0.50 ag i d10 9i ag i d9 5s6d 0.000E+00 ( //r2// )= 0.000E+00 a0 0.0000 0.000E+00 0.000 0.000 sqrtdel= 1.0000 0.000E+00 47 -1 0.70 0.50 ag i d10 9i ag i d9 5s7d 0.000E+00 ( //r2// )= 0.000E+00 a0 0.0000 0.000E+00 0.000 0.000 sqrtdel= 1.0000 0.000E+00 47 -1 0.70 0.50 ag i d10 9i ag i d9 5s8d 0.000E+00 ( //r2// )= 0.000E+00 a0 0.0000 0.000E+00 0.000 0.000 sqrtdel= 1.0000 0.000E+00 47 -1 0.70 0.50 ag i d10 9i ag i d9 5s9d 0.000E+00 ( //r2// )= 0.000E+00 a0 0.0000 0.000E+00 0.000 0.000 sqrtdel= 1.0000 0.000E+00 47 -1 0.70 0.50 ag i d10 9i ag i d8 5s2 5d 0.000E+00 ( //r2// )= 0.000E+00 a0 0.0000 0.000E+00 0.000 0.000 sqrtdel= 1.0000 0.000E+00 47 -1 0.70 0.50 ag i d10 9i ag i d10 5g 2.426E+02 ( 9i//r2// 5g)= 4.906E+02 a0 0.5999 4.114E+02 0.284 0.868 sqrtdel= 1.0000 4.906E+02 47 -1 0.70 0.50 ag i d10 9i ag i d10 6g 4.409E+02 ( 9i//r2// 6g)= 8.918E+02 a0 0.3691 1.360E+03 0.074 0.183 sqrtdel= 1.0000 8.918E+02 47 -1 0.70 0.50 ag i d10 9i ag i d10 7g 2.137E+02 ( 9i//r2// 7g)= 4.322E+02 a0 0.0631 3.193E+02-0.243-0.399 sqrtdel= 1.0000 4.322E+02 47 -1 0.70 0.50 ag i d10 9i ag i d10 8g -7.964E+03 ( 9i//r2// 8g)=-1.611E+04 a0 -0.9657 4.436E+05-0.754-0.911 sqrtdel= 1.0000 -1.611E+04 47 -1 0.70 0.50 ag i d10 9i ag i d10 9g 1.017E+04 ( 9i//r2// 9g)= 2.056E+04 a0 0.9066 7.227E+05 0.531 0.639 sqrtdel= 1.0000 2.056E+04 47 -1 0.70 0.50 ag i d10 9i ag i d9 5s5g 0.000E+00 ( //r2// )= 0.000E+00 a0 0.0000 0.000E+00 0.000 0.000 sqrtdel= 1.0000 0.000E+00 47 -1 0.70 0.50 ag i d10 9i ag i d9 5s6g 0.000E+00 ( //r2// )= 0.000E+00 a0 0.0000 0.000E+00 0.000 0.000 sqrtdel= 1.0000 0.000E+00 47 -1 0.70 0.50 ag i d10 9i ag i d9 5s7g 0.000E+00 ( //r2// )= 0.000E+00 a0 0.0000 0.000E+00 0.000 0.000 sqrtdel= 1.0000 0.000E+00 47 -1 0.70 0.50 ag i d10 9i ag i d9 5s8g 0.000E+00 ( //r2// )= 0.000E+00 a0 0.0000 0.000E+00 0.000 0.000 sqrtdel= 1.0000 0.000E+00 47 -1 0.70 0.50 ag i d10 9i ag i d9 5s9g 0.000E+00 ( //r2// )= 0.000E+00 a0 0.0000 0.000E+00 0.000 0.000 sqrtdel= 1.0000 0.000E+00 47 -1 0.70 0.50 ag i d10 9i ag i d10 7i -2.801E+02 ( 9i//r2// 7i)= 5.096E+02 a0 -0.1471 5.487E+02 0.000 0.000 sqrtdel= 1.0000 5.096E+02 47 -1 0.70 0.50 ag i d10 9i ag i d10 8i -3.159E+03 ( 9i//r2// 8i)= 5.747E+03 a0 -0.5679 6.979E+04 0.000 0.000 sqrtdel= 1.0000 5.747E+03 47 -1 0.70 0.50 ag i d10 9i ag i d10 9i 1.134E+04 ( 9i//r2// 9i)=-2.063E+04 a0 1.0000 8.993E+05 1.000 1.000 sqrtdel= 1.0000 -2.063E+04 47 -1 0.70 0.50 ag i d10 9i ag i d9 5s7i 0.000E+00 ( //r2// )= 0.000E+00 a0 0.0000 0.000E+00 0.000 0.000 sqrtdel= 1.0000 0.000E+00 47 -1 0.70 0.50 ag i d10 9i ag i d9 5s8i 0.000E+00 ( //r2// )= 0.000E+00 a0 0.0000 0.000E+00 0.000 0.000 sqrtdel= 1.0000 0.000E+00 47 -1 0.70 0.50 ag i d10 9i ag i d9 5s9i -3.165E+00 ( 4d//r2// 5s)=-3.165E+00 a0 -0.9614 6.679E-01-0.449-0.676 sqrtdel= 1.0000 -3.165E+00 47 -1 0.70 0.50 ag i d10 9i ag i d10 9l -1.180E+04 ( 9i//r2//10l)=-2.792E+04 a0 -0.9888 5.457E+05-0.829-0.918 sqrtdel= 1.0000 -2.792E+04 47 -1 0.70 0.50 ag i d10 9i ag i d9 5s9l 0.000E+00 ( //r2// )= 0.000E+00 a0 0.0000 0.000E+00 0.000 0.000 sqrtdel= 1.0000 0.000E+00 47 -1 0.70 0.50 ag i d10 9i ag i d9 5p2 0.000E+00 ( //r2// )= 0.000E+00 a0 0.0000 0.000E+00 0.000 0.000 sqrtdel= 1.0000 0.000E+00 47 -1 0.70 0.50 ag i d9 5s7i ag i d10 5s 0.000E+00 ( //r2// )= 0.000E+00 a0 0.0000 0.000E+00 0.000 0.000 sqrtdel= 1.0000 0.000E+00 47 -1 0.70 0.50 ag i d9 5s7i ag i d10 6s 0.000E+00 ( //r2// )= 0.000E+00 a0 0.0000 0.000E+00 0.000 0.000 sqrtdel= 1.0000 0.000E+00 47 -1 0.70 0.50 ag i d9 5s7i ag i d10 7s 0.000E+00 ( //r2// )= 0.000E+00 a0 0.0000 0.000E+00 0.000 0.000 sqrtdel= 1.0000 0.000E+00 47 -1 0.70 0.50 ag i d9 5s7i ag i d10 8s 0.000E+00 ( //r2// )= 0.000E+00 a0 0.0000 0.000E+00 0.000 0.000 sqrtdel= 1.0000 0.000E+00 47 -1 0.70 0.50 ag i d9 5s7i ag i d10 9s 0.000E+00 ( //r2// )= 0.000E+00 a0 0.0000 0.000E+00 0.000 0.000 sqrtdel= 1.0000 0.000E+00 47 -1 0.70 0.50 ag i d9 5s7i ag i d9 5s2 0.000E+00 ( //r2// )= 0.000E+00 a0 0.0000 0.000E+00 0.000 0.000 sqrtdel= 1.0000 0.000E+00 47 -1 0.70 0.50 ag i d9 5s7i ag i d9 5s6s 0.000E+00 ( //r2// )= 0.000E+00 a0 0.0000 0.000E+00 0.000 0.000 sqrtdel= 1.0000 0.000E+00 47 -1 0.70 0.50 ag i d9 5s7i ag i d9 5s7s 0.000E+00 ( //r2// )= 0.000E+00 a0 0.0000 0.000E+00 0.000 0.000 sqrtdel= 1.0000 0.000E+00 47 -1 0.70 0.50 ag i d9 5s7i ag i d9 5s8s 0.000E+00 ( //r2// )= 0.000E+00 a0 0.0000 0.000E+00 0.000 0.000 sqrtdel= 1.0000 0.000E+00 47 -1 0.70 0.50 ag i d9 5s7i ag i d9 5s9s 0.000E+00 ( //r2// )= 0.000E+00 a0 0.0000 0.000E+00 0.000 0.000 sqrtdel= 1.0000 0.000E+00 47 -1 0.70 0.50 ag i d9 5s7i ag i d8 5s2 6s 0.000E+00 ( //r2// )= 0.000E+00 a0 0.0000 0.000E+00 0.000 0.000 sqrtdel= 1.0000 0.000E+00 47 -1 0.70 0.50 ag i d9 5s7i ag i d10 5d 0.000E+00 ( //r2// )= 0.000E+00 a0 0.0000 0.000E+00 0.000 0.000 sqrtdel= 1.0000 0.000E+00 47 -1 0.70 0.50 ag i d9 5s7i ag i d10 6d 0.000E+00 ( //r2// )= 0.000E+00 a0 0.0000 0.000E+00 0.000 0.000 sqrtdel= 1.0000 0.000E+00 47 -1 0.70 0.50 ag i d9 5s7i ag i d10 7d 0.000E+00 ( //r2// )= 0.000E+00 a0 0.0000 0.000E+00 0.000 0.000 sqrtdel= 1.0000 0.000E+00 47 -1 0.70 0.50 ag i d9 5s7i ag i d10 8d 0.000E+00 ( //r2// )= 0.000E+00 a0 0.0000 0.000E+00 0.000 0.000 sqrtdel= 1.0000 0.000E+00 47 -1 0.70 0.50 ag i d9 5s7i ag i d10 9d 0.000E+00 ( //r2// )= 0.000E+00 a0 0.0000 0.000E+00 0.000 0.000 sqrtdel= 1.0000 0.000E+00 47 -1 0.70 0.50 ag i d9 5s7i ag i d9 5s5d 0.000E+00 ( //r2// )= 0.000E+00 a0 0.0000 0.000E+00 0.000 0.000 sqrtdel= 1.0000 0.000E+00 47 -1 0.70 0.50 ag i d9 5s7i ag i d9 5s6d 0.000E+00 ( //r2// )= 0.000E+00 a0 0.0000 0.000E+00 0.000 0.000 sqrtdel= 1.0000 0.000E+00 47 -1 0.70 0.50 ag i d9 5s7i ag i d9 5s7d 0.000E+00 ( //r2// )= 0.000E+00 a0 0.0000 0.000E+00 0.000 0.000 sqrtdel= 1.0000 0.000E+00 47 -1 0.70 0.50 ag i d9 5s7i ag i d9 5s8d 0.000E+00 ( //r2// )= 0.000E+00 a0 0.0000 0.000E+00 0.000 0.000 sqrtdel= 1.0000 0.000E+00 47 -1 0.70 0.50 ag i d9 5s7i ag i d9 5s9d 0.000E+00 ( //r2// )= 0.000E+00 a0 0.0000 0.000E+00 0.000 0.000 sqrtdel= 1.0000 0.000E+00 47 -1 0.70 0.50 ag i d9 5s7i ag i d8 5s2 5d 0.000E+00 ( //r2// )= 0.000E+00 a0 0.0000 0.000E+00 0.000 0.000 sqrtdel= 1.0000 0.000E+00 47 -1 0.70 0.50 ag i d9 5s7i ag i d10 5g 0.000E+00 ( //r2// )= 0.000E+00 a0 0.0000 0.000E+00 0.000 0.000 sqrtdel= 1.0000 0.000E+00 47 -1 0.70 0.50 ag i d9 5s7i ag i d10 6g 0.000E+00 ( //r2// )= 0.000E+00 a0 0.0000 0.000E+00 0.000 0.000 sqrtdel= 1.0000 0.000E+00 47 -1 0.70 0.50 ag i d9 5s7i ag i d10 7g 0.000E+00 ( //r2// )= 0.000E+00 a0 0.0000 0.000E+00 0.000 0.000 sqrtdel= 1.0000 0.000E+00 47 -1 0.70 0.50 ag i d9 5s7i ag i d10 8g 0.000E+00 ( //r2// )= 0.000E+00 a0 0.0000 0.000E+00 0.000 0.000 sqrtdel= 1.0000 0.000E+00 47 -1 0.70 0.50 ag i d9 5s7i ag i d10 9g 0.000E+00 ( //r2// )= 0.000E+00 a0 0.0000 0.000E+00 0.000 0.000 sqrtdel= 1.0000 0.000E+00 47 -1 0.70 0.50 ag i d9 5s7i ag i d9 5s5g 7.842E+02 ( 7i//r2// 5g)= 1.586E+03 a0 1.0000 4.300E+03 0.507 1.000 sqrtdel= 1.0000 1.586E+03 47 -1 0.70 0.50 ag i d9 5s7i ag i d9 5s6g -2.370E+03 ( 7i//r2// 6g)=-4.794E+03 a0 -0.9808 3.928E+04-0.811-0.904 sqrtdel= 1.0000 -4.794E+03 47 -1 0.70 0.50 ag i d9 5s7i ag i d9 5s7g 2.164E+03 ( 7i//r2// 7g)= 4.377E+03 a0 0.7467 3.275E+04 0.291 0.382 sqrtdel= 1.0000 4.377E+03 47 -1 0.70 0.50 ag i d9 5s7i ag i d9 5s8g -3.153E+02 ( 7i//r2// 8g)=-6.378E+02 a0 -0.1424 6.954E+02 0.026 0.048 sqrtdel= 1.0000 -6.378E+02 47 -1 0.70 0.50 ag i d9 5s7i ag i d9 5s9g -6.951E+01 ( 7i//r2// 9g)=-1.406E+02 a0 -0.0419 3.378E+01 0.012 0.027 sqrtdel= 1.0000 -1.406E+02 47 -1 0.70 0.50 ag i d9 5s7i ag i d10 7i -3.165E+00 ( 5s//r2// 4d)=-3.165E+00 a0 -0.9614 6.679E-01-0.449-0.676 sqrtdel= 1.0000 -3.165E+00 47 -1 0.70 0.50 ag i d9 5s7i ag i d10 8i 0.000E+00 ( //r2// )= 0.000E+00 a0 0.0000 0.000E+00 0.000 0.000 sqrtdel= 1.0000 0.000E+00 47 -1 0.70 0.50 ag i d9 5s7i ag i d10 9i 0.000E+00 ( //r2// )= 0.000E+00 a0 0.0000 0.000E+00 0.000 0.000 sqrtdel= 1.0000 0.000E+00 47 -1 0.70 0.50 ag i d9 5s7i ag i d9 5s7i 2.940E+03 ( 7i//r2// 7i)=-5.348E+03 a0 1.0000 6.045E+04 1.000 1.000 sqrtdel= 1.0000 -5.348E+03 47 -1 0.70 0.50 ag i d9 5s7i ag i d9 5s8i -1.510E+03 ( 7i//r2// 8i)= 2.746E+03 a0 -0.5653 1.594E+04 0.000 0.000 sqrtdel= 1.0000 2.746E+03 47 -1 0.70 0.50 ag i d9 5s7i ag i d9 5s9i -2.801E+02 ( 7i//r2// 9i)= 5.096E+02 a0 -0.1471 5.487E+02 0.000 0.000 sqrtdel= 1.0000 5.096E+02 47 -1 0.70 0.50 ag i d9 5s7i ag i d10 9l 0.000E+00 ( //r2// )= 0.000E+00 a0 0.0000 0.000E+00 0.000 0.000 sqrtdel= 1.0000 0.000E+00 47 -1 0.70 0.50 ag i d9 5s7i ag i d9 5s9l 1.293E+03 ( 7i//r2//10l)= 3.060E+03 a0 0.6607 6.558E+03 0.424 0.885 sqrtdel= 1.0000 3.060E+03 47 -1 0.70 0.50 ag i d9 5s7i ag i d9 5p2 0.000E+00 ( //r2// )= 0.000E+00 a0 0.0000 0.000E+00 0.000 0.000 sqrtdel= 1.0000 0.000E+00 47 -1 0.70 0.50 ag i d9 5s8i ag i d10 5s 0.000E+00 ( //r2// )= 0.000E+00 a0 0.0000 0.000E+00 0.000 0.000 sqrtdel= 1.0000 0.000E+00 47 -1 0.70 0.50 ag i d9 5s8i ag i d10 6s 0.000E+00 ( //r2// )= 0.000E+00 a0 0.0000 0.000E+00 0.000 0.000 sqrtdel= 1.0000 0.000E+00 47 -1 0.70 0.50 ag i d9 5s8i ag i d10 7s 0.000E+00 ( //r2// )= 0.000E+00 a0 0.0000 0.000E+00 0.000 0.000 sqrtdel= 1.0000 0.000E+00 47 -1 0.70 0.50 ag i d9 5s8i ag i d10 8s 0.000E+00 ( //r2// )= 0.000E+00 a0 0.0000 0.000E+00 0.000 0.000 sqrtdel= 1.0000 0.000E+00 47 -1 0.70 0.50 ag i d9 5s8i ag i d10 9s 0.000E+00 ( //r2// )= 0.000E+00 a0 0.0000 0.000E+00 0.000 0.000 sqrtdel= 1.0000 0.000E+00 47 -1 0.70 0.50 ag i d9 5s8i ag i d9 5s2 0.000E+00 ( //r2// )= 0.000E+00 a0 0.0000 0.000E+00 0.000 0.000 sqrtdel= 1.0000 0.000E+00 47 -1 0.70 0.50 ag i d9 5s8i ag i d9 5s6s 0.000E+00 ( //r2// )= 0.000E+00 a0 0.0000 0.000E+00 0.000 0.000 sqrtdel= 1.0000 0.000E+00 47 -1 0.70 0.50 ag i d9 5s8i ag i d9 5s7s 0.000E+00 ( //r2// )= 0.000E+00 a0 0.0000 0.000E+00 0.000 0.000 sqrtdel= 1.0000 0.000E+00 47 -1 0.70 0.50 ag i d9 5s8i ag i d9 5s8s 0.000E+00 ( //r2// )= 0.000E+00 a0 0.0000 0.000E+00 0.000 0.000 sqrtdel= 1.0000 0.000E+00 47 -1 0.70 0.50 ag i d9 5s8i ag i d9 5s9s 0.000E+00 ( //r2// )= 0.000E+00 a0 0.0000 0.000E+00 0.000 0.000 sqrtdel= 1.0000 0.000E+00 47 -1 0.70 0.50 ag i d9 5s8i ag i d8 5s2 6s 0.000E+00 ( //r2// )= 0.000E+00 a0 0.0000 0.000E+00 0.000 0.000 sqrtdel= 1.0000 0.000E+00 47 -1 0.70 0.50 ag i d9 5s8i ag i d10 5d 0.000E+00 ( //r2// )= 0.000E+00 a0 0.0000 0.000E+00 0.000 0.000 sqrtdel= 1.0000 0.000E+00 47 -1 0.70 0.50 ag i d9 5s8i ag i d10 6d 0.000E+00 ( //r2// )= 0.000E+00 a0 0.0000 0.000E+00 0.000 0.000 sqrtdel= 1.0000 0.000E+00 47 -1 0.70 0.50 ag i d9 5s8i ag i d10 7d 0.000E+00 ( //r2// )= 0.000E+00 a0 0.0000 0.000E+00 0.000 0.000 sqrtdel= 1.0000 0.000E+00 47 -1 0.70 0.50 ag i d9 5s8i ag i d10 8d 0.000E+00 ( //r2// )= 0.000E+00 a0 0.0000 0.000E+00 0.000 0.000 sqrtdel= 1.0000 0.000E+00 47 -1 0.70 0.50 ag i d9 5s8i ag i d10 9d 0.000E+00 ( //r2// )= 0.000E+00 a0 0.0000 0.000E+00 0.000 0.000 sqrtdel= 1.0000 0.000E+00 47 -1 0.70 0.50 ag i d9 5s8i ag i d9 5s5d 0.000E+00 ( //r2// )= 0.000E+00 a0 0.0000 0.000E+00 0.000 0.000 sqrtdel= 1.0000 0.000E+00 47 -1 0.70 0.50 ag i d9 5s8i ag i d9 5s6d 0.000E+00 ( //r2// )= 0.000E+00 a0 0.0000 0.000E+00 0.000 0.000 sqrtdel= 1.0000 0.000E+00 47 -1 0.70 0.50 ag i d9 5s8i ag i d9 5s7d 0.000E+00 ( //r2// )= 0.000E+00 a0 0.0000 0.000E+00 0.000 0.000 sqrtdel= 1.0000 0.000E+00 47 -1 0.70 0.50 ag i d9 5s8i ag i d9 5s8d 0.000E+00 ( //r2// )= 0.000E+00 a0 0.0000 0.000E+00 0.000 0.000 sqrtdel= 1.0000 0.000E+00 47 -1 0.70 0.50 ag i d9 5s8i ag i d9 5s9d 0.000E+00 ( //r2// )= 0.000E+00 a0 0.0000 0.000E+00 0.000 0.000 sqrtdel= 1.0000 0.000E+00 47 -1 0.70 0.50 ag i d9 5s8i ag i d8 5s2 5d 0.000E+00 ( //r2// )= 0.000E+00 a0 0.0000 0.000E+00 0.000 0.000 sqrtdel= 1.0000 0.000E+00 47 -1 0.70 0.50 ag i d9 5s8i ag i d10 5g 0.000E+00 ( //r2// )= 0.000E+00 a0 0.0000 0.000E+00 0.000 0.000 sqrtdel= 1.0000 0.000E+00 47 -1 0.70 0.50 ag i d9 5s8i ag i d10 6g 0.000E+00 ( //r2// )= 0.000E+00 a0 0.0000 0.000E+00 0.000 0.000 sqrtdel= 1.0000 0.000E+00 47 -1 0.70 0.50 ag i d9 5s8i ag i d10 7g 0.000E+00 ( //r2// )= 0.000E+00 a0 0.0000 0.000E+00 0.000 0.000 sqrtdel= 1.0000 0.000E+00 47 -1 0.70 0.50 ag i d9 5s8i ag i d10 8g 0.000E+00 ( //r2// )= 0.000E+00 a0 0.0000 0.000E+00 0.000 0.000 sqrtdel= 1.0000 0.000E+00 47 -1 0.70 0.50 ag i d9 5s8i ag i d10 9g 0.000E+00 ( //r2// )= 0.000E+00 a0 0.0000 0.000E+00 0.000 0.000 sqrtdel= 1.0000 0.000E+00 47 -1 0.70 0.50 ag i d9 5s8i ag i d9 5s5g 3.954E+02 ( 8i//r2// 5g)= 7.998E+02 a0 0.7568 1.094E+03 0.373 0.933 sqrtdel= 1.0000 7.998E+02 47 -1 0.70 0.50 ag i d9 5s8i ag i d9 5s6g 5.631E+02 ( 8i//r2// 6g)= 1.139E+03 a0 0.3415 2.217E+03-0.046-0.086 sqrtdel= 1.0000 1.139E+03 47 -1 0.70 0.50 ag i d9 5s8i ag i d9 5s7g -4.739E+03 ( 8i//r2// 7g)=-9.586E+03 a0 -0.9902 1.571E+05-0.819-0.938 sqrtdel= 1.0000 -9.586E+03 47 -1 0.70 0.50 ag i d9 5s8i ag i d9 5s8g 5.288E+03 ( 8i//r2// 8g)= 1.069E+04 a0 0.8532 1.955E+05 0.431 0.535 sqrtdel= 1.0000 1.069E+04 47 -1 0.70 0.50 ag i d9 5s8i ag i d9 5s9g -8.716E+02 ( 8i//r2// 9g)=-1.763E+03 a0 -0.1779 5.312E+03 0.042 0.069 sqrtdel= 1.0000 -1.763E+03 47 -1 0.70 0.50 ag i d9 5s8i ag i d10 7i 0.000E+00 ( //r2// )= 0.000E+00 a0 0.0000 0.000E+00 0.000 0.000 sqrtdel= 1.0000 0.000E+00 47 -1 0.70 0.50 ag i d9 5s8i ag i d10 8i -3.165E+00 ( 5s//r2// 4d)=-3.165E+00 a0 -0.9614 6.679E-01-0.449-0.676 sqrtdel= 1.0000 -3.165E+00 47 -1 0.70 0.50 ag i d9 5s8i ag i d10 9i 0.000E+00 ( //r2// )= 0.000E+00 a0 0.0000 0.000E+00 0.000 0.000 sqrtdel= 1.0000 0.000E+00 47 -1 0.70 0.50 ag i d9 5s8i ag i d9 5s7i -1.510E+03 ( 8i//r2// 7i)= 2.746E+03 a0 -0.5653 1.594E+04 0.000 0.000 sqrtdel= 1.0000 2.746E+03 47 -1 0.70 0.50 ag i d9 5s8i ag i d9 5s8i 6.240E+03 ( 8i//r2// 8i)=-1.135E+04 a0 1.0000 2.723E+05 1.000 1.000 sqrtdel= 1.0000 -1.135E+04 47 -1 0.70 0.50 ag i d9 5s8i ag i d9 5s9i -3.159E+03 ( 8i//r2// 9i)= 5.747E+03 a0 -0.5679 6.979E+04 0.000 0.000 sqrtdel= 1.0000 5.747E+03 47 -1 0.70 0.50 ag i d9 5s8i ag i d10 9l 0.000E+00 ( //r2// )= 0.000E+00 a0 0.0000 0.000E+00 0.000 0.000 sqrtdel= 1.0000 0.000E+00 47 -1 0.70 0.50 ag i d9 5s8i ag i d9 5s9l 2.340E+03 ( 8i//r2//10l)= 5.538E+03 a0 0.4783 2.148E+04 0.095 0.166 sqrtdel= 1.0000 5.538E+03 47 -1 0.70 0.50 ag i d9 5s8i ag i d9 5p2 0.000E+00 ( //r2// )= 0.000E+00 a0 0.0000 0.000E+00 0.000 0.000 sqrtdel= 1.0000 0.000E+00 47 -1 0.70 0.50 ag i d9 5s9i ag i d10 5s 0.000E+00 ( //r2// )= 0.000E+00 a0 0.0000 0.000E+00 0.000 0.000 sqrtdel= 1.0000 0.000E+00 47 -1 0.70 0.50 ag i d9 5s9i ag i d10 6s 0.000E+00 ( //r2// )= 0.000E+00 a0 0.0000 0.000E+00 0.000 0.000 sqrtdel= 1.0000 0.000E+00 47 -1 0.70 0.50 ag i d9 5s9i ag i d10 7s 0.000E+00 ( //r2// )= 0.000E+00 a0 0.0000 0.000E+00 0.000 0.000 sqrtdel= 1.0000 0.000E+00 47 -1 0.70 0.50 ag i d9 5s9i ag i d10 8s 0.000E+00 ( //r2// )= 0.000E+00 a0 0.0000 0.000E+00 0.000 0.000 sqrtdel= 1.0000 0.000E+00 47 -1 0.70 0.50 ag i d9 5s9i ag i d10 9s 0.000E+00 ( //r2// )= 0.000E+00 a0 0.0000 0.000E+00 0.000 0.000 sqrtdel= 1.0000 0.000E+00 47 -1 0.70 0.50 ag i d9 5s9i ag i d9 5s2 0.000E+00 ( //r2// )= 0.000E+00 a0 0.0000 0.000E+00 0.000 0.000 sqrtdel= 1.0000 0.000E+00 47 -1 0.70 0.50 ag i d9 5s9i ag i d9 5s6s 0.000E+00 ( //r2// )= 0.000E+00 a0 0.0000 0.000E+00 0.000 0.000 sqrtdel= 1.0000 0.000E+00 47 -1 0.70 0.50 ag i d9 5s9i ag i d9 5s7s 0.000E+00 ( //r2// )= 0.000E+00 a0 0.0000 0.000E+00 0.000 0.000 sqrtdel= 1.0000 0.000E+00 47 -1 0.70 0.50 ag i d9 5s9i ag i d9 5s8s 0.000E+00 ( //r2// )= 0.000E+00 a0 0.0000 0.000E+00 0.000 0.000 sqrtdel= 1.0000 0.000E+00 47 -1 0.70 0.50 ag i d9 5s9i ag i d9 5s9s 0.000E+00 ( //r2// )= 0.000E+00 a0 0.0000 0.000E+00 0.000 0.000 sqrtdel= 1.0000 0.000E+00 47 -1 0.70 0.50 ag i d9 5s9i ag i d8 5s2 6s 0.000E+00 ( //r2// )= 0.000E+00 a0 0.0000 0.000E+00 0.000 0.000 sqrtdel= 1.0000 0.000E+00 47 -1 0.70 0.50 ag i d9 5s9i ag i d10 5d 0.000E+00 ( //r2// )= 0.000E+00 a0 0.0000 0.000E+00 0.000 0.000 sqrtdel= 1.0000 0.000E+00 47 -1 0.70 0.50 ag i d9 5s9i ag i d10 6d 0.000E+00 ( //r2// )= 0.000E+00 a0 0.0000 0.000E+00 0.000 0.000 sqrtdel= 1.0000 0.000E+00 47 -1 0.70 0.50 ag i d9 5s9i ag i d10 7d 0.000E+00 ( //r2// )= 0.000E+00 a0 0.0000 0.000E+00 0.000 0.000 sqrtdel= 1.0000 0.000E+00 47 -1 0.70 0.50 ag i d9 5s9i ag i d10 8d 0.000E+00 ( //r2// )= 0.000E+00 a0 0.0000 0.000E+00 0.000 0.000 sqrtdel= 1.0000 0.000E+00 47 -1 0.70 0.50 ag i d9 5s9i ag i d10 9d 0.000E+00 ( //r2// )= 0.000E+00 a0 0.0000 0.000E+00 0.000 0.000 sqrtdel= 1.0000 0.000E+00 47 -1 0.70 0.50 ag i d9 5s9i ag i d9 5s5d 0.000E+00 ( //r2// )= 0.000E+00 a0 0.0000 0.000E+00 0.000 0.000 sqrtdel= 1.0000 0.000E+00 47 -1 0.70 0.50 ag i d9 5s9i ag i d9 5s6d 0.000E+00 ( //r2// )= 0.000E+00 a0 0.0000 0.000E+00 0.000 0.000 sqrtdel= 1.0000 0.000E+00 47 -1 0.70 0.50 ag i d9 5s9i ag i d9 5s7d 0.000E+00 ( //r2// )= 0.000E+00 a0 0.0000 0.000E+00 0.000 0.000 sqrtdel= 1.0000 0.000E+00 47 -1 0.70 0.50 ag i d9 5s9i ag i d9 5s8d 0.000E+00 ( //r2// )= 0.000E+00 a0 0.0000 0.000E+00 0.000 0.000 sqrtdel= 1.0000 0.000E+00 47 -1 0.70 0.50 ag i d9 5s9i ag i d9 5s9d 0.000E+00 ( //r2// )= 0.000E+00 a0 0.0000 0.000E+00 0.000 0.000 sqrtdel= 1.0000 0.000E+00 47 -1 0.70 0.50 ag i d9 5s9i ag i d8 5s2 5d 0.000E+00 ( //r2// )= 0.000E+00 a0 0.0000 0.000E+00 0.000 0.000 sqrtdel= 1.0000 0.000E+00 47 -1 0.70 0.50 ag i d9 5s9i ag i d10 5g 0.000E+00 ( //r2// )= 0.000E+00 a0 0.0000 0.000E+00 0.000 0.000 sqrtdel= 1.0000 0.000E+00 47 -1 0.70 0.50 ag i d9 5s9i ag i d10 6g 0.000E+00 ( //r2// )= 0.000E+00 a0 0.0000 0.000E+00 0.000 0.000 sqrtdel= 1.0000 0.000E+00 47 -1 0.70 0.50 ag i d9 5s9i ag i d10 7g 0.000E+00 ( //r2// )= 0.000E+00 a0 0.0000 0.000E+00 0.000 0.000 sqrtdel= 1.0000 0.000E+00 47 -1 0.70 0.50 ag i d9 5s9i ag i d10 8g 0.000E+00 ( //r2// )= 0.000E+00 a0 0.0000 0.000E+00 0.000 0.000 sqrtdel= 1.0000 0.000E+00 47 -1 0.70 0.50 ag i d9 5s9i ag i d10 9g 0.000E+00 ( //r2// )= 0.000E+00 a0 0.0000 0.000E+00 0.000 0.000 sqrtdel= 1.0000 0.000E+00 47 -1 0.70 0.50 ag i d9 5s9i ag i d9 5s5g 2.426E+02 ( 9i//r2// 5g)= 4.906E+02 a0 0.5999 4.114E+02 0.284 0.868 sqrtdel= 1.0000 4.906E+02 47 -1 0.70 0.50 ag i d9 5s9i ag i d9 5s6g 4.409E+02 ( 9i//r2// 6g)= 8.917E+02 a0 0.3690 1.359E+03 0.074 0.183 sqrtdel= 1.0000 8.917E+02 47 -1 0.70 0.50 ag i d9 5s9i ag i d9 5s7g 2.134E+02 ( 9i//r2// 7g)= 4.316E+02 a0 0.0631 3.184E+02-0.243-0.399 sqrtdel= 1.0000 4.316E+02 47 -1 0.70 0.50 ag i d9 5s9i ag i d9 5s8g -7.963E+03 ( 9i//r2// 8g)=-1.611E+04 a0 -0.9657 4.435E+05-0.754-0.911 sqrtdel= 1.0000 -1.611E+04 47 -1 0.70 0.50 ag i d9 5s9i ag i d9 5s9g 1.017E+04 ( 9i//r2// 9g)= 2.056E+04 a0 0.9067 7.228E+05 0.531 0.639 sqrtdel= 1.0000 2.056E+04 47 -1 0.70 0.50 ag i d9 5s9i ag i d10 7i 0.000E+00 ( //r2// )= 0.000E+00 a0 0.0000 0.000E+00 0.000 0.000 sqrtdel= 1.0000 0.000E+00 47 -1 0.70 0.50 ag i d9 5s9i ag i d10 8i 0.000E+00 ( //r2// )= 0.000E+00 a0 0.0000 0.000E+00 0.000 0.000 sqrtdel= 1.0000 0.000E+00 47 -1 0.70 0.50 ag i d9 5s9i ag i d10 9i -3.165E+00 ( 5s//r2// 4d)=-3.165E+00 a0 -0.9614 6.679E-01-0.449-0.676 sqrtdel= 1.0000 -3.165E+00 47 -1 0.70 0.50 ag i d9 5s9i ag i d9 5s7i -2.801E+02 ( 9i//r2// 7i)= 5.096E+02 a0 -0.1471 5.487E+02 0.000 0.000 sqrtdel= 1.0000 5.096E+02 47 -1 0.70 0.50 ag i d9 5s9i ag i d9 5s8i -3.159E+03 ( 9i//r2// 8i)= 5.747E+03 a0 -0.5679 6.979E+04 0.000 0.000 sqrtdel= 1.0000 5.747E+03 47 -1 0.70 0.50 ag i d9 5s9i ag i d9 5s9i 1.134E+04 ( 9i//r2// 9i)=-2.063E+04 a0 1.0000 8.993E+05 1.000 1.000 sqrtdel= 1.0000 -2.063E+04 47 -1 0.70 0.50 ag i d9 5s9i ag i d10 9l 0.000E+00 ( //r2// )= 0.000E+00 a0 0.0000 0.000E+00 0.000 0.000 sqrtdel= 1.0000 0.000E+00 47 -1 0.70 0.50 ag i d9 5s9i ag i d9 5s9l -1.180E+04 ( 9i//r2//10l)=-2.792E+04 a0 -0.9888 5.457E+05-0.829-0.918 sqrtdel= 1.0000 -2.792E+04 47 -1 0.70 0.50 ag i d9 5s9i ag i d9 5p2 0.000E+00 ( //r2// )= 0.000E+00 a0 0.0000 0.000E+00 0.000 0.000 sqrtdel= 1.0000 0.000E+00 47 -1 0.70 0.50 ag i d10 9l ag i d10 5s 0.000E+00 ( //r2// )= 0.000E+00 a0 0.0000 0.000E+00 0.000 0.000 sqrtdel= 1.0000 0.000E+00 47 -1 0.70 0.50 ag i d10 9l ag i d10 6s 0.000E+00 ( //r2// )= 0.000E+00 a0 0.0000 0.000E+00 0.000 0.000 sqrtdel= 1.0000 0.000E+00 47 -1 0.70 0.50 ag i d10 9l ag i d10 7s 0.000E+00 ( //r2// )= 0.000E+00 a0 0.0000 0.000E+00 0.000 0.000 sqrtdel= 1.0000 0.000E+00 47 -1 0.70 0.50 ag i d10 9l ag i d10 8s 0.000E+00 ( //r2// )= 0.000E+00 a0 0.0000 0.000E+00 0.000 0.000 sqrtdel= 1.0000 0.000E+00 47 -1 0.70 0.50 ag i d10 9l ag i d10 9s 0.000E+00 ( //r2// )= 0.000E+00 a0 0.0000 0.000E+00 0.000 0.000 sqrtdel= 1.0000 0.000E+00 47 -1 0.70 0.50 ag i d10 9l ag i d9 5s2 0.000E+00 ( //r2// )= 0.000E+00 a0 0.0000 0.000E+00 0.000 0.000 sqrtdel= 1.0000 0.000E+00 47 -1 0.70 0.50 ag i d10 9l ag i d9 5s6s 0.000E+00 ( //r2// )= 0.000E+00 a0 0.0000 0.000E+00 0.000 0.000 sqrtdel= 1.0000 0.000E+00 47 -1 0.70 0.50 ag i d10 9l ag i d9 5s7s 0.000E+00 ( //r2// )= 0.000E+00 a0 0.0000 0.000E+00 0.000 0.000 sqrtdel= 1.0000 0.000E+00 47 -1 0.70 0.50 ag i d10 9l ag i d9 5s8s 0.000E+00 ( //r2// )= 0.000E+00 a0 0.0000 0.000E+00 0.000 0.000 sqrtdel= 1.0000 0.000E+00 47 -1 0.70 0.50 ag i d10 9l ag i d9 5s9s 0.000E+00 ( //r2// )= 0.000E+00 a0 0.0000 0.000E+00 0.000 0.000 sqrtdel= 1.0000 0.000E+00 47 -1 0.70 0.50 ag i d10 9l ag i d8 5s2 6s 0.000E+00 ( //r2// )= 0.000E+00 a0 0.0000 0.000E+00 0.000 0.000 sqrtdel= 1.0000 0.000E+00 47 -1 0.70 0.50 ag i d10 9l ag i d10 5d 0.000E+00 ( //r2// )= 0.000E+00 a0 0.0000 0.000E+00 0.000 0.000 sqrtdel= 1.0000 0.000E+00 47 -1 0.70 0.50 ag i d10 9l ag i d10 6d 0.000E+00 ( //r2// )= 0.000E+00 a0 0.0000 0.000E+00 0.000 0.000 sqrtdel= 1.0000 0.000E+00 47 -1 0.70 0.50 ag i d10 9l ag i d10 7d 0.000E+00 ( //r2// )= 0.000E+00 a0 0.0000 0.000E+00 0.000 0.000 sqrtdel= 1.0000 0.000E+00 47 -1 0.70 0.50 ag i d10 9l ag i d10 8d 0.000E+00 ( //r2// )= 0.000E+00 a0 0.0000 0.000E+00 0.000 0.000 sqrtdel= 1.0000 0.000E+00 47 -1 0.70 0.50 ag i d10 9l ag i d10 9d 0.000E+00 ( //r2// )= 0.000E+00 a0 0.0000 0.000E+00 0.000 0.000 sqrtdel= 1.0000 0.000E+00 47 -1 0.70 0.50 ag i d10 9l ag i d9 5s5d 0.000E+00 ( //r2// )= 0.000E+00 a0 0.0000 0.000E+00 0.000 0.000 sqrtdel= 1.0000 0.000E+00 47 -1 0.70 0.50 ag i d10 9l ag i d9 5s6d 0.000E+00 ( //r2// )= 0.000E+00 a0 0.0000 0.000E+00 0.000 0.000 sqrtdel= 1.0000 0.000E+00 47 -1 0.70 0.50 ag i d10 9l ag i d9 5s7d 0.000E+00 ( //r2// )= 0.000E+00 a0 0.0000 0.000E+00 0.000 0.000 sqrtdel= 1.0000 0.000E+00 47 -1 0.70 0.50 ag i d10 9l ag i d9 5s8d 0.000E+00 ( //r2// )= 0.000E+00 a0 0.0000 0.000E+00 0.000 0.000 sqrtdel= 1.0000 0.000E+00 47 -1 0.70 0.50 ag i d10 9l ag i d9 5s9d 0.000E+00 ( //r2// )= 0.000E+00 a0 0.0000 0.000E+00 0.000 0.000 sqrtdel= 1.0000 0.000E+00 47 -1 0.70 0.50 ag i d10 9l ag i d8 5s2 5d 0.000E+00 ( //r2// )= 0.000E+00 a0 0.0000 0.000E+00 0.000 0.000 sqrtdel= 1.0000 0.000E+00 47 -1 0.70 0.50 ag i d10 9l ag i d10 5g 0.000E+00 ( //r2// )= 0.000E+00 a0 0.0000 0.000E+00 0.000 0.000 sqrtdel= 1.0000 0.000E+00 47 -1 0.70 0.50 ag i d10 9l ag i d10 6g 0.000E+00 ( //r2// )= 0.000E+00 a0 0.0000 0.000E+00 0.000 0.000 sqrtdel= 1.0000 0.000E+00 47 -1 0.70 0.50 ag i d10 9l ag i d10 7g 0.000E+00 ( //r2// )= 0.000E+00 a0 0.0000 0.000E+00 0.000 0.000 sqrtdel= 1.0000 0.000E+00 47 -1 0.70 0.50 ag i d10 9l ag i d10 8g 0.000E+00 ( //r2// )= 0.000E+00 a0 0.0000 0.000E+00 0.000 0.000 sqrtdel= 1.0000 0.000E+00 47 -1 0.70 0.50 ag i d10 9l ag i d10 9g 0.000E+00 ( //r2// )= 0.000E+00 a0 0.0000 0.000E+00 0.000 0.000 sqrtdel= 1.0000 0.000E+00 47 -1 0.70 0.50 ag i d10 9l ag i d9 5s5g 0.000E+00 ( //r2// )= 0.000E+00 a0 0.0000 0.000E+00 0.000 0.000 sqrtdel= 1.0000 0.000E+00 47 -1 0.70 0.50 ag i d10 9l ag i d9 5s6g 0.000E+00 ( //r2// )= 0.000E+00 a0 0.0000 0.000E+00 0.000 0.000 sqrtdel= 1.0000 0.000E+00 47 -1 0.70 0.50 ag i d10 9l ag i d9 5s7g 0.000E+00 ( //r2// )= 0.000E+00 a0 0.0000 0.000E+00 0.000 0.000 sqrtdel= 1.0000 0.000E+00 47 -1 0.70 0.50 ag i d10 9l ag i d9 5s8g 0.000E+00 ( //r2// )= 0.000E+00 a0 0.0000 0.000E+00 0.000 0.000 sqrtdel= 1.0000 0.000E+00 47 -1 0.70 0.50 ag i d10 9l ag i d9 5s9g 0.000E+00 ( //r2// )= 0.000E+00 a0 0.0000 0.000E+00 0.000 0.000 sqrtdel= 1.0000 0.000E+00 47 -1 0.70 0.50 ag i d10 9l ag i d10 7i 1.293E+03 (10l//r2// 7i)= 3.060E+03 a0 0.6607 6.558E+03 0.424 0.885 sqrtdel= 1.0000 3.060E+03 47 -1 0.70 0.50 ag i d10 9l ag i d10 8i 2.340E+03 (10l//r2// 8i)= 5.538E+03 a0 0.4783 2.148E+04 0.095 0.166 sqrtdel= 1.0000 5.538E+03 47 -1 0.70 0.50 ag i d10 9l ag i d10 9i -1.180E+04 (10l//r2// 9i)=-2.792E+04 a0 -0.9888 5.457E+05-0.829-0.918 sqrtdel= 1.0000 -2.792E+04 47 -1 0.70 0.50 ag i d10 9l ag i d9 5s7i 0.000E+00 ( //r2// )= 0.000E+00 a0 0.0000 0.000E+00 0.000 0.000 sqrtdel= 1.0000 0.000E+00 47 -1 0.70 0.50 ag i d10 9l ag i d9 5s8i 0.000E+00 ( //r2// )= 0.000E+00 a0 0.0000 0.000E+00 0.000 0.000 sqrtdel= 1.0000 0.000E+00 47 -1 0.70 0.50 ag i d10 9l ag i d9 5s9i 0.000E+00 ( //r2// )= 0.000E+00 a0 0.0000 0.000E+00 0.000 0.000 sqrtdel= 1.0000 0.000E+00 47 -1 0.70 0.50 ag i d10 9l ag i d10 9l 1.425E+04 (10l//r2//10l)=-2.953E+04 a0 1.0000 7.963E+05 1.000 1.000 sqrtdel= 1.0000 -2.953E+04 47 -1 0.70 0.50 ag i d10 9l ag i d9 5s9l -3.165E+00 ( 4d//r2// 5s)=-3.165E+00 a0 -0.9614 6.679E-01-0.449-0.676 sqrtdel= 1.0000 -3.165E+00 47 -1 0.70 0.50 ag i d10 9l ag i d9 5p2 0.000E+00 ( //r2// )= 0.000E+00 a0 0.0000 0.000E+00 0.000 0.000 sqrtdel= 1.0000 0.000E+00 47 -1 0.70 0.50 ag i d9 5s9l ag i d10 5s 0.000E+00 ( //r2// )= 0.000E+00 a0 0.0000 0.000E+00 0.000 0.000 sqrtdel= 1.0000 0.000E+00 47 -1 0.70 0.50 ag i d9 5s9l ag i d10 6s 0.000E+00 ( //r2// )= 0.000E+00 a0 0.0000 0.000E+00 0.000 0.000 sqrtdel= 1.0000 0.000E+00 47 -1 0.70 0.50 ag i d9 5s9l ag i d10 7s 0.000E+00 ( //r2// )= 0.000E+00 a0 0.0000 0.000E+00 0.000 0.000 sqrtdel= 1.0000 0.000E+00 47 -1 0.70 0.50 ag i d9 5s9l ag i d10 8s 0.000E+00 ( //r2// )= 0.000E+00 a0 0.0000 0.000E+00 0.000 0.000 sqrtdel= 1.0000 0.000E+00 47 -1 0.70 0.50 ag i d9 5s9l ag i d10 9s 0.000E+00 ( //r2// )= 0.000E+00 a0 0.0000 0.000E+00 0.000 0.000 sqrtdel= 1.0000 0.000E+00 47 -1 0.70 0.50 ag i d9 5s9l ag i d9 5s2 0.000E+00 ( //r2// )= 0.000E+00 a0 0.0000 0.000E+00 0.000 0.000 sqrtdel= 1.0000 0.000E+00 47 -1 0.70 0.50 ag i d9 5s9l ag i d9 5s6s 0.000E+00 ( //r2// )= 0.000E+00 a0 0.0000 0.000E+00 0.000 0.000 sqrtdel= 1.0000 0.000E+00 47 -1 0.70 0.50 ag i d9 5s9l ag i d9 5s7s 0.000E+00 ( //r2// )= 0.000E+00 a0 0.0000 0.000E+00 0.000 0.000 sqrtdel= 1.0000 0.000E+00 47 -1 0.70 0.50 ag i d9 5s9l ag i d9 5s8s 0.000E+00 ( //r2// )= 0.000E+00 a0 0.0000 0.000E+00 0.000 0.000 sqrtdel= 1.0000 0.000E+00 47 -1 0.70 0.50 ag i d9 5s9l ag i d9 5s9s 0.000E+00 ( //r2// )= 0.000E+00 a0 0.0000 0.000E+00 0.000 0.000 sqrtdel= 1.0000 0.000E+00 47 -1 0.70 0.50 ag i d9 5s9l ag i d8 5s2 6s 0.000E+00 ( //r2// )= 0.000E+00 a0 0.0000 0.000E+00 0.000 0.000 sqrtdel= 1.0000 0.000E+00 47 -1 0.70 0.50 ag i d9 5s9l ag i d10 5d 0.000E+00 ( //r2// )= 0.000E+00 a0 0.0000 0.000E+00 0.000 0.000 sqrtdel= 1.0000 0.000E+00 47 -1 0.70 0.50 ag i d9 5s9l ag i d10 6d 0.000E+00 ( //r2// )= 0.000E+00 a0 0.0000 0.000E+00 0.000 0.000 sqrtdel= 1.0000 0.000E+00 47 -1 0.70 0.50 ag i d9 5s9l ag i d10 7d 0.000E+00 ( //r2// )= 0.000E+00 a0 0.0000 0.000E+00 0.000 0.000 sqrtdel= 1.0000 0.000E+00 47 -1 0.70 0.50 ag i d9 5s9l ag i d10 8d 0.000E+00 ( //r2// )= 0.000E+00 a0 0.0000 0.000E+00 0.000 0.000 sqrtdel= 1.0000 0.000E+00 47 -1 0.70 0.50 ag i d9 5s9l ag i d10 9d 0.000E+00 ( //r2// )= 0.000E+00 a0 0.0000 0.000E+00 0.000 0.000 sqrtdel= 1.0000 0.000E+00 47 -1 0.70 0.50 ag i d9 5s9l ag i d9 5s5d 0.000E+00 ( //r2// )= 0.000E+00 a0 0.0000 0.000E+00 0.000 0.000 sqrtdel= 1.0000 0.000E+00 47 -1 0.70 0.50 ag i d9 5s9l ag i d9 5s6d 0.000E+00 ( //r2// )= 0.000E+00 a0 0.0000 0.000E+00 0.000 0.000 sqrtdel= 1.0000 0.000E+00 47 -1 0.70 0.50 ag i d9 5s9l ag i d9 5s7d 0.000E+00 ( //r2// )= 0.000E+00 a0 0.0000 0.000E+00 0.000 0.000 sqrtdel= 1.0000 0.000E+00 47 -1 0.70 0.50 ag i d9 5s9l ag i d9 5s8d 0.000E+00 ( //r2// )= 0.000E+00 a0 0.0000 0.000E+00 0.000 0.000 sqrtdel= 1.0000 0.000E+00 47 -1 0.70 0.50 ag i d9 5s9l ag i d9 5s9d 0.000E+00 ( //r2// )= 0.000E+00 a0 0.0000 0.000E+00 0.000 0.000 sqrtdel= 1.0000 0.000E+00 47 -1 0.70 0.50 ag i d9 5s9l ag i d8 5s2 5d 0.000E+00 ( //r2// )= 0.000E+00 a0 0.0000 0.000E+00 0.000 0.000 sqrtdel= 1.0000 0.000E+00 47 -1 0.70 0.50 ag i d9 5s9l ag i d10 5g 0.000E+00 ( //r2// )= 0.000E+00 a0 0.0000 0.000E+00 0.000 0.000 sqrtdel= 1.0000 0.000E+00 47 -1 0.70 0.50 ag i d9 5s9l ag i d10 6g 0.000E+00 ( //r2// )= 0.000E+00 a0 0.0000 0.000E+00 0.000 0.000 sqrtdel= 1.0000 0.000E+00 47 -1 0.70 0.50 ag i d9 5s9l ag i d10 7g 0.000E+00 ( //r2// )= 0.000E+00 a0 0.0000 0.000E+00 0.000 0.000 sqrtdel= 1.0000 0.000E+00 47 -1 0.70 0.50 ag i d9 5s9l ag i d10 8g 0.000E+00 ( //r2// )= 0.000E+00 a0 0.0000 0.000E+00 0.000 0.000 sqrtdel= 1.0000 0.000E+00 47 -1 0.70 0.50 ag i d9 5s9l ag i d10 9g 0.000E+00 ( //r2// )= 0.000E+00 a0 0.0000 0.000E+00 0.000 0.000 sqrtdel= 1.0000 0.000E+00 47 -1 0.70 0.50 ag i d9 5s9l ag i d9 5s5g 0.000E+00 ( //r2// )= 0.000E+00 a0 0.0000 0.000E+00 0.000 0.000 sqrtdel= 1.0000 0.000E+00 47 -1 0.70 0.50 ag i d9 5s9l ag i d9 5s6g 0.000E+00 ( //r2// )= 0.000E+00 a0 0.0000 0.000E+00 0.000 0.000 sqrtdel= 1.0000 0.000E+00 47 -1 0.70 0.50 ag i d9 5s9l ag i d9 5s7g 0.000E+00 ( //r2// )= 0.000E+00 a0 0.0000 0.000E+00 0.000 0.000 sqrtdel= 1.0000 0.000E+00 47 -1 0.70 0.50 ag i d9 5s9l ag i d9 5s8g 0.000E+00 ( //r2// )= 0.000E+00 a0 0.0000 0.000E+00 0.000 0.000 sqrtdel= 1.0000 0.000E+00 47 -1 0.70 0.50 ag i d9 5s9l ag i d9 5s9g 0.000E+00 ( //r2// )= 0.000E+00 a0 0.0000 0.000E+00 0.000 0.000 sqrtdel= 1.0000 0.000E+00 47 -1 0.70 0.50 ag i d9 5s9l ag i d10 7i 0.000E+00 ( //r2// )= 0.000E+00 a0 0.0000 0.000E+00 0.000 0.000 sqrtdel= 1.0000 0.000E+00 47 -1 0.70 0.50 ag i d9 5s9l ag i d10 8i 0.000E+00 ( //r2// )= 0.000E+00 a0 0.0000 0.000E+00 0.000 0.000 sqrtdel= 1.0000 0.000E+00 47 -1 0.70 0.50 ag i d9 5s9l ag i d10 9i 0.000E+00 ( //r2// )= 0.000E+00 a0 0.0000 0.000E+00 0.000 0.000 sqrtdel= 1.0000 0.000E+00 47 -1 0.70 0.50 ag i d9 5s9l ag i d9 5s7i 1.293E+03 (10l//r2// 7i)= 3.060E+03 a0 0.6607 6.558E+03 0.424 0.885 sqrtdel= 1.0000 3.060E+03 47 -1 0.70 0.50 ag i d9 5s9l ag i d9 5s8i 2.340E+03 (10l//r2// 8i)= 5.538E+03 a0 0.4783 2.148E+04 0.095 0.166 sqrtdel= 1.0000 5.538E+03 47 -1 0.70 0.50 ag i d9 5s9l ag i d9 5s9i -1.180E+04 (10l//r2// 9i)=-2.792E+04 a0 -0.9888 5.457E+05-0.829-0.918 sqrtdel= 1.0000 -2.792E+04 47 -1 0.70 0.50 ag i d9 5s9l ag i d10 9l -3.165E+00 ( 5s//r2// 4d)=-3.165E+00 a0 -0.9614 6.679E-01-0.449-0.676 sqrtdel= 1.0000 -3.165E+00 47 -1 0.70 0.50 ag i d9 5s9l ag i d9 5s9l 1.425E+04 (10l//r2//10l)=-2.953E+04 a0 1.0000 7.963E+05 1.000 1.000 sqrtdel= 1.0000 -2.953E+04 47 -1 0.70 0.50 ag i d9 5s9l ag i d9 5p2 0.000E+00 ( //r2// )= 0.000E+00 a0 0.0000 0.000E+00 0.000 0.000 sqrtdel= 1.0000 0.000E+00 47 -1 0.70 0.50 ag i d9 5p2 ag i d10 5s 0.000E+00 ( //r2// )= 0.000E+00 a0 0.0000 0.000E+00 0.000 0.000 sqrtdel= 1.0000 0.000E+00 47 -1 0.70 0.50 ag i d9 5p2 ag i d10 6s 0.000E+00 ( //r2// )= 0.000E+00 a0 0.0000 0.000E+00 0.000 0.000 sqrtdel= 1.0000 0.000E+00 47 -1 0.70 0.50 ag i d9 5p2 ag i d10 7s 0.000E+00 ( //r2// )= 0.000E+00 a0 0.0000 0.000E+00 0.000 0.000 sqrtdel= 1.0000 0.000E+00 47 -1 0.70 0.50 ag i d9 5p2 ag i d10 8s 0.000E+00 ( //r2// )= 0.000E+00 a0 0.0000 0.000E+00 0.000 0.000 sqrtdel= 1.0000 0.000E+00 47 -1 0.70 0.50 ag i d9 5p2 ag i d10 9s 0.000E+00 ( //r2// )= 0.000E+00 a0 0.0000 0.000E+00 0.000 0.000 sqrtdel= 1.0000 0.000E+00 47 -1 0.70 0.50 ag i d9 5p2 ag i d9 5s2 0.000E+00 ( //r2// )= 0.000E+00 a0 0.0000 0.000E+00 0.000 0.000 sqrtdel= 1.0000 0.000E+00 47 -1 0.70 0.50 ag i d9 5p2 ag i d9 5s6s 0.000E+00 ( //r2// )= 0.000E+00 a0 0.0000 0.000E+00 0.000 0.000 sqrtdel= 1.0000 0.000E+00 47 -1 0.70 0.50 ag i d9 5p2 ag i d9 5s7s 0.000E+00 ( //r2// )= 0.000E+00 a0 0.0000 0.000E+00 0.000 0.000 sqrtdel= 1.0000 0.000E+00 47 -1 0.70 0.50 ag i d9 5p2 ag i d9 5s8s 0.000E+00 ( //r2// )= 0.000E+00 a0 0.0000 0.000E+00 0.000 0.000 sqrtdel= 1.0000 0.000E+00 47 -1 0.70 0.50 ag i d9 5p2 ag i d9 5s9s 0.000E+00 ( //r2// )= 0.000E+00 a0 0.0000 0.000E+00 0.000 0.000 sqrtdel= 1.0000 0.000E+00 47 -1 0.70 0.50 ag i d9 5p2 ag i d8 5s2 6s 0.000E+00 ( //r2// )= 0.000E+00 a0 0.0000 0.000E+00 0.000 0.000 sqrtdel= 1.0000 0.000E+00 47 -1 0.70 0.50 ag i d9 5p2 ag i d10 5d 0.000E+00 ( //r2// )= 0.000E+00 a0 0.0000 0.000E+00 0.000 0.000 sqrtdel= 1.0000 0.000E+00 47 -1 0.70 0.50 ag i d9 5p2 ag i d10 6d 0.000E+00 ( //r2// )= 0.000E+00 a0 0.0000 0.000E+00 0.000 0.000 sqrtdel= 1.0000 0.000E+00 47 -1 0.70 0.50 ag i d9 5p2 ag i d10 7d 0.000E+00 ( //r2// )= 0.000E+00 a0 0.0000 0.000E+00 0.000 0.000 sqrtdel= 1.0000 0.000E+00 47 -1 0.70 0.50 ag i d9 5p2 ag i d10 8d 0.000E+00 ( //r2// )= 0.000E+00 a0 0.0000 0.000E+00 0.000 0.000 sqrtdel= 1.0000 0.000E+00 47 -1 0.70 0.50 ag i d9 5p2 ag i d10 9d 0.000E+00 ( //r2// )= 0.000E+00 a0 0.0000 0.000E+00 0.000 0.000 sqrtdel= 1.0000 0.000E+00 47 -1 0.70 0.50 ag i d9 5p2 ag i d9 5s5d 0.000E+00 ( //r2// )= 0.000E+00 a0 0.0000 0.000E+00 0.000 0.000 sqrtdel= 1.0000 0.000E+00 47 -1 0.70 0.50 ag i d9 5p2 ag i d9 5s6d 0.000E+00 ( //r2// )= 0.000E+00 a0 0.0000 0.000E+00 0.000 0.000 sqrtdel= 1.0000 0.000E+00 47 -1 0.70 0.50 ag i d9 5p2 ag i d9 5s7d 0.000E+00 ( //r2// )= 0.000E+00 a0 0.0000 0.000E+00 0.000 0.000 sqrtdel= 1.0000 0.000E+00 47 -1 0.70 0.50 ag i d9 5p2 ag i d9 5s8d 0.000E+00 ( //r2// )= 0.000E+00 a0 0.0000 0.000E+00 0.000 0.000 sqrtdel= 1.0000 0.000E+00 47 -1 0.70 0.50 ag i d9 5p2 ag i d9 5s9d 0.000E+00 ( //r2// )= 0.000E+00 a0 0.0000 0.000E+00 0.000 0.000 sqrtdel= 1.0000 0.000E+00 47 -1 0.70 0.50 ag i d9 5p2 ag i d8 5s2 5d 0.000E+00 ( //r2// )= 0.000E+00 a0 0.0000 0.000E+00 0.000 0.000 sqrtdel= 1.0000 0.000E+00 47 -1 0.70 0.50 ag i d9 5p2 ag i d10 5g 0.000E+00 ( //r2// )= 0.000E+00 a0 0.0000 0.000E+00 0.000 0.000 sqrtdel= 1.0000 0.000E+00 47 -1 0.70 0.50 ag i d9 5p2 ag i d10 6g 0.000E+00 ( //r2// )= 0.000E+00 a0 0.0000 0.000E+00 0.000 0.000 sqrtdel= 1.0000 0.000E+00 47 -1 0.70 0.50 ag i d9 5p2 ag i d10 7g 0.000E+00 ( //r2// )= 0.000E+00 a0 0.0000 0.000E+00 0.000 0.000 sqrtdel= 1.0000 0.000E+00 47 -1 0.70 0.50 ag i d9 5p2 ag i d10 8g 0.000E+00 ( //r2// )= 0.000E+00 a0 0.0000 0.000E+00 0.000 0.000 sqrtdel= 1.0000 0.000E+00 47 -1 0.70 0.50 ag i d9 5p2 ag i d10 9g 0.000E+00 ( //r2// )= 0.000E+00 a0 0.0000 0.000E+00 0.000 0.000 sqrtdel= 1.0000 0.000E+00 47 -1 0.70 0.50 ag i d9 5p2 ag i d9 5s5g 0.000E+00 ( //r2// )= 0.000E+00 a0 0.0000 0.000E+00 0.000 0.000 sqrtdel= 1.0000 0.000E+00 47 -1 0.70 0.50 ag i d9 5p2 ag i d9 5s6g 0.000E+00 ( //r2// )= 0.000E+00 a0 0.0000 0.000E+00 0.000 0.000 sqrtdel= 1.0000 0.000E+00 47 -1 0.70 0.50 ag i d9 5p2 ag i d9 5s7g 0.000E+00 ( //r2// )= 0.000E+00 a0 0.0000 0.000E+00 0.000 0.000 sqrtdel= 1.0000 0.000E+00 47 -1 0.70 0.50 ag i d9 5p2 ag i d9 5s8g 0.000E+00 ( //r2// )= 0.000E+00 a0 0.0000 0.000E+00 0.000 0.000 sqrtdel= 1.0000 0.000E+00 47 -1 0.70 0.50 ag i d9 5p2 ag i d9 5s9g 0.000E+00 ( //r2// )= 0.000E+00 a0 0.0000 0.000E+00 0.000 0.000 sqrtdel= 1.0000 0.000E+00 47 -1 0.70 0.50 ag i d9 5p2 ag i d10 7i 0.000E+00 ( //r2// )= 0.000E+00 a0 0.0000 0.000E+00 0.000 0.000 sqrtdel= 1.0000 0.000E+00 47 -1 0.70 0.50 ag i d9 5p2 ag i d10 8i 0.000E+00 ( //r2// )= 0.000E+00 a0 0.0000 0.000E+00 0.000 0.000 sqrtdel= 1.0000 0.000E+00 47 -1 0.70 0.50 ag i d9 5p2 ag i d10 9i 0.000E+00 ( //r2// )= 0.000E+00 a0 0.0000 0.000E+00 0.000 0.000 sqrtdel= 1.0000 0.000E+00 47 -1 0.70 0.50 ag i d9 5p2 ag i d9 5s7i 0.000E+00 ( //r2// )= 0.000E+00 a0 0.0000 0.000E+00 0.000 0.000 sqrtdel= 1.0000 0.000E+00 47 -1 0.70 0.50 ag i d9 5p2 ag i d9 5s8i 0.000E+00 ( //r2// )= 0.000E+00 a0 0.0000 0.000E+00 0.000 0.000 sqrtdel= 1.0000 0.000E+00 47 -1 0.70 0.50 ag i d9 5p2 ag i d9 5s9i 0.000E+00 ( //r2// )= 0.000E+00 a0 0.0000 0.000E+00 0.000 0.000 sqrtdel= 1.0000 0.000E+00 47 -1 0.70 0.50 ag i d9 5p2 ag i d10 9l 0.000E+00 ( //r2// )= 0.000E+00 a0 0.0000 0.000E+00 0.000 0.000 sqrtdel= 1.0000 0.000E+00 47 -1 0.70 0.50 ag i d9 5p2 ag i d9 5s9l 0.000E+00 ( //r2// )= 0.000E+00 a0 0.0000 0.000E+00 0.000 0.000 sqrtdel= 1.0000 0.000E+00 47 -1 0.70 0.50 ag i d9 5p2 ag i d9 5p2 1.983E+01 ( 5p//r2// 5p)=-2.172E+01 a0 1.0000 1.311E+02 1.000 1.000 sqrtdel= 1.0000 -2.172E+01 ag i d10 5p 26.42329 0.72286 0.00000 0.00000 0.00000 xr fact= 1.00 1.00 1.00 1.00 1.00 ag i d10 6p 43.88119 0.16642 0.00000 0.00000 0.00000 xr fact= 1.00 1.00 1.00 1.00 1.00 ag i d10 7p 49.27340 0.06572 0.00000 0.00000 0.00000 xr fact= 1.00 1.00 1.00 1.00 1.00 ag i d10 8p 51.73498 0.03273 0.00000 0.00000 0.00000 xr fact= 1.00 1.00 1.00 1.00 1.00 ag i d10 9p 53.06779 0.01865 0.00000 0.00000 0.00000 xr fact= 1.00 1.00 1.00 1.00 1.00 ag i d9 5s5p 57.23865 1.81118 1.04705 13.17862 12.99725 xr fact= 1.00 1.00 1.00 1.00 1.00 4.86614 3.92783 31.07454 ag i d9 5s6p 81.33552 1.81863 0.17158 2.02381 14.08784 xr fact= 1.00 1.00 1.00 1.00 1.00 0.68134 0.57603 3.10390 ag i d9 5s7p 87.50970 1.81960 0.06648 0.74845 14.16039 xr fact= 1.00 1.00 1.00 1.00 1.00 0.25439 0.21739 1.07502 ag i d9 5s8p 90.20218 1.81990 0.03297 0.36261 14.18105 xr fact= 1.00 1.00 1.00 1.00 1.00 0.12413 0.10657 0.50769 ag i d9 5s9p 91.63004 1.82003 0.01876 0.20373 14.18932 xr fact= 1.00 1.00 1.00 1.00 1.00 0.07005 0.06029 0.28144 ag i d8 5s2 5p 113.12112 76.10390 49.74159 1.93778 1.38626 xr fact= 1.00 1.00 1.00 1.00 1.00 15.31165 5.39743 4.51302 ag i d10 4f 49.19378 0.00005 0.00000 0.00000 0.00000 xr fact= 1.00 1.00 1.00 1.00 1.00 ag i d10 5f 51.67743 0.00002 0.00000 0.00000 0.00000 xr fact= 1.00 1.00 1.00 1.00 1.00 ag i d10 6f 53.02939 0.00001 0.00000 0.00000 0.00000 xr fact= 1.00 1.00 1.00 1.00 1.00 ag i d10 7f 53.84493 0.00001 0.00000 0.00000 0.00000 xr fact= 1.00 1.00 1.00 1.00 1.00 ag i d10 8f 54.37413 0.00001 0.00000 0.00000 0.00000 xr fact= 1.00 1.00 1.00 1.00 1.00 ag i d10 9f 54.73699 0.00000 0.00000 0.00000 0.00000 xr fact= 1.00 1.00 1.00 1.00 1.00 ag i d9 5s4f 87.81909 1.82021 0.00005 0.18074 0.00979 xr fact= 1.00 1.00 1.00 1.00 1.00 14.19718 0.00210 0.00116 0.00079 0.02501 ag i d9 5s5f 90.32431 1.82021 0.00003 0.09473 0.00676 xr fact= 1.00 1.00 1.00 1.00 1.00 14.19767 0.00197 0.00109 0.00074 0.02134 ag i d9 5s6f 91.68968 1.82021 0.00001 0.05587 0.00455 xr fact= 1.00 1.00 1.00 1.00 1.00 14.19827 0.00151 0.00084 0.00057 0.01562 ag i d9 5s7f 92.51310 1.82021 0.00001 0.03572 0.00314 xr fact= 1.00 1.00 1.00 1.00 1.00 14.19867 0.00113 0.00063 0.00042 0.01128 ag i d9 5s8f 93.04701 1.82021 0.00001 0.02423 0.00224 xr fact= 1.00 1.00 1.00 1.00 1.00 14.19892 0.00084 0.00047 0.00032 0.00826 ag i d9 5s9f 93.41285 1.82021 0.00000 0.01719 0.00165 xr fact= 1.00 1.00 1.00 1.00 1.00 14.19909 0.00064 0.00036 0.00024 0.00618 ag i d8 5s2 4f 152.21383 76.43543 49.98338 1.94565 0.00005 xr fact= 1.00 1.00 1.00 1.00 1.00 0.16846 0.00850 0.00194 0.00107 0.00073 ag i d10 6h 53.04791 0.00001 0.00000 0.00000 0.00000 xr fact= 1.00 1.00 1.00 1.00 1.00 ag i d10 7h 53.85781 0.00000 0.00000 0.00000 0.00000 xr fact= 1.00 1.00 1.00 1.00 1.00 ag i d10 8h 54.38281 0.00000 0.00000 0.00000 0.00000 xr fact= 1.00 1.00 1.00 1.00 1.00 ag i d10 9h 54.74350 0.00000 0.00000 0.00000 0.00000 xr fact= 1.00 1.00 1.00 1.00 1.00 ag i d9 5s6h 91.73132 1.82021 0.00001 0.01336 0.00009 xr fact= 1.00 1.00 1.00 1.00 1.00 14.19953 0.00000 0.00000 0.00000 0.00000 ag i d9 5s7h 92.54086 1.82021 0.00000 0.00841 0.00007 xr fact= 1.00 1.00 1.00 1.00 1.00 14.19952 0.00000 0.00000 0.00000 0.00000 ag i d9 5s8h 93.06588 1.82021 0.00000 0.00564 0.00005 xr fact= 1.00 1.00 1.00 1.00 1.00 14.19952 0.00000 0.00000 0.00000 0.00000 ag i d9 5s9h 93.42658 1.82021 0.00000 0.00396 0.00004 xr fact= 1.00 1.00 1.00 1.00 1.00 14.19952 0.00000 0.00000 0.00000 0.00000 ag i d10 8k 54.38289 0.00000 0.00000 0.00000 0.00000 xr fact= 1.00 1.00 1.00 1.00 1.00 ag i d10 9k 54.74320 0.00000 0.00000 0.00000 0.00000 xr fact= 1.00 1.00 1.00 1.00 1.00 ag i d9 5s8k 93.06603 1.82021 0.00000 0.00221 0.00000 xr fact= 1.00 1.00 1.00 1.00 1.00 14.19952 0.00000 0.00000 0.00000 0.00000 ag i d9 5s9k 93.42641 1.82021 0.00000 0.00156 0.00000 xr fact= 1.00 1.00 1.00 1.00 1.00 14.19952 0.00000 0.00000 0.00000 0.00000 rcn mod 32 ee,eee= -1.35132 -0.67566 ee,eee= -0.77274 -1.06203 slater integrals for ag i d10 5p nconf=42 z= 47 ion= 0 exf=0.650 irel= 1 ag i d9 5s5p nconf=47 kut=-1 corrf=0.000 class 0 k rdk( 4d, 4d, 4d, 5s) frac k rek( 4d, 4d, 4d, 5s) frac - ------------------------------------- ----- - ------------------------------------- ----- 2 -0.13130239 ryd = -14408.7707 cm-1 -0.480 2 -0.13130263 ryd = -14408.7979 cm-1 -0.480 ag i d10 5p -d9 5s5p 1 -14.4088 5 42 47 6 0.820 0.023 645.680 sec rcn mod 32 ee,eee= -0.28364 -0.14182 ee,eee= -0.35477 -0.31921 slater integrals for ag i d10 5p nconf=42 z= 47 ion= 0 exf=0.650 irel= 1 ag i d9 5s5p nconf=47 kut=-1 corrf=0.000 class 0 k rdk( 4d, 5p, 5s, 5p) frac k rek( 4d, 5p, 5s, 5p) frac - ------------------------------------- ----- - ------------------------------------- ----- 2 -0.10044976 ryd = -11023.0863 cm-1 -0.908 1 -0.09384393 ryd = -10298.1809 cm-1 -0.759 ag i d10 5p -d9 5s5p 2 -11.0231 5 -10.2982 5 42 47 6 0.195 0.016 645.891 sec sqrtdel= 1.0000 1.0000 -14.4088 -11.0231 -10.2982 rcn mod 32 ee,eee= -0.12369 -0.20366 slater integrals for ag i d10 5p nconf=42 z= 47 ion= 0 exf=0.650 irel= 1 ag i d9 5s6p nconf=48 kut=-1 corrf=0.000 class 0 k rdk( 4d, 5p, 5s, 6p) frac k rek( 4d, 5p, 5s, 6p) frac - ------------------------------------- ----- - ------------------------------------- ----- 2 -0.02722732 ryd = -2987.8529 cm-1 -0.703 1 -0.03246006 ryd = -3562.0802 cm-1 -0.718 ag i d10 5p -d9 5s6p 2 -2.9879 5 -3.5621 5 42 48 1 0.141 0.023 646.070 sec sqrtdel= 1.0000 1.0000 -2.9879 -3.5621 rcn mod 32 ee,eee= -0.06669 -0.17516 slater integrals for ag i d10 5p nconf=42 z= 47 ion= 0 exf=0.650 irel= 1 ag i d9 5s7p nconf=49 kut=-1 corrf=0.000 class 0 k rdk( 4d, 5p, 5s, 7p) frac k rek( 4d, 5p, 5s, 7p) frac - ------------------------------------- ----- - ------------------------------------- ----- 2 -0.01540422 ryd = -1690.4179 cm-1 -0.661 1 -0.01942129 ryd = -2131.2399 cm-1 -0.706 ag i d10 5p -d9 5s7p 2 -1.6904 5 -2.1312 5 42 49 1 0.156 0.016 646.242 sec sqrtdel= 1.0000 1.0000 -1.6904 -2.1312 rcn mod 32 ee,eee= -0.04193 -0.16278 slater integrals for ag i d10 5p nconf=42 z= 47 ion= 0 exf=0.650 irel= 1 ag i d9 5s8p nconf=50 kut=-1 corrf=0.000 class 0 k rdk( 4d, 5p, 5s, 8p) frac k rek( 4d, 5p, 5s, 8p) frac - ------------------------------------- ----- - ------------------------------------- ----- 2 -0.01039974 ryd = -1141.2400 cm-1 -0.642 1 -0.01343846 ryd = -1474.7008 cm-1 -0.700 ag i d10 5p -d9 5s8p 2 -1.1412 5 -1.4747 5 42 50 1 0.141 0.023 646.414 sec sqrtdel= 1.0000 1.0000 -1.1412 -1.4747 rcn mod 32 ee,eee= -0.02883 -0.15624 slater integrals for ag i d10 5p nconf=42 z= 47 ion= 0 exf=0.650 irel= 1 ag i d9 5s9p nconf=51 kut=-1 corrf=0.000 class 0 k rdk( 4d, 5p, 5s, 9p) frac k rek( 4d, 5p, 5s, 9p) frac - ------------------------------------- ----- - ------------------------------------- ----- 2 -0.00766721 ryd = -841.3794 cm-1 -0.632 1 -0.01004238 ryd = -1102.0241 cm-1 -0.697 ag i d10 5p -d9 5s9p 2 -0.8414 5 -1.1020 5 42 51 1 0.172 0.117 646.703 sec sqrtdel= 1.0000 1.0000 -0.8414 -1.1020 rcn mod 32 ee,eee= -1.35132 -0.67566 ee,eee= -0.82593 -1.08863 slater integrals for ag i d10 5p nconf=42 z= 47 ion= 0 exf=0.650 irel= 1 ag i d8 5s2 5p nconf=52 kut=-1 corrf=0.000 class 0 k rdk( 4d, 4d, 5s, 5s) frac k rek( 4d, 4d, 5s, 5s) frac - ------------------------------------- ----- - ------------------------------------- ----- 2 0.14480165 ryd = 15890.1433 cm-1 0.787 2 0.14480165 ryd = 15890.1433 cm-1 0.787 ag i d10 5p -d8 5s2 5p 1 15.8901 5 42 52 11 0.859 0.039 647.602 sec sqrtdel= 1.0000 1.0000 15.8901 rcn mod 32 ee,eee= -0.28364 -0.14182 ee,eee= -0.06339 -0.17351 slater integrals for ag i d10 5p nconf=42 z= 47 ion= 0 exf=0.650 irel= 1 ag i d9 5s4f nconf=59 kut=-1 corrf=0.000 class 0 k rdk( 4d, 5p, 5s, 4f) frac k rek( 4d, 5p, 5s, 4f) frac - ------------------------------------- ----- - ------------------------------------- ----- 2 0.00521964 ryd = 572.7889 cm-1 0.954 1 0.00250219 ryd = 274.5832 cm-1 0.998 ag i d10 5p -d9 5s4f 2 0.5728 5 0.2746 5 42 59 18 1.242 0.023 648.930 sec sqrtdel= 1.0000 1.0000 0.5728 0.2746 rcn mod 32 ee,eee= -0.04058 -0.16211 slater integrals for ag i d10 5p nconf=42 z= 47 ion= 0 exf=0.650 irel= 1 ag i d9 5s5f nconf=60 kut=-1 corrf=0.000 class 0 k rdk( 4d, 5p, 5s, 5f) frac k rek( 4d, 5p, 5s, 5f) frac - ------------------------------------- ----- - ------------------------------------- ----- 2 0.00469231 ryd = 514.9216 cm-1 0.954 1 0.00239811 ryd = 263.1625 cm-1 0.998 ag i d10 5p -d9 5s5f 2 0.5149 5 0.2632 5 42 60 1 0.281 0.031 649.242 sec sqrtdel= 1.0000 1.0000 0.5149 0.2632 rcn mod 32 ee,eee= -0.02815 -0.15590 slater integrals for ag i d10 5p nconf=42 z= 47 ion= 0 exf=0.650 irel= 1 ag i d9 5s6f nconf=61 kut=-1 corrf=0.000 class 0 k rdk( 4d, 5p, 5s, 6f) frac k rek( 4d, 5p, 5s, 6f) frac - ------------------------------------- ----- - ------------------------------------- ----- 2 0.00395775 ryd = 434.3123 cm-1 0.953 1 0.00209182 ryd = 229.5510 cm-1 0.998 ag i d10 5p -d9 5s6f 2 0.4343 5 0.2296 5 42 61 1 0.242 0.031 649.516 sec sqrtdel= 1.0000 1.0000 0.4343 0.2296 rcn mod 32 ee,eee= -0.02066 -0.15215 slater integrals for ag i d10 5p nconf=42 z= 47 ion= 0 exf=0.650 irel= 1 ag i d9 5s7f nconf=62 kut=-1 corrf=0.000 class 0 k rdk( 4d, 5p, 5s, 7f) frac k rek( 4d, 5p, 5s, 7f) frac - ------------------------------------- ----- - ------------------------------------- ----- 2 0.00333329 ryd = 365.7864 cm-1 0.952 1 0.00179829 ryd = 197.3395 cm-1 0.998 ag i d10 5p -d9 5s7f 2 0.3658 5 0.1973 5 42 62 1 0.141 0.016 649.672 sec sqrtdel= 1.0000 1.0000 0.3658 0.1973 rcn mod 32 ee,eee= -0.01580 -0.14972 slater integrals for ag i d10 5p nconf=42 z= 47 ion= 0 exf=0.650 irel= 1 ag i d9 5s8f nconf=63 kut=-1 corrf=0.000 class 0 k rdk( 4d, 5p, 5s, 8f) frac k rek( 4d, 5p, 5s, 8f) frac - ------------------------------------- ----- - ------------------------------------- ----- 2 0.00283639 ryd = 311.2577 cm-1 0.952 1 0.00155137 ryd = 170.2429 cm-1 0.998 ag i d10 5p -d9 5s8f 2 0.3113 5 0.1702 5 42 63 1 0.141 0.023 649.844 sec sqrtdel= 1.0000 1.0000 0.3113 0.1702 rcn mod 32 ee,eee= -0.01247 -0.14805 slater integrals for ag i d10 5p nconf=42 z= 47 ion= 0 exf=0.650 irel= 1 ag i d9 5s9f nconf=64 kut=-1 corrf=0.000 class 0 k rdk( 4d, 5p, 5s, 9f) frac k rek( 4d, 5p, 5s, 9f) frac - ------------------------------------- ----- - ------------------------------------- ----- 2 0.00244328 ryd = 268.1189 cm-1 0.952 1 0.00134950 ryd = 148.0909 cm-1 0.998 ag i d10 5p -d9 5s9f 2 0.2681 5 0.1481 5 42 64 1 0.148 0.023 650.016 sec sqrtdel= 1.0000 1.0000 0.2681 0.1481 rcn mod 32 ee,eee= -0.11368 -0.05684 ee,eee= -0.35477 -0.23423 slater integrals for ag i d10 6p nconf=43 z= 47 ion= 0 exf=0.650 irel= 1 ag i d9 5s5p nconf=47 kut=-1 corrf=0.000 class 0 k rdk( 4d, 6p, 5s, 5p) frac k rek( 4d, 6p, 5s, 5p) frac - ------------------------------------- ----- - ------------------------------------- ----- 2 -0.03595941 ryd = -3946.0888 cm-1 -0.816 1 -0.03581900 ryd = -3930.6803 cm-1 -0.711 ag i d10 6p -d9 5s5p 2 -3.9461 5 -3.9307 5 43 47 6 0.172 0.016 650.250 sec sqrtdel= 1.0000 1.0000 -3.9461 -3.9307 rcn mod 32 ee,eee= -1.60816 -0.80408 ee,eee= -1.01220 -1.31018 slater integrals for ag i d10 6p nconf=43 z= 47 ion= 0 exf=0.650 irel= 1 ag i d9 5s6p nconf=48 kut=-1 corrf=0.000 class 0 k rdk( 4d, 4d, 4d, 5s) frac k rek( 4d, 4d, 4d, 5s) frac - ------------------------------------- ----- - ------------------------------------- ----- 2 -0.13719599 ryd = -15055.5193 cm-1 -0.476 2 -0.13719626 ryd = -15055.5482 cm-1 -0.476 ag i d10 6p -d9 5s6p 1 -15.0555 5 43 48 7 0.266 0.055 650.586 sec rcn mod 32 ee,eee= -0.11368 -0.05684 ee,eee= -0.12369 -0.11868 slater integrals for ag i d10 6p nconf=43 z= 47 ion= 0 exf=0.650 irel= 1 ag i d9 5s6p nconf=48 kut=-1 corrf=0.000 class 0 k rdk( 4d, 6p, 5s, 6p) frac k rek( 4d, 6p, 5s, 6p) frac - ------------------------------------- ----- - ------------------------------------- ----- 2 -0.01737658 ryd = -1906.8591 cm-1 -0.897 1 -0.01304081 ryd = -1431.0635 cm-1 -0.691 ag i d10 6p -d9 5s6p 2 -1.9069 5 -1.4311 5 43 48 7 0.195 0.070 650.852 sec sqrtdel= 1.0000 1.0000 -15.0555 -1.9069 -1.4311 rcn mod 32 ee,eee= -1.60816 -0.80408 ee,eee= -1.09662 -1.35239 slater integrals for ag i d10 6p nconf=43 z= 47 ion= 0 exf=0.650 irel= 1 ag i d9 5s7p nconf=49 kut=-1 corrf=0.000 class 0 k rdk( 4d, 4d, 4d, 5s) frac k rek( 4d, 4d, 4d, 5s) frac - ------------------------------------- ----- - ------------------------------------- ----- 2 0.00000000 ryd = 0.0000 cm-1 0.000 2 0.00000000 ryd = 0.0000 cm-1 0.000 ag i d10 6p -d9 5s7p 1 0.0000 5 43 49 8 0.219 0.008 651.094 sec rcn mod 32 ee,eee= -0.11368 -0.05684 ee,eee= -0.06669 -0.09018 slater integrals for ag i d10 6p nconf=43 z= 47 ion= 0 exf=0.650 irel= 1 ag i d9 5s7p nconf=49 kut=-1 corrf=0.000 class 0 k rdk( 4d, 6p, 5s, 7p) frac k rek( 4d, 6p, 5s, 7p) frac - ------------------------------------- ----- - ------------------------------------- ----- 2 -0.00922514 ryd = -1012.3420 cm-1 -0.828 1 -0.00786128 ryd = -862.6760 cm-1 -0.683 ag i d10 6p -d9 5s7p 2 -1.0123 5 -0.8627 5 43 49 8 0.547 0.109 651.750 sec sqrtdel= 1.0000 1.0000 0.0000 -1.0123 -0.8627 rcn mod 32 ee,eee= -1.60816 -0.80408 ee,eee= -1.13660 -1.37238 slater integrals for ag i d10 6p nconf=43 z= 47 ion= 0 exf=0.650 irel= 1 ag i d9 5s8p nconf=50 kut=-1 corrf=0.000 class 0 k rdk( 4d, 4d, 4d, 5s) frac k rek( 4d, 4d, 4d, 5s) frac - ------------------------------------- ----- - ------------------------------------- ----- 2 0.00000000 ryd = 0.0000 cm-1 0.000 2 0.00000000 ryd = 0.0000 cm-1 0.000 ag i d10 6p -d9 5s8p 1 0.0000 5 43 50 9 0.711 0.031 652.492 sec rcn mod 32 ee,eee= -0.11368 -0.05684 ee,eee= -0.04193 -0.07780 slater integrals for ag i d10 6p nconf=43 z= 47 ion= 0 exf=0.650 irel= 1 ag i d9 5s8p nconf=50 kut=-1 corrf=0.000 class 0 k rdk( 4d, 6p, 5s, 8p) frac k rek( 4d, 6p, 5s, 8p) frac - ------------------------------------- ----- - ------------------------------------- ----- 2 -0.00616112 ryd = -676.1051 cm-1 -0.807 1 -0.00545613 ryd = -598.7415 cm-1 -0.679 ag i d10 6p -d9 5s8p 2 -0.6761 5 -0.5987 5 43 50 9 0.250 0.023 652.766 sec sqrtdel= 1.0000 1.0000 0.0000 -0.6761 -0.5987 rcn mod 32 ee,eee= -1.60816 -0.80408 ee,eee= -1.15874 -1.38345 slater integrals for ag i d10 6p nconf=43 z= 47 ion= 0 exf=0.650 irel= 1 ag i d9 5s9p nconf=51 kut=-1 corrf=0.000 class 0 k rdk( 4d, 4d, 4d, 5s) frac k rek( 4d, 4d, 4d, 5s) frac - ------------------------------------- ----- - ------------------------------------- ----- 2 0.00000000 ryd = 0.0000 cm-1 0.000 2 0.00000000 ryd = 0.0000 cm-1 0.000 ag i d10 6p -d9 5s9p 1 0.0000 5 43 51 10 0.289 0.008 653.063 sec rcn mod 32 ee,eee= -0.11368 -0.05684 ee,eee= -0.02883 -0.07126 slater integrals for ag i d10 6p nconf=43 z= 47 ion= 0 exf=0.650 irel= 1 ag i d9 5s9p nconf=51 kut=-1 corrf=0.000 class 0 k rdk( 4d, 6p, 5s, 9p) frac k rek( 4d, 6p, 5s, 9p) frac - ------------------------------------- ----- - ------------------------------------- ----- 2 -0.00452490 ryd = -496.5508 cm-1 -0.796 1 -0.00408374 ryd = -448.1391 cm-1 -0.676 ag i d10 6p -d9 5s9p 2 -0.4966 5 -0.4481 5 43 51 10 0.414 0.016 653.492 sec sqrtdel= 1.0000 1.0000 0.0000 -0.4966 -0.4481 rcn mod 32 ee,eee= -0.06339 -0.08853 slater integrals for ag i d10 6p nconf=43 z= 47 ion= 0 exf=0.650 irel= 1 ag i d9 5s4f nconf=59 kut=-1 corrf=0.000 class 0 k rdk( 4d, 6p, 5s, 4f) frac k rek( 4d, 6p, 5s, 4f) frac - ------------------------------------- ----- - ------------------------------------- ----- 2 -0.00172388 ryd = -189.1738 cm-1 -0.441 1 0.00092386 ryd = 101.3819 cm-1 0.963 ag i d10 6p -d9 5s4f 2 -0.1892 5 0.1014 5 43 59 8 0.195 0.023 653.734 sec sqrtdel= 1.0000 1.0000 -0.1892 0.1014 rcn mod 32 ee,eee= -0.04058 -0.07713 slater integrals for ag i d10 6p nconf=43 z= 47 ion= 0 exf=0.650 irel= 1 ag i d9 5s5f nconf=60 kut=-1 corrf=0.000 class 0 k rdk( 4d, 6p, 5s, 5f) frac k rek( 4d, 6p, 5s, 5f) frac - ------------------------------------- ----- - ------------------------------------- ----- 2 -0.00083696 ryd = -91.8452 cm-1 -0.284 1 0.00089096 ryd = 97.7718 cm-1 0.964 ag i d10 6p -d9 5s5f 2 -0.0918 5 0.0978 5 43 60 1 0.031 0.023 653.797 sec sqrtdel= 1.0000 1.0000 -0.0918 0.0978 rcn mod 32 ee,eee= -0.02815 -0.07092 slater integrals for ag i d10 6p nconf=43 z= 47 ion= 0 exf=0.650 irel= 1 ag i d9 5s6f nconf=61 kut=-1 corrf=0.000 class 0 k rdk( 4d, 6p, 5s, 6f) frac k rek( 4d, 6p, 5s, 6f) frac - ------------------------------------- ----- - ------------------------------------- ----- 2 -0.00045099 ryd = -49.4906 cm-1 -0.195 1 0.00077968 ryd = 85.5605 cm-1 0.965 ag i d10 6p -d9 5s6f 2 -0.0495 5 0.0856 5 43 61 1 0.023 0.023 653.844 sec sqrtdel= 1.0000 1.0000 -0.0495 0.0856 rcn mod 32 ee,eee= -0.02066 -0.06717 slater integrals for ag i d10 6p nconf=43 z= 47 ion= 0 exf=0.650 irel= 1 ag i d9 5s7f nconf=62 kut=-1 corrf=0.000 class 0 k rdk( 4d, 6p, 5s, 7f) frac k rek( 4d, 6p, 5s, 7f) frac - ------------------------------------- ----- - ------------------------------------- ----- 2 -0.00026328 ryd = -28.8920 cm-1 -0.141 1 0.00067160 ryd = 73.6991 cm-1 0.965 ag i d10 6p -d9 5s7f 2 -0.0289 5 0.0737 5 43 62 1 0.031 0.047 653.930 sec sqrtdel= 1.0000 1.0000 -0.0289 0.0737 rcn mod 32 ee,eee= -0.01580 -0.06474 slater integrals for ag i d10 6p nconf=43 z= 47 ion= 0 exf=0.650 irel= 1 ag i d9 5s8f nconf=63 kut=-1 corrf=0.000 class 0 k rdk( 4d, 6p, 5s, 8f) frac k rek( 4d, 6p, 5s, 8f) frac - ------------------------------------- ----- - ------------------------------------- ----- 2 -0.00016252 ryd = -17.8343 cm-1 -0.105 1 0.00058014 ryd = 63.6628 cm-1 0.966 ag i d10 6p -d9 5s8f 2 -0.0178 5 0.0637 5 43 63 1 0.031 0.016 654.000 sec sqrtdel= 1.0000 1.0000 -0.0178 0.0637 rcn mod 32 ee,eee= -0.01247 -0.06307 slater integrals for ag i d10 6p nconf=43 z= 47 ion= 0 exf=0.650 irel= 1 ag i d9 5s9f nconf=64 kut=-1 corrf=0.000 class 0 k rdk( 4d, 6p, 5s, 9f) frac k rek( 4d, 6p, 5s, 9f) frac - ------------------------------------- ----- - ------------------------------------- ----- 2 -0.00010419 ryd = -11.4331 cm-1 -0.079 1 0.00050512 ryd = 55.4306 cm-1 0.966 ag i d10 6p -d9 5s9f 2 -0.0114 5 0.0554 5 43 64 1 0.016 0.031 654.063 sec sqrtdel= 1.0000 1.0000 -0.0114 0.0554 rcn mod 32 ee,eee= -0.06306 -0.03153 ee,eee= -0.35477 -0.20892 slater integrals for ag i d10 7p nconf=44 z= 47 ion= 0 exf=0.650 irel= 1 ag i d9 5s5p nconf=47 kut=-1 corrf=0.000 class 0 k rdk( 4d, 7p, 5s, 5p) frac k rek( 4d, 7p, 5s, 5p) frac - ------------------------------------- ----- - ------------------------------------- ----- 2 -0.02077874 ryd = -2280.2031 cm-1 -0.783 1 -0.02101087 ryd = -2305.6760 cm-1 -0.690 ag i d10 7p -d9 5s5p 2 -2.2802 5 -2.3057 5 44 47 6 0.414 0.016 654.547 sec sqrtdel= 1.0000 1.0000 -2.2802 -2.3057 rcn mod 32 ee,eee= -1.69434 -0.84717 ee,eee= -1.01220 -1.35327 slater integrals for ag i d10 7p nconf=44 z= 47 ion= 0 exf=0.650 irel= 1 ag i d9 5s6p nconf=48 kut=-1 corrf=0.000 class 0 k rdk( 4d, 4d, 4d, 5s) frac k rek( 4d, 4d, 4d, 5s) frac - ------------------------------------- ----- - ------------------------------------- ----- 2 0.00000000 ryd = 0.0000 cm-1 0.000 2 0.00000000 ryd = 0.0000 cm-1 0.000 ag i d10 7p -d9 5s6p 1 0.0000 5 44 48 7 0.195 0.016 654.766 sec rcn mod 32 ee,eee= -0.06306 -0.03153 ee,eee= -0.12369 -0.09338 slater integrals for ag i d10 7p nconf=44 z= 47 ion= 0 exf=0.650 irel= 1 ag i d9 5s6p nconf=48 kut=-1 corrf=0.000 class 0 k rdk( 4d, 7p, 5s, 6p) frac k rek( 4d, 7p, 5s, 6p) frac - ------------------------------------- ----- - ------------------------------------- ----- 2 -0.00990517 ryd = -1086.9665 cm-1 -0.858 1 -0.00775119 ryd = -850.5952 cm-1 -0.677 ag i d10 7p -d9 5s6p 2 -1.0870 5 -0.8506 5 44 48 7 0.227 0.031 655.023 sec sqrtdel= 1.0000 1.0000 0.0000 -1.0870 -0.8506 rcn mod 32 ee,eee= -1.69434 -0.84717 ee,eee= -1.09662 -1.39548 slater integrals for ag i d10 7p nconf=44 z= 47 ion= 0 exf=0.650 irel= 1 ag i d9 5s7p nconf=49 kut=-1 corrf=0.000 class 0 k rdk( 4d, 4d, 4d, 5s) frac k rek( 4d, 4d, 4d, 5s) frac - ------------------------------------- ----- - ------------------------------------- ----- 2 -0.13753684 ryd = -15092.9230 cm-1 -0.475 2 -0.13753711 ryd = -15092.9520 cm-1 -0.476 ag i d10 7p -d9 5s7p 1 -15.0929 5 44 49 8 0.219 0.023 655.266 sec rcn mod 32 ee,eee= -0.06306 -0.03153 ee,eee= -0.06669 -0.06487 slater integrals for ag i d10 7p nconf=44 z= 47 ion= 0 exf=0.650 irel= 1 ag i d9 5s7p nconf=49 kut=-1 corrf=0.000 class 0 k rdk( 4d, 7p, 5s, 7p) frac k rek( 4d, 7p, 5s, 7p) frac - ------------------------------------- ----- - ------------------------------------- ----- 2 -0.00636975 ryd = -698.9989 cm-1 -0.893 1 -0.00468132 ryd = -513.7154 cm-1 -0.670 ag i d10 7p -d9 5s7p 2 -0.6990 5 -0.5137 5 44 49 8 0.219 0.023 655.664 sec sqrtdel= 1.0000 1.0000 -15.0929 -0.6990 -0.5137 rcn mod 32 ee,eee= -1.69434 -0.84717 ee,eee= -1.13660 -1.41547 slater integrals for ag i d10 7p nconf=44 z= 47 ion= 0 exf=0.650 irel= 1 ag i d9 5s8p nconf=50 kut=-1 corrf=0.000 class 0 k rdk( 4d, 4d, 4d, 5s) frac k rek( 4d, 4d, 4d, 5s) frac - ------------------------------------- ----- - ------------------------------------- ----- 2 0.00000000 ryd = 0.0000 cm-1 0.000 2 0.00000000 ryd = 0.0000 cm-1 0.000 ag i d10 7p -d9 5s8p 1 0.0000 5 44 50 9 0.289 0.008 655.961 sec rcn mod 32 ee,eee= -0.06306 -0.03153 ee,eee= -0.04193 -0.05250 slater integrals for ag i d10 7p nconf=44 z= 47 ion= 0 exf=0.650 irel= 1 ag i d9 5s8p nconf=50 kut=-1 corrf=0.000 class 0 k rdk( 4d, 7p, 5s, 8p) frac k rek( 4d, 7p, 5s, 8p) frac - ------------------------------------- ----- - ------------------------------------- ----- 2 -0.00415359 ryd = -455.8040 cm-1 -0.861 1 -0.00325154 ryd = -356.8153 cm-1 -0.666 ag i d10 7p -d9 5s8p 2 -0.4558 5 -0.3568 5 44 50 9 0.336 0.008 656.305 sec sqrtdel= 1.0000 1.0000 0.0000 -0.4558 -0.3568 rcn mod 32 ee,eee= -1.69434 -0.84717 ee,eee= -1.15874 -1.42654 slater integrals for ag i d10 7p nconf=44 z= 47 ion= 0 exf=0.650 irel= 1 ag i d9 5s9p nconf=51 kut=-1 corrf=0.000 class 0 k rdk( 4d, 4d, 4d, 5s) frac k rek( 4d, 4d, 4d, 5s) frac - ------------------------------------- ----- - ------------------------------------- ----- 2 0.00000000 ryd = 0.0000 cm-1 0.000 2 0.00000000 ryd = 0.0000 cm-1 0.000 ag i d10 7p -d9 5s9p 1 0.0000 5 44 51 10 0.594 0.039 656.945 sec rcn mod 32 ee,eee= -0.06306 -0.03153 ee,eee= -0.02883 -0.04595 slater integrals for ag i d10 7p nconf=44 z= 47 ion= 0 exf=0.650 irel= 1 ag i d9 5s9p nconf=51 kut=-1 corrf=0.000 class 0 k rdk( 4d, 7p, 5s, 9p) frac k rek( 4d, 7p, 5s, 9p) frac - ------------------------------------- ----- - ------------------------------------- ----- 2 -0.00303762 ryd = -333.3405 cm-1 -0.849 1 -0.00243464 ryd = -267.1704 cm-1 -0.664 ag i d10 7p -d9 5s9p 2 -0.3333 5 -0.2672 5 44 51 10 0.273 0.039 657.266 sec sqrtdel= 1.0000 1.0000 0.0000 -0.3333 -0.2672 rcn mod 32 ee,eee= -0.06339 -0.06322 slater integrals for ag i d10 7p nconf=44 z= 47 ion= 0 exf=0.650 irel= 1 ag i d9 5s4f nconf=59 kut=-1 corrf=0.000 class 0 k rdk( 4d, 7p, 5s, 4f) frac k rek( 4d, 7p, 5s, 4f) frac - ------------------------------------- ----- - ------------------------------------- ----- 2 -0.00020904 ryd = -22.9390 cm-1 -0.093 1 0.00053914 ryd = 59.1636 cm-1 0.940 ag i d10 7p -d9 5s4f 2 -0.0229 5 0.0592 5 44 59 8 0.195 0.023 657.516 sec sqrtdel= 1.0000 1.0000 -0.0229 0.0592 rcn mod 32 ee,eee= -0.04058 -0.05182 slater integrals for ag i d10 7p nconf=44 z= 47 ion= 0 exf=0.650 irel= 1 ag i d9 5s5f nconf=60 kut=-1 corrf=0.000 class 0 k rdk( 4d, 7p, 5s, 5f) frac k rek( 4d, 7p, 5s, 5f) frac - ------------------------------------- ----- - ------------------------------------- ----- 2 -0.00050334 ryd = -55.2354 cm-1 -0.289 1 0.00052069 ryd = 57.1386 cm-1 0.942 ag i d10 7p -d9 5s5f 2 -0.0552 5 0.0571 5 44 60 1 0.031 0.016 657.563 sec sqrtdel= 1.0000 1.0000 -0.0552 0.0571 rcn mod 32 ee,eee= -0.02815 -0.04561 slater integrals for ag i d10 7p nconf=44 z= 47 ion= 0 exf=0.650 irel= 1 ag i d9 5s6f nconf=61 kut=-1 corrf=0.000 class 0 k rdk( 4d, 7p, 5s, 6f) frac k rek( 4d, 7p, 5s, 6f) frac - ------------------------------------- ----- - ------------------------------------- ----- 2 -0.00037812 ryd = -41.4933 cm-1 -0.270 1 0.00045599 ryd = 50.0391 cm-1 0.943 ag i d10 7p -d9 5s6f 2 -0.0415 5 0.0500 5 44 61 1 0.039 0.023 657.625 sec sqrtdel= 1.0000 1.0000 -0.0415 0.0500 rcn mod 32 ee,eee= -0.02066 -0.04186 slater integrals for ag i d10 7p nconf=44 z= 47 ion= 0 exf=0.650 irel= 1 ag i d9 5s7f nconf=62 kut=-1 corrf=0.000 class 0 k rdk( 4d, 7p, 5s, 7f) frac k rek( 4d, 7p, 5s, 7f) frac - ------------------------------------- ----- - ------------------------------------- ----- 2 -0.00027986 ryd = -30.7107 cm-1 -0.244 1 0.00039295 ryd = 43.1213 cm-1 0.943 ag i d10 7p -d9 5s7f 2 -0.0307 5 0.0431 5 44 62 1 0.055 0.031 657.711 sec sqrtdel= 1.0000 1.0000 -0.0307 0.0431 rcn mod 32 ee,eee= -0.01580 -0.03943 slater integrals for ag i d10 7p nconf=44 z= 47 ion= 0 exf=0.650 irel= 1 ag i d9 5s8f nconf=63 kut=-1 corrf=0.000 class 0 k rdk( 4d, 7p, 5s, 8f) frac k rek( 4d, 7p, 5s, 8f) frac - ------------------------------------- ----- - ------------------------------------- ----- 2 -0.00021355 ryd = -23.4349 cm-1 -0.222 1 0.00033954 ryd = 37.2602 cm-1 0.943 ag i d10 7p -d9 5s8f 2 -0.0234 5 0.0373 5 44 63 1 0.031 0.023 657.766 sec sqrtdel= 1.0000 1.0000 -0.0234 0.0373 rcn mod 32 ee,eee= -0.01247 -0.03777 slater integrals for ag i d10 7p nconf=44 z= 47 ion= 0 exf=0.650 irel= 1 ag i d9 5s9f nconf=64 kut=-1 corrf=0.000 class 0 k rdk( 4d, 7p, 5s, 9f) frac k rek( 4d, 7p, 5s, 9f) frac - ------------------------------------- ----- - ------------------------------------- ----- 2 -0.00016823 ryd = -18.4608 cm-1 -0.206 1 0.00029570 ryd = 32.4489 cm-1 0.944 ag i d10 7p -d9 5s9f 2 -0.0185 5 0.0324 5 44 64 1 0.039 0.016 657.820 sec sqrtdel= 1.0000 1.0000 -0.0185 0.0324 rcn mod 32 ee,eee= -0.04018 -0.02009 ee,eee= -0.35477 -0.19748 slater integrals for ag i d10 8p nconf=45 z= 47 ion= 0 exf=0.650 irel= 1 ag i d9 5s5p nconf=47 kut=-1 corrf=0.000 class 0 k rdk( 4d, 8p, 5s, 5p) frac k rek( 4d, 8p, 5s, 5p) frac - ------------------------------------- ----- - ------------------------------------- ----- 2 -0.01411971 ryd = -1549.4588 cm-1 -0.767 1 -0.01437087 ryd = -1577.0201 cm-1 -0.679 ag i d10 8p -d9 5s5p 2 -1.5495 5 -1.5770 5 45 47 6 0.164 0.023 658.055 sec sqrtdel= 1.0000 1.0000 -1.5495 -1.5770 rcn mod 32 ee,eee= -1.73471 -0.86736 ee,eee= -1.01220 -1.37346 slater integrals for ag i d10 8p nconf=45 z= 47 ion= 0 exf=0.650 irel= 1 ag i d9 5s6p nconf=48 kut=-1 corrf=0.000 class 0 k rdk( 4d, 4d, 4d, 5s) frac k rek( 4d, 4d, 4d, 5s) frac - ------------------------------------- ----- - ------------------------------------- ----- 2 0.00000000 ryd = 0.0000 cm-1 0.000 2 0.00000000 ryd = 0.0000 cm-1 0.000 ag i d10 8p -d9 5s6p 1 0.0000 5 45 48 7 0.188 0.023 658.266 sec rcn mod 32 ee,eee= -0.04018 -0.02009 ee,eee= -0.12369 -0.08194 slater integrals for ag i d10 8p nconf=45 z= 47 ion= 0 exf=0.650 irel= 1 ag i d9 5s6p nconf=48 kut=-1 corrf=0.000 class 0 k rdk( 4d, 8p, 5s, 6p) frac k rek( 4d, 8p, 5s, 6p) frac - ------------------------------------- ----- - ------------------------------------- ----- 2 -0.00673780 ryd = -739.3876 cm-1 -0.843 1 -0.00533245 ryd = -585.1685 cm-1 -0.670 ag i d10 8p -d9 5s6p 2 -0.7394 5 -0.5852 5 45 48 7 0.195 0.055 658.516 sec sqrtdel= 1.0000 1.0000 0.0000 -0.7394 -0.5852 rcn mod 32 ee,eee= -1.73471 -0.86736 ee,eee= -1.09662 -1.41567 slater integrals for ag i d10 8p nconf=45 z= 47 ion= 0 exf=0.650 irel= 1 ag i d9 5s7p nconf=49 kut=-1 corrf=0.000 class 0 k rdk( 4d, 4d, 4d, 5s) frac k rek( 4d, 4d, 4d, 5s) frac - ------------------------------------- ----- - ------------------------------------- ----- 2 0.00000000 ryd = 0.0000 cm-1 0.000 2 0.00000000 ryd = 0.0000 cm-1 0.000 ag i d10 8p -d9 5s7p 1 0.0000 5 45 49 8 0.750 0.031 659.297 sec rcn mod 32 ee,eee= -0.04018 -0.02009 ee,eee= -0.06669 -0.05343 slater integrals for ag i d10 8p nconf=45 z= 47 ion= 0 exf=0.650 irel= 1 ag i d9 5s7p nconf=49 kut=-1 corrf=0.000 class 0 k rdk( 4d, 8p, 5s, 7p) frac k rek( 4d, 8p, 5s, 7p) frac - ------------------------------------- ----- - ------------------------------------- ----- 2 -0.00430378 ryd = -472.2850 cm-1 -0.874 1 -0.00322315 ryd = -353.6996 cm-1 -0.663 ag i d10 8p -d9 5s7p 2 -0.4723 5 -0.3537 5 45 49 8 0.219 0.016 659.531 sec sqrtdel= 1.0000 1.0000 0.0000 -0.4723 -0.3537 rcn mod 32 ee,eee= -1.73471 -0.86736 ee,eee= -1.13660 -1.43566 slater integrals for ag i d10 8p nconf=45 z= 47 ion= 0 exf=0.650 irel= 1 ag i d9 5s8p nconf=50 kut=-1 corrf=0.000 class 0 k rdk( 4d, 4d, 4d, 5s) frac k rek( 4d, 4d, 4d, 5s) frac - ------------------------------------- ----- - ------------------------------------- ----- 2 -0.13763082 ryd = -15103.2364 cm-1 -0.475 2 -0.13763109 ryd = -15103.2654 cm-1 -0.475 ag i d10 8p -d9 5s8p 1 -15.1032 5 45 50 9 0.336 0.117 660.000 sec rcn mod 32 ee,eee= -0.04018 -0.02009 ee,eee= -0.04193 -0.04106 slater integrals for ag i d10 8p nconf=45 z= 47 ion= 0 exf=0.650 irel= 1 ag i d9 5s8p nconf=50 kut=-1 corrf=0.000 class 0 k rdk( 4d, 8p, 5s, 8p) frac k rek( 4d, 8p, 5s, 8p) frac - ------------------------------------- ----- - ------------------------------------- ----- 2 -0.00306438 ryd = -336.2767 cm-1 -0.891 1 -0.00223947 ryd = -245.7532 cm-1 -0.660 ag i d10 8p -d9 5s8p 2 -0.3363 5 -0.2458 5 45 50 9 0.375 0.031 660.406 sec sqrtdel= 1.0000 1.0000 -15.1032 -0.3363 -0.2458 rcn mod 32 ee,eee= -1.73471 -0.86736 ee,eee= -1.15874 -1.44673 slater integrals for ag i d10 8p nconf=45 z= 47 ion= 0 exf=0.650 irel= 1 ag i d9 5s9p nconf=51 kut=-1 corrf=0.000 class 0 k rdk( 4d, 4d, 4d, 5s) frac k rek( 4d, 4d, 4d, 5s) frac - ------------------------------------- ----- - ------------------------------------- ----- 2 0.00000000 ryd = 0.0000 cm-1 0.000 2 0.00000000 ryd = 0.0000 cm-1 0.000 ag i d10 8p -d9 5s9p 1 0.0000 5 45 51 10 0.438 0.008 660.852 sec rcn mod 32 ee,eee= -0.04018 -0.02009 ee,eee= -0.02883 -0.03451 slater integrals for ag i d10 8p nconf=45 z= 47 ion= 0 exf=0.650 irel= 1 ag i d9 5s9p nconf=51 kut=-1 corrf=0.000 class 0 k rdk( 4d, 8p, 5s, 9p) frac k rek( 4d, 8p, 5s, 9p) frac - ------------------------------------- ----- - ------------------------------------- ----- 2 -0.00221437 ryd = -242.9987 cm-1 -0.873 1 -0.00167712 ryd = -184.0428 cm-1 -0.658 ag i d10 8p -d9 5s9p 2 -0.2430 5 -0.1840 5 45 51 10 0.289 0.023 661.164 sec sqrtdel= 1.0000 1.0000 0.0000 -0.2430 -0.1840 rcn mod 32 ee,eee= -0.06339 -0.05178 slater integrals for ag i d10 8p nconf=45 z= 47 ion= 0 exf=0.650 irel= 1 ag i d9 5s4f nconf=59 kut=-1 corrf=0.000 class 0 k rdk( 4d, 8p, 5s, 4f) frac k rek( 4d, 8p, 5s, 4f) frac - ------------------------------------- ----- - ------------------------------------- ----- 2 -0.00013166 ryd = -14.4480 cm-1 -0.087 1 0.00036802 ryd = 40.3859 cm-1 0.927 ag i d10 8p -d9 5s4f 2 -0.0144 5 0.0404 5 45 59 8 0.461 0.023 661.664 sec sqrtdel= 1.0000 1.0000 -0.0144 0.0404 rcn mod 32 ee,eee= -0.04058 -0.04038 slater integrals for ag i d10 8p nconf=45 z= 47 ion= 0 exf=0.650 irel= 1 ag i d9 5s5f nconf=60 kut=-1 corrf=0.000 class 0 k rdk( 4d, 8p, 5s, 5f) frac k rek( 4d, 8p, 5s, 5f) frac - ------------------------------------- ----- - ------------------------------------- ----- 2 -0.00012223 ryd = -13.4137 cm-1 -0.102 1 0.00035565 ryd = 39.0279 cm-1 0.929 ag i d10 8p -d9 5s5f 2 -0.0134 5 0.0390 5 45 60 1 0.031 0.008 661.711 sec sqrtdel= 1.0000 1.0000 -0.0134 0.0390 rcn mod 32 ee,eee= -0.02815 -0.03417 slater integrals for ag i d10 8p nconf=45 z= 47 ion= 0 exf=0.650 irel= 1 ag i d9 5s6f nconf=61 kut=-1 corrf=0.000 class 0 k rdk( 4d, 8p, 5s, 6f) frac k rek( 4d, 8p, 5s, 6f) frac - ------------------------------------- ----- - ------------------------------------- ----- 2 -0.00019926 ryd = -21.8658 cm-1 -0.211 1 0.00031156 ryd = 34.1895 cm-1 0.931 ag i d10 8p -d9 5s6f 2 -0.0219 5 0.0342 5 45 61 1 0.023 0.031 661.781 sec sqrtdel= 1.0000 1.0000 -0.0219 0.0342 rcn mod 32 ee,eee= -0.02066 -0.03042 slater integrals for ag i d10 8p nconf=45 z= 47 ion= 0 exf=0.650 irel= 1 ag i d9 5s7f nconf=62 kut=-1 corrf=0.000 class 0 k rdk( 4d, 8p, 5s, 7f) frac k rek( 4d, 8p, 5s, 7f) frac - ------------------------------------- ----- - ------------------------------------- ----- 2 -0.00017184 ryd = -18.8578 cm-1 -0.221 1 0.00026854 ryd = 29.4686 cm-1 0.931 ag i d10 8p -d9 5s7f 2 -0.0189 5 0.0295 5 45 62 1 0.031 0.070 661.914 sec sqrtdel= 1.0000 1.0000 -0.0189 0.0295 rcn mod 32 ee,eee= -0.01580 -0.02799 slater integrals for ag i d10 8p nconf=45 z= 47 ion= 0 exf=0.650 irel= 1 ag i d9 5s8f nconf=63 kut=-1 corrf=0.000 class 0 k rdk( 4d, 8p, 5s, 8f) frac k rek( 4d, 8p, 5s, 8f) frac - ------------------------------------- ----- - ------------------------------------- ----- 2 -0.00014139 ryd = -15.5157 cm-1 -0.217 1 0.00023207 ryd = 25.4664 cm-1 0.932 ag i d10 8p -d9 5s8f 2 -0.0155 5 0.0255 5 45 63 1 0.094 0.039 662.055 sec sqrtdel= 1.0000 1.0000 -0.0155 0.0255 rcn mod 32 ee,eee= -0.01247 -0.02633 slater integrals for ag i d10 8p nconf=45 z= 47 ion= 0 exf=0.650 irel= 1 ag i d9 5s9f nconf=64 kut=-1 corrf=0.000 class 0 k rdk( 4d, 8p, 5s, 9f) frac k rek( 4d, 8p, 5s, 9f) frac - ------------------------------------- ----- - ------------------------------------- ----- 2 -0.00011681 ryd = -12.8182 cm-1 -0.210 1 0.00020212 ryd = 22.1800 cm-1 0.932 ag i d10 8p -d9 5s9f 2 -0.0128 5 0.0222 5 45 64 1 0.031 0.016 662.102 sec sqrtdel= 1.0000 1.0000 -0.0128 0.0222 rcn mod 32 ee,eee= -0.02785 -0.01392 ee,eee= -0.35477 -0.19131 slater integrals for ag i d10 9p nconf=46 z= 47 ion= 0 exf=0.650 irel= 1 ag i d9 5s5p nconf=47 kut=-1 corrf=0.000 class 0 k rdk( 4d, 9p, 5s, 5p) frac k rek( 4d, 9p, 5s, 5p) frac - ------------------------------------- ----- - ------------------------------------- ----- 2 -0.01043810 ryd = -1145.4490 cm-1 -0.758 1 -0.01066209 ryd = -1170.0289 cm-1 -0.673 ag i d10 9p -d9 5s5p 2 -1.1454 5 -1.1700 5 46 47 6 0.172 0.031 662.344 sec sqrtdel= 1.0000 1.0000 -1.1454 -1.1700 rcn mod 32 ee,eee= -1.75698 -0.87849 ee,eee= -1.01220 -1.38459 slater integrals for ag i d10 9p nconf=46 z= 47 ion= 0 exf=0.650 irel= 1 ag i d9 5s6p nconf=48 kut=-1 corrf=0.000 class 0 k rdk( 4d, 4d, 4d, 5s) frac k rek( 4d, 4d, 4d, 5s) frac - ------------------------------------- ----- - ------------------------------------- ----- 2 0.00000000 ryd = 0.0000 cm-1 0.000 2 0.00000000 ryd = 0.0000 cm-1 0.000 ag i d10 9p -d9 5s6p 1 0.0000 5 46 48 7 0.188 0.016 662.547 sec rcn mod 32 ee,eee= -0.02785 -0.01392 ee,eee= -0.12369 -0.07577 slater integrals for ag i d10 9p nconf=46 z= 47 ion= 0 exf=0.650 irel= 1 ag i d9 5s6p nconf=48 kut=-1 corrf=0.000 class 0 k rdk( 4d, 9p, 5s, 6p) frac k rek( 4d, 9p, 5s, 6p) frac - ------------------------------------- ----- - ------------------------------------- ----- 2 -0.00498971 ryd = -547.5575 cm-1 -0.835 1 -0.00396887 ryd = -435.5327 cm-1 -0.666 ag i d10 9p -d9 5s6p 2 -0.5476 5 -0.4355 5 46 48 7 0.188 0.023 662.766 sec sqrtdel= 1.0000 1.0000 0.0000 -0.5476 -0.4355 rcn mod 32 ee,eee= -1.75698 -0.87849 ee,eee= -1.09662 -1.42680 slater integrals for ag i d10 9p nconf=46 z= 47 ion= 0 exf=0.650 irel= 1 ag i d9 5s7p nconf=49 kut=-1 corrf=0.000 class 0 k rdk( 4d, 4d, 4d, 5s) frac k rek( 4d, 4d, 4d, 5s) frac - ------------------------------------- ----- - ------------------------------------- ----- 2 0.00000000 ryd = 0.0000 cm-1 0.000 2 0.00000000 ryd = 0.0000 cm-1 0.000 ag i d10 9p -d9 5s7p 1 0.0000 5 46 49 8 0.227 0.023 663.016 sec rcn mod 32 ee,eee= -0.02785 -0.01392 ee,eee= -0.06669 -0.04727 slater integrals for ag i d10 9p nconf=46 z= 47 ion= 0 exf=0.650 irel= 1 ag i d9 5s7p nconf=49 kut=-1 corrf=0.000 class 0 k rdk( 4d, 9p, 5s, 7p) frac k rek( 4d, 9p, 5s, 7p) frac - ------------------------------------- ----- - ------------------------------------- ----- 2 -0.00318744 ryd = -349.7806 cm-1 -0.867 1 -0.00240001 ryd = -263.3706 cm-1 -0.659 ag i d10 9p -d9 5s7p 2 -0.3498 5 -0.2634 5 46 49 8 0.219 0.016 663.250 sec sqrtdel= 1.0000 1.0000 0.0000 -0.3498 -0.2634 rcn mod 32 ee,eee= -1.75698 -0.87849 ee,eee= -1.13660 -1.44679 slater integrals for ag i d10 9p nconf=46 z= 47 ion= 0 exf=0.650 irel= 1 ag i d9 5s8p nconf=50 kut=-1 corrf=0.000 class 0 k rdk( 4d, 4d, 4d, 5s) frac k rek( 4d, 4d, 4d, 5s) frac - ------------------------------------- ----- - ------------------------------------- ----- 2 0.00000000 ryd = 0.0000 cm-1 0.000 2 0.00000000 ryd = 0.0000 cm-1 0.000 ag i d10 9p -d9 5s8p 1 0.0000 5 46 50 9 0.680 0.016 663.961 sec rcn mod 32 ee,eee= -0.02785 -0.01392 ee,eee= -0.04193 -0.03489 slater integrals for ag i d10 9p nconf=46 z= 47 ion= 0 exf=0.650 irel= 1 ag i d9 5s8p nconf=50 kut=-1 corrf=0.000 class 0 k rdk( 4d, 9p, 5s, 8p) frac k rek( 4d, 9p, 5s, 8p) frac - ------------------------------------- ----- - ------------------------------------- ----- 2 -0.00226144 ryd = -248.1645 cm-1 -0.880 1 -0.00166785 ryd = -183.0249 cm-1 -0.656 ag i d10 9p -d9 5s8p 2 -0.2482 5 -0.1830 5 46 50 9 0.250 0.039 664.250 sec sqrtdel= 1.0000 1.0000 0.0000 -0.2482 -0.1830 rcn mod 32 ee,eee= -1.75698 -0.87849 ee,eee= -1.15874 -1.45786 slater integrals for ag i d10 9p nconf=46 z= 47 ion= 0 exf=0.650 irel= 1 ag i d9 5s9p nconf=51 kut=-1 corrf=0.000 class 0 k rdk( 4d, 4d, 4d, 5s) frac k rek( 4d, 4d, 4d, 5s) frac - ------------------------------------- ----- - ------------------------------------- ----- 2 -0.13766796 ryd = -15107.3119 cm-1 -0.475 2 -0.13766823 ryd = -15107.3410 cm-1 -0.475 ag i d10 9p -d9 5s9p 1 -15.1073 5 46 51 10 0.281 0.063 664.594 sec rcn mod 32 ee,eee= -0.02785 -0.01392 ee,eee= -0.02883 -0.02834 slater integrals for ag i d10 9p nconf=46 z= 47 ion= 0 exf=0.650 irel= 1 ag i d9 5s9p nconf=51 kut=-1 corrf=0.000 class 0 k rdk( 4d, 9p, 5s, 9p) frac k rek( 4d, 9p, 5s, 9p) frac - ------------------------------------- ----- - ------------------------------------- ----- 2 -0.00171383 ryd = -188.0715 cm-1 -0.890 1 -0.00124916 ryd = -137.0789 cm-1 -0.654 ag i d10 9p -d9 5s9p 2 -0.1881 5 -0.1371 5 46 51 10 0.367 0.070 665.031 sec sqrtdel= 1.0000 1.0000 -15.1073 -0.1881 -0.1371 rcn mod 32 ee,eee= -0.06339 -0.04562 slater integrals for ag i d10 9p nconf=46 z= 47 ion= 0 exf=0.650 irel= 1 ag i d9 5s4f nconf=59 kut=-1 corrf=0.000 class 0 k rdk( 4d, 9p, 5s, 4f) frac k rek( 4d, 9p, 5s, 4f) frac - ------------------------------------- ----- - ------------------------------------- ----- 2 -0.00009194 ryd = -10.0894 cm-1 -0.082 1 0.00027277 ryd = 29.9328 cm-1 0.920 ag i d10 9p -d9 5s4f 2 -0.0101 5 0.0299 5 46 59 8 0.211 0.031 665.336 sec sqrtdel= 1.0000 1.0000 -0.0101 0.0299 rcn mod 32 ee,eee= -0.04058 -0.03422 slater integrals for ag i d10 9p nconf=46 z= 47 ion= 0 exf=0.650 irel= 1 ag i d9 5s5f nconf=60 kut=-1 corrf=0.000 class 0 k rdk( 4d, 9p, 5s, 5f) frac k rek( 4d, 9p, 5s, 5f) frac - ------------------------------------- ----- - ------------------------------------- ----- 2 -0.00008553 ryd = -9.3861 cm-1 -0.096 1 0.00026369 ryd = 28.9361 cm-1 0.922 ag i d10 9p -d9 5s5f 2 -0.0094 5 0.0289 5 46 60 1 0.031 0.016 665.383 sec sqrtdel= 1.0000 1.0000 -0.0094 0.0289 rcn mod 32 ee,eee= -0.02815 -0.02800 slater integrals for ag i d10 9p nconf=46 z= 47 ion= 0 exf=0.650 irel= 1 ag i d9 5s6f nconf=61 kut=-1 corrf=0.000 class 0 k rdk( 4d, 9p, 5s, 6f) frac k rek( 4d, 9p, 5s, 6f) frac - ------------------------------------- ----- - ------------------------------------- ----- 2 -0.00007371 ryd = -8.0884 cm-1 -0.104 1 0.00023104 ryd = 25.3532 cm-1 0.924 ag i d10 9p -d9 5s6f 2 -0.0081 5 0.0254 5 46 61 1 0.031 0.023 665.445 sec sqrtdel= 1.0000 1.0000 -0.0081 0.0254 rcn mod 32 ee,eee= -0.02066 -0.02425 slater integrals for ag i d10 9p nconf=46 z= 47 ion= 0 exf=0.650 irel= 1 ag i d9 5s7f nconf=62 kut=-1 corrf=0.000 class 0 k rdk( 4d, 9p, 5s, 7f) frac k rek( 4d, 9p, 5s, 7f) frac - ------------------------------------- ----- - ------------------------------------- ----- 2 -0.00009745 ryd = -10.6936 cm-1 -0.170 1 0.00019915 ryd = 21.8547 cm-1 0.924 ag i d10 9p -d9 5s7f 2 -0.0107 5 0.0219 5 46 62 1 0.031 0.016 665.492 sec sqrtdel= 1.0000 1.0000 -0.0107 0.0219 rcn mod 32 ee,eee= -0.01580 -0.02182 slater integrals for ag i d10 9p nconf=46 z= 47 ion= 0 exf=0.650 irel= 1 ag i d9 5s8f nconf=63 kut=-1 corrf=0.000 class 0 k rdk( 4d, 9p, 5s, 8f) frac k rek( 4d, 9p, 5s, 8f) frac - ------------------------------------- ----- - ------------------------------------- ----- 2 -0.00008861 ryd = -9.7239 cm-1 -0.184 1 0.00017212 ryd = 18.8879 cm-1 0.925 ag i d10 9p -d9 5s8f 2 -0.0097 5 0.0189 5 46 63 1 0.031 0.016 665.547 sec sqrtdel= 1.0000 1.0000 -0.0097 0.0189 rcn mod 32 ee,eee= -0.01247 -0.02016 slater integrals for ag i d10 9p nconf=46 z= 47 ion= 0 exf=0.650 irel= 1 ag i d9 5s9f nconf=64 kut=-1 corrf=0.000 class 0 k rdk( 4d, 9p, 5s, 9f) frac k rek( 4d, 9p, 5s, 9f) frac - ------------------------------------- ----- - ------------------------------------- ----- 2 -0.00007681 ryd = -8.4284 cm-1 -0.187 1 0.00014991 ryd = 16.4513 cm-1 0.925 ag i d10 9p -d9 5s9f 2 -0.0084 5 0.0165 5 46 64 1 0.031 0.016 665.602 sec sqrtdel= 1.0000 1.0000 -0.0084 0.0165 rcn mod 32 ee,eee= -0.35477 -0.17739 ee,eee= -0.12369 -0.23923 slater integrals for ag i d9 5s5p nconf=47 z= 47 ion= 0 exf=0.650 irel= 1 ag i d9 5s6p nconf=48 kut=-1 corrf=0.000 class 6 k rdk( 4d, 5p, 4d, 6p) frac k rek( 4d, 5p, 4d, 6p) frac - ------------------------------------- ----- - ------------------------------------- ----- 0 0.09504976 ryd = 10430.5055 cm-1 0.470 1 0.01647766 ryd = 1808.2142 cm-1 0.553 2 0.03893391 ryd = 4272.5027 cm-1 0.909 3 0.01363299 ryd = 1496.0479 cm-1 0.826 - ------------------------------------- ----- - ------------------------------------- ----- 0 0.09501050 ryd = 10426.1965 cm-1 0.469 1 0.01667672 ryd = 1830.0580 cm-1 0.555 2 0.03898661 ryd = 4278.2852 cm-1 0.908 3 0.01374647 ryd = 1508.5006 cm-1 0.827 - ------------------------------------- ----- - ------------------------------------- ----- 0 0.09509178 ryd = 10435.1159 cm-1 0.470 1 0.01633718 ryd = 1792.7987 cm-1 0.551 2 0.03888351 ryd = 4266.9718 cm-1 0.909 3 0.01353938 ryd = 1485.7747 cm-1 0.826 - ------------------------------------- ----- - ------------------------------------- ----- 0 0.09505114 ryd = 10430.6562 cm-1 0.470 1 0.01650695 ryd = 1811.4283 cm-1 0.551 2 0.03893506 ryd = 4272.6285 cm-1 0.909 3 0.01364292 ryd = 1497.1376 cm-1 0.826 9.00000 0.14856 2.00000 1.00000 1.00000 0.00990 -0.23923 0.00000 9.00000 0.12279 2.00000 3.00000 1.00000 0.01517 -0.23923 0.00000 ag i d9 5s5p -d9 5s6p 4 0.1849 5 4.2725 5 1.8082 5 1.4960 5 47 48 7 0.266 0.328 666.234 sec rcn mod 32 ee,eee= -0.35477 -0.17739 ee,eee= -0.12369 -0.23923 slater integrals for ag i d9 5s5p nconf=47 z= 47 ion= 0 exf=0.650 irel= 1 ag i d9 5s6p nconf=48 kut=-1 corrf=0.000 class 6 k rdk( 5s, 5p, 5s, 6p) frac k rek( 5s, 5p, 5s, 6p) frac - ------------------------------------- ----- - ------------------------------------- ----- 0 0.07427926 ryd = 8151.2058 cm-1 0.410 1 0.08397523 ryd = 9215.2158 cm-1 0.906 - ------------------------------------- ----- - ------------------------------------- ----- 0 0.07310735 ryd = 8022.6035 cm-1 0.405 1 0.08475101 ryd = 9300.3476 cm-1 0.900 - ------------------------------------- ----- - ------------------------------------- ----- 0 0.07566798 ryd = 8303.6011 cm-1 0.413 1 0.08600170 ryd = 9437.5955 cm-1 0.935 - ------------------------------------- ----- - ------------------------------------- ----- 0 0.07438767 ryd = 8163.1023 cm-1 0.413 1 0.08537636 ryd = 9368.9716 cm-1 0.935 1.00000 0.08538 0.00000 1.00000 1.00000 0.01423 -0.23923 0.00000 ag i d9 5s5p -d9 5s6p 2 1.5615 5 9.2152 5 47 48 7 0.289 0.109 666.633 sec sqrtdel= 1.0000 1.0000 0.1849 4.2725 1.8082 1.4960 1.5615 9.2152 rcn mod 32 ee,eee= -0.35477 -0.17739 ee,eee= -0.06669 -0.21073 slater integrals for ag i d9 5s5p nconf=47 z= 47 ion= 0 exf=0.650 irel= 1 ag i d9 5s7p nconf=49 kut=-1 corrf=0.000 class 6 k rdk( 4d, 5p, 4d, 7p) frac k rek( 4d, 5p, 4d, 7p) frac - ------------------------------------- ----- - ------------------------------------- ----- 0 0.05200267 ryd = 5706.6336 cm-1 0.429 1 0.01003644 ryd = 1101.3716 cm-1 0.548 2 0.02301720 ryd = 2525.8456 cm-1 0.886 3 0.00835151 ryd = 916.4721 cm-1 0.823 - ------------------------------------- ----- - ------------------------------------- ----- 0 0.05197579 ryd = 5703.6830 cm-1 0.429 1 0.01016830 ryd = 1115.8416 cm-1 0.550 2 0.02304774 ryd = 2529.1965 cm-1 0.885 3 0.00842635 ryd = 924.6845 cm-1 0.824 - ------------------------------------- ----- - ------------------------------------- ----- 0 0.05203127 ryd = 5709.7711 cm-1 0.429 1 0.00995203 ryd = 1092.1085 cm-1 0.547 2 0.02298809 ryd = 2522.6511 cm-1 0.886 3 0.00829286 ryd = 910.0357 cm-1 0.823 - ------------------------------------- ----- - ------------------------------------- ----- 0 0.05200353 ryd = 5706.7271 cm-1 0.429 1 0.01006016 ryd = 1103.9751 cm-1 0.547 2 0.02301791 ryd = 2525.9238 cm-1 0.886 3 0.00835960 ryd = 917.3601 cm-1 0.823 9.00000 0.09054 2.00000 1.00000 1.00000 0.00604 -0.21073 0.00000 9.00000 0.07524 2.00000 3.00000 1.00000 0.00926 -0.21073 0.00000 ag i d9 5s5p -d9 5s7p 4 0.1129 5 2.5258 5 1.1014 5 0.9165 5 47 49 8 0.234 0.086 666.961 sec rcn mod 32 ee,eee= -0.35477 -0.17739 ee,eee= -0.06669 -0.21073 slater integrals for ag i d9 5s5p nconf=47 z= 47 ion= 0 exf=0.650 irel= 1 ag i d9 5s7p nconf=49 kut=-1 corrf=0.000 class 6 k rdk( 5s, 5p, 5s, 7p) frac k rek( 5s, 5p, 5s, 7p) frac - ------------------------------------- ----- - ------------------------------------- ----- 0 0.03931246 ryd = 4314.0439 cm-1 0.363 1 0.04821709 ryd = 5291.2133 cm-1 0.868 - ------------------------------------- ----- - ------------------------------------- ----- 0 0.03855647 ryd = 4231.0831 cm-1 0.358 1 0.04855990 ryd = 5328.8332 cm-1 0.861 - ------------------------------------- ----- - ------------------------------------- ----- 0 0.04018974 ryd = 4410.3142 cm-1 0.368 1 0.04995148 ryd = 5481.5406 cm-1 0.908 - ------------------------------------- ----- - ------------------------------------- ----- 0 0.03937311 ryd = 4320.6986 cm-1 0.368 1 0.04925569 ryd = 5405.1869 cm-1 0.908 1.00000 0.04926 0.00000 1.00000 1.00000 0.00821 -0.21073 0.00000 ag i d9 5s5p -d9 5s7p 2 0.9009 5 5.2912 5 47 49 8 0.219 0.055 667.234 sec sqrtdel= 1.0000 1.0000 0.1129 2.5258 1.1014 0.9165 0.9009 5.2912 rcn mod 32 ee,eee= -0.35477 -0.17739 ee,eee= -0.04193 -0.19835 slater integrals for ag i d9 5s5p nconf=47 z= 47 ion= 0 exf=0.650 irel= 1 ag i d9 5s8p nconf=50 kut=-1 corrf=0.000 class 6 k rdk( 4d, 5p, 4d, 8p) frac k rek( 4d, 5p, 4d, 8p) frac - ------------------------------------- ----- - ------------------------------------- ----- 0 0.03469488 ryd = 3807.3233 cm-1 0.413 1 0.00700017 ryd = 768.1801 cm-1 0.545 2 0.01585007 ryd = 1739.3440 cm-1 0.876 3 0.00583930 ryd = 640.7890 cm-1 0.822 - ------------------------------------- ----- - ------------------------------------- ----- 0 0.03467544 ryd = 3805.1901 cm-1 0.412 1 0.00709405 ryd = 778.4819 cm-1 0.548 2 0.01587042 ryd = 1741.5773 cm-1 0.875 3 0.00589243 ryd = 646.6191 cm-1 0.823 - ------------------------------------- ----- - ------------------------------------- ----- 0 0.03471548 ryd = 3809.5838 cm-1 0.413 1 0.00694280 ryd = 761.8842 cm-1 0.545 2 0.01583069 ryd = 1737.2168 cm-1 0.876 3 0.00579865 ryd = 636.3286 cm-1 0.821 - ------------------------------------- ----- - ------------------------------------- ----- 0 0.03469546 ryd = 3807.3869 cm-1 0.413 1 0.00701842 ryd = 770.1831 cm-1 0.545 2 0.01585055 ryd = 1739.3971 cm-1 0.876 3 0.00584554 ryd = 641.4739 cm-1 0.821 9.00000 0.06317 2.00000 1.00000 1.00000 0.00421 -0.19835 0.00000 9.00000 0.05261 2.00000 3.00000 1.00000 0.00647 -0.19835 0.00000 ag i d9 5s5p -d9 5s8p 4 0.0788 5 1.7393 5 0.7682 5 0.6408 5 47 50 9 0.258 0.125 667.625 sec rcn mod 32 ee,eee= -0.35477 -0.17739 ee,eee= -0.04193 -0.19835 slater integrals for ag i d9 5s5p nconf=47 z= 47 ion= 0 exf=0.650 irel= 1 ag i d9 5s8p nconf=50 kut=-1 corrf=0.000 class 6 k rdk( 5s, 5p, 5s, 8p) frac k rek( 5s, 5p, 5s, 8p) frac - ------------------------------------- ----- - ------------------------------------- ----- 0 0.02582915 ryd = 2834.4209 cm-1 0.344 1 0.03275462 ryd = 3594.4034 cm-1 0.851 - ------------------------------------- ----- - ------------------------------------- ----- 0 0.02529384 ryd = 2775.6778 cm-1 0.339 1 0.03294881 ryd = 3615.7140 cm-1 0.842 - ------------------------------------- ----- - ------------------------------------- ----- 0 0.02644424 ryd = 2901.9197 cm-1 0.349 1 0.03410412 ryd = 3742.4944 cm-1 0.895 - ------------------------------------- ----- - ------------------------------------- ----- 0 0.02586904 ryd = 2838.7987 cm-1 0.349 1 0.03352647 ryd = 3679.1042 cm-1 0.895 1.00000 0.03353 0.00000 1.00000 1.00000 0.00559 -0.19835 0.00000 ag i d9 5s5p -d9 5s8p 2 0.6132 5 3.5944 5 47 50 9 0.352 0.133 668.117 sec sqrtdel= 1.0000 1.0000 0.0788 1.7393 0.7682 0.6408 0.6132 3.5944 rcn mod 32 ee,eee= -0.35477 -0.17739 ee,eee= -0.02883 -0.19180 slater integrals for ag i d9 5s5p nconf=47 z= 47 ion= 0 exf=0.650 irel= 1 ag i d9 5s9p nconf=51 kut=-1 corrf=0.000 class 6 k rdk( 4d, 5p, 4d, 9p) frac k rek( 4d, 5p, 4d, 9p) frac - ------------------------------------- ----- - ------------------------------------- ----- 0 0.02542203 ryd = 2789.7453 cm-1 0.404 1 0.00525400 ryd = 576.5603 cm-1 0.544 2 0.01181449 ryd = 1296.4901 cm-1 0.870 3 0.00438849 ryd = 481.5809 cm-1 0.821 - ------------------------------------- ----- - ------------------------------------- ----- 0 0.02540721 ryd = 2788.1192 cm-1 0.403 1 0.00532496 ryd = 584.3467 cm-1 0.546 2 0.01182929 ryd = 1298.1142 cm-1 0.870 3 0.00442857 ryd = 485.9795 cm-1 0.822 - ------------------------------------- ----- - ------------------------------------- ----- 0 0.02543770 ryd = 2791.4651 cm-1 0.404 1 0.00521177 ryd = 571.9260 cm-1 0.543 2 0.01180039 ryd = 1294.9435 cm-1 0.871 3 0.00435824 ryd = 478.2616 cm-1 0.821 - ------------------------------------- ----- - ------------------------------------- ----- 0 0.02542246 ryd = 2789.7921 cm-1 0.404 1 0.00526837 ryd = 578.1364 cm-1 0.543 2 0.01181484 ryd = 1296.5289 cm-1 0.871 3 0.00439341 ryd = 482.1205 cm-1 0.821 9.00000 0.04742 2.00000 1.00000 1.00000 0.00316 -0.19180 0.00000 9.00000 0.03954 2.00000 3.00000 1.00000 0.00486 -0.19180 0.00000 ag i d9 5s5p -d9 5s9p 4 0.0592 5 1.2965 5 0.5766 5 0.4816 5 47 51 10 0.922 0.078 669.133 sec rcn mod 32 ee,eee= -0.35477 -0.17739 ee,eee= -0.02883 -0.19180 slater integrals for ag i d9 5s5p nconf=47 z= 47 ion= 0 exf=0.650 irel= 1 ag i d9 5s9p nconf=51 kut=-1 corrf=0.000 class 6 k rdk( 5s, 5p, 5s, 9p) frac k rek( 5s, 5p, 5s, 9p) frac - ------------------------------------- ----- - ------------------------------------- ----- 0 0.01876133 ryd = 2058.8179 cm-1 0.334 1 0.02423046 ryd = 2658.9855 cm-1 0.842 - ------------------------------------- ----- - ------------------------------------- ----- 0 0.01835726 ryd = 2014.4761 cm-1 0.328 1 0.02435720 ryd = 2672.8935 cm-1 0.832 - ------------------------------------- ----- - ------------------------------------- ----- 0 0.01922302 ryd = 2109.4827 cm-1 0.339 1 0.02529689 ryd = 2776.0122 cm-1 0.887 - ------------------------------------- ----- - ------------------------------------- ----- 0 0.01879014 ryd = 2061.9794 cm-1 0.339 1 0.02482704 ryd = 2724.4528 cm-1 0.887 1.00000 0.02483 0.00000 1.00000 1.00000 0.00414 -0.19180 0.00000 ag i d9 5s5p -d9 5s9p 2 0.4541 5 2.6590 5 47 51 10 0.320 0.047 669.500 sec sqrtdel= 1.0000 1.0000 0.0592 1.2965 0.5766 0.4816 0.4541 2.6590 rcn mod 32 ee,eee= -1.60757 -0.80379 ee,eee= -0.82593 -1.21675 slater integrals for ag i d9 5s5p nconf=47 z= 47 ion= 0 exf=0.650 irel= 1 ag i d8 5s2 5p nconf=52 kut=-1 corrf=0.000 class 0 k rdk( 4d, 4d, 4d, 5s) frac k rek( 4d, 4d, 4d, 5s) frac - ------------------------------------- ----- - ------------------------------------- ----- 2 -0.12656572 ryd = -13888.9815 cm-1 -0.441 2 -0.12656599 ryd = -13889.0111 cm-1 -0.442 ag i d9 5s5p -d8 5s2 5p 1 -13.8890 5 47 52 11 0.297 0.031 669.852 sec rcn mod 32 ee,eee= -0.35477 -0.17739 ee,eee= -0.43413 -0.39445 slater integrals for ag i d9 5s5p nconf=47 z= 47 ion= 0 exf=0.650 irel= 1 ag i d8 5s2 5p nconf=52 kut=-1 corrf=0.000 class 0 k rdk( 4d, 5p, 5s, 5p) frac k rek( 4d, 5p, 5s, 5p) frac - ------------------------------------- ----- - ------------------------------------- ----- 2 -0.11161812 ryd = -12248.6727 cm-1 -0.887 1 -0.10424972 ryd = -11440.0838 cm-1 -0.721 ag i d9 5s5p -d8 5s2 5p 2 -12.2487 5 -11.4401 5 47 52 11 0.305 0.023 670.180 sec sqrtdel= 1.0000 1.0000 -13.8890 -12.2487 -11.4401 rcn mod 32 ee,eee= -0.35477 -0.17739 ee,eee= -0.06287 -0.20882 slater integrals for ag i d9 5s5p nconf=47 z= 47 ion= 0 exf=0.650 irel= 1 ag i d10 4f nconf=53 kut=-1 corrf=0.000 class 0 k rdk( 5s, 5p, 4d, 4f) frac k rek( 5s, 5p, 4d, 4f) frac - ------------------------------------- ----- - ------------------------------------- ----- 2 0.00457583 ryd = 502.1395 cm-1 0.954 3 0.00172328 ryd = 189.1081 cm-1 0.964 ag i d9 5s5p -d10 4f 2 0.5021 5 0.1891 5 47 53 12 0.422 0.266 670.867 sec sqrtdel= 1.0000 1.0000 0.5021 0.1891 rcn mod 32 ee,eee= -0.04026 -0.19752 slater integrals for ag i d9 5s5p nconf=47 z= 47 ion= 0 exf=0.650 irel= 1 ag i d10 5f nconf=54 kut=-1 corrf=0.000 class 0 k rdk( 5s, 5p, 4d, 5f) frac k rek( 5s, 5p, 4d, 5f) frac - ------------------------------------- ----- - ------------------------------------- ----- 2 0.00409872 ryd = 449.7822 cm-1 0.954 3 0.00160004 ryd = 175.5845 cm-1 0.963 ag i d9 5s5p -d10 5f 2 0.4498 5 0.1756 5 47 54 1 0.039 0.008 670.953 sec sqrtdel= 1.0000 1.0000 0.4498 0.1756 rcn mod 32 ee,eee= -0.02795 -0.19136 slater integrals for ag i d9 5s5p nconf=47 z= 47 ion= 0 exf=0.650 irel= 1 ag i d10 6f nconf=55 kut=-1 corrf=0.000 class 0 k rdk( 5s, 5p, 4d, 6f) frac k rek( 5s, 5p, 4d, 6f) frac - ------------------------------------- ----- - ------------------------------------- ----- 2 0.00344091 ryd = 377.5964 cm-1 0.953 3 0.00136902 ryd = 150.2330 cm-1 0.963 ag i d9 5s5p -d10 6f 2 0.3776 5 0.1502 5 47 55 1 0.023 0.078 671.063 sec sqrtdel= 1.0000 1.0000 0.3776 0.1502 rcn mod 32 ee,eee= -0.02053 -0.18765 slater integrals for ag i d9 5s5p nconf=47 z= 47 ion= 0 exf=0.650 irel= 1 ag i d10 7f nconf=56 kut=-1 corrf=0.000 class 0 k rdk( 5s, 5p, 4d, 7f) frac k rek( 5s, 5p, 4d, 7f) frac - ------------------------------------- ----- - ------------------------------------- ----- 2 0.00288528 ryd = 316.6229 cm-1 0.953 3 0.00116134 ryd = 127.4428 cm-1 0.963 ag i d9 5s5p -d10 7f 2 0.3166 5 0.1274 5 47 56 1 0.031 0.023 671.117 sec sqrtdel= 1.0000 1.0000 0.3166 0.1274 rcn mod 32 ee,eee= -0.01571 -0.18524 slater integrals for ag i d9 5s5p nconf=47 z= 47 ion= 0 exf=0.650 irel= 1 ag i d10 8f nconf=57 kut=-1 corrf=0.000 class 0 k rdk( 5s, 5p, 4d, 8f) frac k rek( 5s, 5p, 4d, 8f) frac - ------------------------------------- ----- - ------------------------------------- ----- 2 0.00244561 ryd = 268.3748 cm-1 0.953 3 0.00099202 ryd = 108.8619 cm-1 0.962 ag i d9 5s5p -d10 8f 2 0.2684 5 0.1089 5 47 57 1 0.016 0.023 671.164 sec sqrtdel= 1.0000 1.0000 0.2684 0.1089 rcn mod 32 ee,eee= -0.01240 -0.18359 slater integrals for ag i d9 5s5p nconf=47 z= 47 ion= 0 exf=0.650 irel= 1 ag i d10 9f nconf=58 kut=-1 corrf=0.000 class 0 k rdk( 5s, 5p, 4d, 9f) frac k rek( 5s, 5p, 4d, 9f) frac - ------------------------------------- ----- - ------------------------------------- ----- 2 0.00209947 ryd = 230.3902 cm-1 0.953 3 0.00085632 ryd = 93.9699 cm-1 0.962 ag i d9 5s5p -d10 9f 2 0.2304 5 0.0940 5 47 58 1 0.031 0.031 671.227 sec sqrtdel= 1.0000 1.0000 0.2304 0.0940 rcn mod 32 ee,eee= -0.35477 -0.17739 ee,eee= -0.06339 -0.20908 slater integrals for ag i d9 5s5p nconf=47 z= 47 ion= 0 exf=0.650 irel= 1 ag i d9 5s4f nconf=59 kut=-1 corrf=0.000 class 0 k rdk( 4d, 5p, 4d, 4f) frac k rek( 4d, 5p, 4d, 4f) frac - ------------------------------------- ----- - ------------------------------------- ----- 2 -0.00370248 ryd = -406.3000 cm-1 -0.972 1 -0.00074876 ryd = -82.1670 cm-1 -0.654 4 -0.00094300 ryd = -103.4827 cm-1 -0.931 3 -0.00047152 ryd = -51.7436 cm-1 -0.783 ag i d9 5s5p -d9 5s4f 4 -0.4063 5 -0.1035 5 -0.0822 5 -0.0517 5 47 59 18 0.477 0.031 671.734 sec sqrtdel= 1.0000 1.0000 -0.4063 -0.1035 -0.0822 -0.0517 rcn mod 32 ee,eee= -0.04058 -0.19768 slater integrals for ag i d9 5s5p nconf=47 z= 47 ion= 0 exf=0.650 irel= 1 ag i d9 5s5f nconf=60 kut=-1 corrf=0.000 class 0 k rdk( 4d, 5p, 4d, 5f) frac k rek( 4d, 5p, 4d, 5f) frac - ------------------------------------- ----- - ------------------------------------- ----- 2 -0.00340087 ryd = -373.2018 cm-1 -0.969 1 -0.00072367 ryd = -79.4133 cm-1 -0.649 4 -0.00089863 ryd = -98.6137 cm-1 -0.927 3 -0.00045817 ryd = -50.2782 cm-1 -0.778 ag i d9 5s5p -d9 5s5f 4 -0.3732 5 -0.0986 5 -0.0794 5 -0.0503 5 47 60 1 0.031 0.031 671.797 sec sqrtdel= 1.0000 1.0000 -0.3732 -0.0986 -0.0794 -0.0503 rcn mod 32 ee,eee= -0.02815 -0.19146 slater integrals for ag i d9 5s5p nconf=47 z= 47 ion= 0 exf=0.650 irel= 1 ag i d9 5s6f nconf=61 kut=-1 corrf=0.000 class 0 k rdk( 4d, 5p, 4d, 6f) frac k rek( 4d, 5p, 4d, 6f) frac - ------------------------------------- ----- - ------------------------------------- ----- 2 -0.00290154 ryd = -318.4071 cm-1 -0.968 1 -0.00063400 ryd = -69.5734 cm-1 -0.647 4 -0.00078165 ryd = -85.7766 cm-1 -0.926 3 -0.00040252 ryd = -44.1710 cm-1 -0.775 ag i d9 5s5p -d9 5s6f 4 -0.3184 5 -0.0858 5 -0.0696 5 -0.0442 5 47 61 1 0.031 0.039 671.875 sec sqrtdel= 1.0000 1.0000 -0.3184 -0.0858 -0.0696 -0.0442 rcn mod 32 ee,eee= -0.02066 -0.18772 slater integrals for ag i d9 5s5p nconf=47 z= 47 ion= 0 exf=0.650 irel= 1 ag i d9 5s7f nconf=62 kut=-1 corrf=0.000 class 0 k rdk( 4d, 5p, 4d, 7f) frac k rek( 4d, 5p, 4d, 7f) frac - ------------------------------------- ----- - ------------------------------------- ----- 2 -0.00246100 ryd = -270.0634 cm-1 -0.967 1 -0.00054648 ryd = -59.9697 cm-1 -0.645 4 -0.00067085 ryd = -73.6169 cm-1 -0.925 3 -0.00034754 ryd = -38.1383 cm-1 -0.774 ag i d9 5s5p -d9 5s7f 4 -0.2701 5 -0.0736 5 -0.0600 5 -0.0381 5 47 62 1 0.023 0.023 671.930 sec sqrtdel= 1.0000 1.0000 -0.2701 -0.0736 -0.0600 -0.0381 rcn mod 32 ee,eee= -0.01580 -0.18529 slater integrals for ag i d9 5s5p nconf=47 z= 47 ion= 0 exf=0.650 irel= 1 ag i d9 5s8f nconf=63 kut=-1 corrf=0.000 class 0 k rdk( 4d, 5p, 4d, 8f) frac k rek( 4d, 5p, 4d, 8f) frac - ------------------------------------- ----- - ------------------------------------- ----- 2 -0.00210406 ryd = -230.8934 cm-1 -0.966 1 -0.00047229 ryd = -51.8273 cm-1 -0.645 4 -0.00057810 ryd = -63.4389 cm-1 -0.924 3 -0.00030069 ryd = -32.9974 cm-1 -0.773 ag i d9 5s5p -d9 5s8f 4 -0.2309 5 -0.0634 5 -0.0518 5 -0.0330 5 47 63 1 0.031 0.023 672.000 sec sqrtdel= 1.0000 1.0000 -0.2309 -0.0634 -0.0518 -0.0330 rcn mod 32 ee,eee= -0.01247 -0.18362 slater integrals for ag i d9 5s5p nconf=47 z= 47 ion= 0 exf=0.650 irel= 1 ag i d9 5s9f nconf=64 kut=-1 corrf=0.000 class 0 k rdk( 4d, 5p, 4d, 9f) frac k rek( 4d, 5p, 4d, 9f) frac - ------------------------------------- ----- - ------------------------------------- ----- 2 -0.00181858 ryd = -199.5660 cm-1 -0.966 1 -0.00041135 ryd = -45.1406 cm-1 -0.644 4 -0.00050249 ryd = -55.1417 cm-1 -0.923 3 -0.00026211 ryd = -28.7634 cm-1 -0.772 ag i d9 5s5p -d9 5s9f 4 -0.1996 5 -0.0551 5 -0.0451 5 -0.0288 5 47 64 1 0.211 0.078 672.305 sec sqrtdel= 1.0000 1.0000 -0.1996 -0.0551 -0.0451 -0.0288 rcn mod 32 ee,eee= -0.06347 -0.20912 slater integrals for ag i d9 5s5p nconf=47 z= 47 ion= 0 exf=0.650 irel= 1 ag i d8 5s2 4f nconf=65 kut=-1 corrf=0.000 class 0 k rdk( 4d, 5p, 5s, 4f) frac k rek( 4d, 5p, 5s, 4f) frac - ------------------------------------- ----- - ------------------------------------- ----- 2 0.00464791 ryd = 510.0487 cm-1 0.943 1 0.00252633 ryd = 277.2325 cm-1 0.998 ag i d9 5s5p -d8 5s2 4f 2 0.5100 5 0.2772 5 47 65 1 0.148 0.031 672.484 sec sqrtdel= 1.0000 1.0000 0.5100 0.2772 rcn mod 32 ee,eee= -0.02778 -0.19128 slater integrals for ag i d9 5s5p nconf=47 z= 47 ion= 0 exf=0.650 irel= 1 ag i d9 5s6h nconf=70 kut=-1 corrf=0.000 class 0 k rdk( 4d, 5p, 4d, 6h) frac k rek( 4d, 5p, 4d, 6h) frac - ------------------------------------- ----- - ------------------------------------- ----- 4 -0.00000343 ryd = -0.3766 cm-1 -0.999 3 -0.00000087 ryd = -0.0954 cm-1 -0.954 ag i d9 5s5p -d9 5s6h 2 -0.0004 5 -0.0001 5 47 70 5 0.641 0.023 673.156 sec sqrtdel= 1.0000 1.0000 -0.0004 -0.0001 rcn mod 32 ee,eee= -0.02041 -0.18759 slater integrals for ag i d9 5s5p nconf=47 z= 47 ion= 0 exf=0.650 irel= 1 ag i d9 5s7h nconf=71 kut=-1 corrf=0.000 class 0 k rdk( 4d, 5p, 4d, 7h) frac k rek( 4d, 5p, 4d, 7h) frac - ------------------------------------- ----- - ------------------------------------- ----- 4 -0.00000402 ryd = -0.4411 cm-1 -0.999 3 -0.00000103 ryd = -0.1133 cm-1 -0.953 ag i d9 5s5p -d9 5s7h 2 -0.0004 5 -0.0001 5 47 71 1 0.445 0.094 673.695 sec sqrtdel= 1.0000 1.0000 -0.0004 -0.0001 rcn mod 32 ee,eee= -0.01563 -0.18520 slater integrals for ag i d9 5s5p nconf=47 z= 47 ion= 0 exf=0.650 irel= 1 ag i d9 5s8h nconf=72 kut=-1 corrf=0.000 class 0 k rdk( 4d, 5p, 4d, 8h) frac k rek( 4d, 5p, 4d, 8h) frac - ------------------------------------- ----- - ------------------------------------- ----- 4 -0.00000401 ryd = -0.4403 cm-1 -0.999 3 -0.00000104 ryd = -0.1141 cm-1 -0.953 ag i d9 5s5p -d9 5s8h 2 -0.0004 5 -0.0001 5 47 72 1 0.141 0.031 673.867 sec sqrtdel= 1.0000 1.0000 -0.0004 -0.0001 rcn mod 32 ee,eee= -0.01235 -0.18356 slater integrals for ag i d9 5s5p nconf=47 z= 47 ion= 0 exf=0.650 irel= 1 ag i d9 5s9h nconf=73 kut=-1 corrf=0.000 class 0 k rdk( 4d, 5p, 4d, 9h) frac k rek( 4d, 5p, 4d, 9h) frac - ------------------------------------- ----- - ------------------------------------- ----- 4 -0.00000379 ryd = -0.4163 cm-1 -0.999 3 -0.00000099 ryd = -0.1085 cm-1 -0.953 ag i d9 5s5p -d9 5s9h 2 -0.0004 5 -0.0001 5 47 73 1 0.141 0.016 674.031 sec sqrtdel= 1.0000 1.0000 -0.0004 -0.0001 rcn mod 32 ee,eee= -0.12369 -0.06184 ee,eee= -0.06669 -0.09519 slater integrals for ag i d9 5s6p nconf=48 z= 47 ion= 0 exf=0.650 irel= 1 ag i d9 5s7p nconf=49 kut=-1 corrf=0.000 class 11 k rdk( 4d, 6p, 4d, 7p) frac k rek( 4d, 6p, 4d, 7p) frac - ------------------------------------- ----- - ------------------------------------- ----- 0 0.05418265 ryd = 5945.8579 cm-1 0.472 1 0.00379270 ryd = 416.2003 cm-1 0.536 2 0.01051190 ryd = 1153.5475 cm-1 0.964 3 0.00322370 ryd = 353.7600 cm-1 0.818 - ------------------------------------- ----- - ------------------------------------- ----- 0 0.05418158 ryd = 5945.7409 cm-1 0.472 1 0.00379637 ryd = 416.6033 cm-1 0.536 2 0.01051425 ryd = 1153.8054 cm-1 0.964 3 0.00322613 ryd = 354.0273 cm-1 0.818 - ------------------------------------- ----- - ------------------------------------- ----- 0 0.05418374 ryd = 5945.9775 cm-1 0.472 1 0.00378930 ryd = 415.8279 cm-1 0.536 2 0.01050956 ryd = 1153.2908 cm-1 0.964 3 0.00322136 ryd = 353.5039 cm-1 0.818 - ------------------------------------- ----- - ------------------------------------- ----- 0 0.05418266 ryd = 5945.8592 cm-1 0.472 1 0.00379284 ryd = 416.2156 cm-1 0.536 2 0.01051190 ryd = 1153.5481 cm-1 0.964 3 0.00322375 ryd = 353.7656 cm-1 0.818 9.00000 0.03414 2.00000 1.00000 1.00000 0.00000 -0.09519 0.00000 9.00000 0.02901 2.00000 3.00000 1.00000 0.00000 -0.09519 0.00000 ag i d9 5s6p -d9 5s7p 4 0.0000 5 1.1535 5 0.4162 5 0.3538 5 48 49 8 0.227 0.078 674.352 sec rcn mod 32 ee,eee= -0.12369 -0.06184 ee,eee= -0.06669 -0.09519 slater integrals for ag i d9 5s6p nconf=48 z= 47 ion= 0 exf=0.650 irel= 1 ag i d9 5s7p nconf=49 kut=-1 corrf=0.000 class 11 k rdk( 5s, 6p, 5s, 7p) frac k rek( 5s, 6p, 5s, 7p) frac - ------------------------------------- ----- - ------------------------------------- ----- 0 0.04951033 ryd = 5433.1304 cm-1 0.449 1 0.01661402 ryd = 1823.1782 cm-1 0.883 - ------------------------------------- ----- - ------------------------------------- ----- 0 0.04949211 ryd = 5431.1314 cm-1 0.449 1 0.01659664 ryd = 1821.2703 cm-1 0.881 - ------------------------------------- ----- - ------------------------------------- ----- 0 0.04952952 ryd = 5435.2367 cm-1 0.450 1 0.01663932 ryd = 1825.9538 cm-1 0.884 - ------------------------------------- ----- - ------------------------------------- ----- 0 0.04951082 ryd = 5433.1841 cm-1 0.450 1 0.01661798 ryd = 1823.6120 cm-1 0.884 1.00000 0.01662 0.00000 1.00000 1.00000 0.00000 -0.09519 0.00000 ag i d9 5s6p -d9 5s7p 2 0.0000 5 1.8232 5 48 49 8 0.219 0.094 674.664 sec sqrtdel= 1.0000 1.0000 0.0000 1.1535 0.4162 0.3538 0.0000 1.8232 rcn mod 32 ee,eee= -0.12369 -0.06184 ee,eee= -0.04193 -0.08281 slater integrals for ag i d9 5s6p nconf=48 z= 47 ion= 0 exf=0.650 irel= 1 ag i d9 5s8p nconf=50 kut=-1 corrf=0.000 class 11 k rdk( 4d, 6p, 4d, 8p) frac k rek( 4d, 6p, 4d, 8p) frac - ------------------------------------- ----- - ------------------------------------- ----- 0 0.03198778 ryd = 3510.2530 cm-1 0.422 1 0.00264854 ryd = 290.6434 cm-1 0.534 2 0.00718668 ryd = 788.6465 cm-1 0.953 3 0.00225644 ryd = 247.6155 cm-1 0.817 - ------------------------------------- ----- - ------------------------------------- ----- 0 0.03198680 ryd = 3510.1459 cm-1 0.422 1 0.00265187 ryd = 291.0094 cm-1 0.535 2 0.00718868 ryd = 788.8668 cm-1 0.953 3 0.00225865 ryd = 247.8581 cm-1 0.817 - ------------------------------------- ----- - ------------------------------------- ----- 0 0.03198878 ryd = 3510.3628 cm-1 0.422 1 0.00264556 ryd = 290.3169 cm-1 0.534 2 0.00718468 ryd = 788.4275 cm-1 0.953 3 0.00225436 ryd = 247.3875 cm-1 0.817 - ------------------------------------- ----- - ------------------------------------- ----- 0 0.03198779 ryd = 3510.2543 cm-1 0.422 1 0.00264872 ryd = 290.6632 cm-1 0.534 2 0.00718668 ryd = 788.6471 cm-1 0.953 3 0.00225651 ryd = 247.6228 cm-1 0.817 9.00000 0.02384 2.00000 1.00000 1.00000 0.00000 -0.08281 0.00000 9.00000 0.02031 2.00000 3.00000 1.00000 0.00000 -0.08281 0.00000 ag i d9 5s6p -d9 5s8p 4 0.0000 5 0.7886 5 0.2906 5 0.2476 5 48 50 9 0.250 0.078 675.023 sec rcn mod 32 ee,eee= -0.12369 -0.06184 ee,eee= -0.04193 -0.08281 slater integrals for ag i d9 5s6p nconf=48 z= 47 ion= 0 exf=0.650 irel= 1 ag i d9 5s8p nconf=50 kut=-1 corrf=0.000 class 11 k rdk( 5s, 6p, 5s, 8p) frac k rek( 5s, 6p, 5s, 8p) frac - ------------------------------------- ----- - ------------------------------------- ----- 0 0.02871623 ryd = 3151.2413 cm-1 0.396 1 0.01139494 ryd = 1250.4502 cm-1 0.873 - ------------------------------------- ----- - ------------------------------------- ----- 0 0.02869988 ryd = 3149.4473 cm-1 0.396 1 0.01137954 ryd = 1248.7599 cm-1 0.871 - ------------------------------------- ----- - ------------------------------------- ----- 0 0.02873349 ryd = 3153.1362 cm-1 0.396 1 0.01142037 ryd = 1253.2405 cm-1 0.876 - ------------------------------------- ----- - ------------------------------------- ----- 0 0.02871669 ryd = 3151.2918 cm-1 0.396 1 0.01139995 ryd = 1251.0002 cm-1 0.876 1.00000 0.01140 0.00000 1.00000 1.00000 0.00000 -0.08281 0.00000 ag i d9 5s6p -d9 5s8p 2 0.0000 5 1.2505 5 48 50 9 0.281 0.055 675.367 sec sqrtdel= 1.0000 1.0000 0.0000 0.7886 0.2906 0.2476 0.0000 1.2505 rcn mod 32 ee,eee= -0.12369 -0.06184 ee,eee= -0.02883 -0.07626 slater integrals for ag i d9 5s6p nconf=48 z= 47 ion= 0 exf=0.650 irel= 1 ag i d9 5s9p nconf=51 kut=-1 corrf=0.000 class 11 k rdk( 4d, 6p, 4d, 9p) frac k rek( 4d, 6p, 4d, 9p) frac - ------------------------------------- ----- - ------------------------------------- ----- 0 0.02228098 ryd = 2445.0550 cm-1 0.400 1 0.00198916 ryd = 218.2850 cm-1 0.533 2 0.00534188 ryd = 586.2039 cm-1 0.947 3 0.00169681 ryd = 186.2032 cm-1 0.816 - ------------------------------------- ----- - ------------------------------------- ----- 0 0.02228018 ryd = 2444.9665 cm-1 0.400 1 0.00199190 ryd = 218.5858 cm-1 0.534 2 0.00534348 ryd = 586.3794 cm-1 0.947 3 0.00169863 ryd = 186.4026 cm-1 0.816 - ------------------------------------- ----- - ------------------------------------- ----- 0 0.02228181 ryd = 2445.1457 cm-1 0.400 1 0.00198676 ryd = 218.0218 cm-1 0.533 2 0.00534029 ryd = 586.0295 cm-1 0.947 3 0.00169512 ryd = 186.0179 cm-1 0.816 - ------------------------------------- ----- - ------------------------------------- ----- 0 0.02228099 ryd = 2445.0561 cm-1 0.400 1 0.00198933 ryd = 218.3038 cm-1 0.533 2 0.00534189 ryd = 586.2044 cm-1 0.947 3 0.00169687 ryd = 186.2102 cm-1 0.816 9.00000 0.01790 2.00000 1.00000 1.00000 0.00000 -0.07626 0.00000 9.00000 0.01527 2.00000 3.00000 1.00000 0.00000 -0.07626 0.00000 ag i d9 5s6p -d9 5s9p 4 0.0000 5 0.5862 5 0.2183 5 0.1862 5 48 51 10 0.539 0.078 676.000 sec rcn mod 32 ee,eee= -0.12369 -0.06184 ee,eee= -0.02883 -0.07626 slater integrals for ag i d9 5s6p nconf=48 z= 47 ion= 0 exf=0.650 irel= 1 ag i d9 5s9p nconf=51 kut=-1 corrf=0.000 class 11 k rdk( 5s, 6p, 5s, 9p) frac k rek( 5s, 6p, 5s, 9p) frac - ------------------------------------- ----- - ------------------------------------- ----- 0 0.01982006 ryd = 2174.9998 cm-1 0.372 1 0.00847290 ryd = 929.7938 cm-1 0.867 - ------------------------------------- ----- - ------------------------------------- ----- 0 0.01980668 ryd = 2173.5320 cm-1 0.372 1 0.00846043 ryd = 928.4246 cm-1 0.865 - ------------------------------------- ----- - ------------------------------------- ----- 0 0.01983418 ryd = 2176.5492 cm-1 0.372 1 0.00849482 ryd = 932.1992 cm-1 0.870 - ------------------------------------- ----- - ------------------------------------- ----- 0 0.01982043 ryd = 2175.0406 cm-1 0.372 1 0.00847763 ryd = 930.3119 cm-1 0.870 1.00000 0.00848 0.00000 1.00000 1.00000 0.00000 -0.07626 0.00000 ag i d9 5s6p -d9 5s9p 2 0.0000 5 0.9298 5 48 51 10 0.383 0.117 676.500 sec sqrtdel= 1.0000 1.0000 0.0000 0.5862 0.2183 0.1862 0.0000 0.9298 rcn mod 32 ee,eee= -0.12369 -0.06184 ee,eee= -0.43413 -0.27891 slater integrals for ag i d9 5s6p nconf=48 z= 47 ion= 0 exf=0.650 irel= 1 ag i d8 5s2 5p nconf=52 kut=-1 corrf=0.000 class 0 k rdk( 4d, 6p, 5s, 5p) frac k rek( 4d, 6p, 5s, 5p) frac - ------------------------------------- ----- - ------------------------------------- ----- 2 -0.03371252 ryd = -3699.5211 cm-1 -0.783 1 -0.03301549 ryd = -3623.0313 cm-1 -0.658 ag i d9 5s6p -d8 5s2 5p 2 -3.6995 5 -3.6230 5 48 52 11 0.523 0.016 677.242 sec sqrtdel= 1.0000 1.0000 -3.6995 -3.6230 rcn mod 32 ee,eee= -0.12369 -0.06184 ee,eee= -0.06287 -0.09328 slater integrals for ag i d9 5s6p nconf=48 z= 47 ion= 0 exf=0.650 irel= 1 ag i d10 4f nconf=53 kut=-1 corrf=0.000 class 0 k rdk( 5s, 6p, 4d, 4f) frac k rek( 5s, 6p, 4d, 4f) frac - ------------------------------------- ----- - ------------------------------------- ----- 2 -0.00231210 ryd = -253.7236 cm-1 -0.586 3 0.00052995 ryd = 58.1553 cm-1 0.923 ag i d9 5s6p -d10 4f 2 -0.2537 5 0.0582 5 48 53 12 0.336 0.031 677.617 sec sqrtdel= 1.0000 1.0000 -0.2537 0.0582 rcn mod 32 ee,eee= -0.04026 -0.08197 slater integrals for ag i d9 5s6p nconf=48 z= 47 ion= 0 exf=0.650 irel= 1 ag i d10 5f nconf=54 kut=-1 corrf=0.000 class 0 k rdk( 5s, 6p, 4d, 5f) frac k rek( 5s, 6p, 4d, 5f) frac - ------------------------------------- ----- - ------------------------------------- ----- 2 -0.00141716 ryd = -155.5157 cm-1 -0.478 3 0.00049646 ryd = 54.4801 cm-1 0.924 ag i d9 5s6p -d10 5f 2 -0.1555 5 0.0545 5 48 54 1 0.023 0.023 677.664 sec sqrtdel= 1.0000 1.0000 -0.1555 0.0545 rcn mod 32 ee,eee= -0.02795 -0.07582 slater integrals for ag i d9 5s6p nconf=48 z= 47 ion= 0 exf=0.650 irel= 1 ag i d10 6f nconf=55 kut=-1 corrf=0.000 class 0 k rdk( 5s, 6p, 4d, 6f) frac k rek( 5s, 6p, 4d, 6f) frac - ------------------------------------- ----- - ------------------------------------- ----- 2 -0.00095445 ryd = -104.7390 cm-1 -0.414 3 0.00042682 ryd = 46.8376 cm-1 0.924 ag i d9 5s6p -d10 6f 2 -0.1047 5 0.0468 5 48 55 1 0.031 0.023 677.727 sec sqrtdel= 1.0000 1.0000 -0.1047 0.0468 rcn mod 32 ee,eee= -0.02053 -0.07211 slater integrals for ag i d9 5s6p nconf=48 z= 47 ion= 0 exf=0.650 irel= 1 ag i d10 7f nconf=56 kut=-1 corrf=0.000 class 0 k rdk( 5s, 6p, 4d, 7f) frac k rek( 5s, 6p, 4d, 7f) frac - ------------------------------------- ----- - ------------------------------------- ----- 2 -0.00069345 ryd = -76.0972 cm-1 -0.375 3 0.00036314 ryd = 39.8503 cm-1 0.925 ag i d9 5s6p -d10 7f 2 -0.0761 5 0.0399 5 48 56 1 0.023 0.023 677.773 sec sqrtdel= 1.0000 1.0000 -0.0761 0.0399 rcn mod 32 ee,eee= -0.01571 -0.06970 slater integrals for ag i d9 5s6p nconf=48 z= 47 ion= 0 exf=0.650 irel= 1 ag i d10 8f nconf=57 kut=-1 corrf=0.000 class 0 k rdk( 5s, 6p, 4d, 8f) frac k rek( 5s, 6p, 4d, 8f) frac - ------------------------------------- ----- - ------------------------------------- ----- 2 -0.00053194 ryd = -58.3736 cm-1 -0.348 3 0.00031082 ryd = 34.1086 cm-1 0.925 ag i d9 5s6p -d10 8f 2 -0.0584 5 0.0341 5 48 57 1 0.031 0.023 677.836 sec sqrtdel= 1.0000 1.0000 -0.0584 0.0341 rcn mod 32 ee,eee= -0.01240 -0.06805 slater integrals for ag i d9 5s6p nconf=48 z= 47 ion= 0 exf=0.650 irel= 1 ag i d10 9f nconf=58 kut=-1 corrf=0.000 class 0 k rdk( 5s, 6p, 4d, 9f) frac k rek( 5s, 6p, 4d, 9f) frac - ------------------------------------- ----- - ------------------------------------- ----- 2 -0.00042453 ryd = -46.5865 cm-1 -0.330 3 0.00026869 ryd = 29.4852 cm-1 0.925 ag i d9 5s6p -d10 9f 2 -0.0466 5 0.0295 5 48 58 1 0.023 0.016 677.883 sec sqrtdel= 1.0000 1.0000 -0.0466 0.0295 rcn mod 32 ee,eee= -0.12369 -0.06184 ee,eee= -0.06339 -0.09354 slater integrals for ag i d9 5s6p nconf=48 z= 47 ion= 0 exf=0.650 irel= 1 ag i d9 5s4f nconf=59 kut=-1 corrf=0.000 class 0 k rdk( 4d, 6p, 4d, 4f) frac k rek( 4d, 6p, 4d, 4f) frac - ------------------------------------- ----- - ------------------------------------- ----- 2 0.00141546 ryd = 155.3285 cm-1 0.502 1 -0.00026321 ryd = -28.8845 cm-1 -0.625 4 -0.00016403 ryd = -18.0007 cm-1 -0.421 3 -0.00016895 ryd = -18.5400 cm-1 -0.761 ag i d9 5s6p -d9 5s4f 4 0.1553 5 -0.0180 5 -0.0289 5 -0.0185 5 48 59 18 0.602 0.031 678.695 sec sqrtdel= 1.0000 1.0000 0.1553 -0.0180 -0.0289 -0.0185 rcn mod 32 ee,eee= -0.04058 -0.08214 slater integrals for ag i d9 5s6p nconf=48 z= 47 ion= 0 exf=0.650 irel= 1 ag i d9 5s5f nconf=60 kut=-1 corrf=0.000 class 0 k rdk( 4d, 6p, 4d, 5f) frac k rek( 4d, 6p, 4d, 5f) frac - ------------------------------------- ----- - ------------------------------------- ----- 2 0.00079588 ryd = 87.3381 cm-1 0.365 1 -0.00025520 ryd = -28.0050 cm-1 -0.621 4 -0.00017846 ryd = -19.5833 cm-1 -0.495 3 -0.00016471 ryd = -18.0745 cm-1 -0.757 ag i d9 5s6p -d9 5s5f 4 0.0873 5 -0.0196 5 -0.0280 5 -0.0181 5 48 60 1 0.031 0.016 678.750 sec sqrtdel= 1.0000 1.0000 0.0873 -0.0196 -0.0280 -0.0181 rcn mod 32 ee,eee= -0.02815 -0.07592 slater integrals for ag i d9 5s6p nconf=48 z= 47 ion= 0 exf=0.650 irel= 1 ag i d9 5s6f nconf=61 kut=-1 corrf=0.000 class 0 k rdk( 4d, 6p, 4d, 6f) frac k rek( 4d, 6p, 4d, 6f) frac - ------------------------------------- ----- - ------------------------------------- ----- 2 0.00049372 ryd = 54.1794 cm-1 0.286 1 -0.00022394 ryd = -24.5745 cm-1 -0.618 4 -0.00016450 ryd = -18.0522 cm-1 -0.530 3 -0.00014494 ryd = -15.9053 cm-1 -0.755 ag i d9 5s6p -d9 5s6f 4 0.0542 5 -0.0181 5 -0.0246 5 -0.0159 5 48 61 1 0.031 0.055 678.852 sec sqrtdel= 1.0000 1.0000 0.0542 -0.0181 -0.0246 -0.0159 rcn mod 32 ee,eee= -0.02066 -0.07217 slater integrals for ag i d9 5s6p nconf=48 z= 47 ion= 0 exf=0.650 irel= 1 ag i d9 5s7f nconf=62 kut=-1 corrf=0.000 class 0 k rdk( 4d, 6p, 4d, 7f) frac k rek( 4d, 6p, 4d, 7f) frac - ------------------------------------- ----- - ------------------------------------- ----- 2 0.00033284 ryd = 36.5245 cm-1 0.237 1 -0.00019322 ryd = -21.2029 cm-1 -0.617 4 -0.00014581 ryd = -16.0012 cm-1 -0.551 3 -0.00012527 ryd = -13.7466 cm-1 -0.753 ag i d9 5s6p -d9 5s7f 4 0.0365 5 -0.0160 5 -0.0212 5 -0.0137 5 48 62 1 0.031 0.016 678.922 sec sqrtdel= 1.0000 1.0000 0.0365 -0.0160 -0.0212 -0.0137 rcn mod 32 ee,eee= -0.01580 -0.06974 slater integrals for ag i d9 5s6p nconf=48 z= 47 ion= 0 exf=0.650 irel= 1 ag i d9 5s8f nconf=63 kut=-1 corrf=0.000 class 0 k rdk( 4d, 6p, 4d, 8f) frac k rek( 4d, 6p, 4d, 8f) frac - ------------------------------------- ----- - ------------------------------------- ----- 2 0.00023879 ryd = 26.2044 cm-1 0.204 1 -0.00016709 ryd = -18.3359 cm-1 -0.616 4 -0.00012824 ryd = -14.0729 cm-1 -0.565 3 -0.00010845 ryd = -11.9014 cm-1 -0.752 ag i d9 5s6p -d9 5s8f 4 0.0262 5 -0.0141 5 -0.0183 5 -0.0119 5 48 63 1 0.031 0.016 678.992 sec sqrtdel= 1.0000 1.0000 0.0262 -0.0141 -0.0183 -0.0119 rcn mod 32 ee,eee= -0.01247 -0.06808 slater integrals for ag i d9 5s6p nconf=48 z= 47 ion= 0 exf=0.650 irel= 1 ag i d9 5s9f nconf=64 kut=-1 corrf=0.000 class 0 k rdk( 4d, 6p, 4d, 9f) frac k rek( 4d, 6p, 4d, 9f) frac - ------------------------------------- ----- - ------------------------------------- ----- 2 0.00017957 ryd = 19.7057 cm-1 0.181 1 -0.00014560 ryd = -15.9776 cm-1 -0.616 4 -0.00011304 ryd = -12.4045 cm-1 -0.575 3 -0.00009458 ryd = -10.3790 cm-1 -0.752 ag i d9 5s6p -d9 5s9f 4 0.0197 5 -0.0124 5 -0.0160 5 -0.0104 5 48 64 1 0.016 0.031 679.063 sec sqrtdel= 1.0000 1.0000 0.0197 -0.0124 -0.0160 -0.0104 rcn mod 32 ee,eee= -0.06347 -0.09358 slater integrals for ag i d9 5s6p nconf=48 z= 47 ion= 0 exf=0.650 irel= 1 ag i d8 5s2 4f nconf=65 kut=-1 corrf=0.000 class 0 k rdk( 4d, 6p, 5s, 4f) frac k rek( 4d, 6p, 5s, 4f) frac - ------------------------------------- ----- - ------------------------------------- ----- 2 -0.00191993 ryd = -210.6880 cm-1 -0.519 1 0.00078722 ryd = 86.3876 cm-1 0.944 ag i d9 5s6p -d8 5s2 4f 2 -0.2107 5 0.0864 5 48 65 1 0.031 0.023 679.125 sec sqrtdel= 1.0000 1.0000 -0.2107 0.0864 rcn mod 32 ee,eee= -0.02778 -0.07573 slater integrals for ag i d9 5s6p nconf=48 z= 47 ion= 0 exf=0.650 irel= 1 ag i d9 5s6h nconf=70 kut=-1 corrf=0.000 class 0 k rdk( 4d, 6p, 4d, 6h) frac k rek( 4d, 6p, 4d, 6h) frac - ------------------------------------- ----- - ------------------------------------- ----- 4 0.00000327 ryd = 0.3590 cm-1 0.785 3 -0.00000027 ryd = -0.0300 cm-1 -0.923 ag i d9 5s6p -d9 5s6h 2 0.0004 5 0.0000 5 48 70 5 0.172 0.016 679.320 sec sqrtdel= 1.0000 1.0000 0.0004 0.0000 rcn mod 32 ee,eee= -0.02041 -0.07205 slater integrals for ag i d9 5s6p nconf=48 z= 47 ion= 0 exf=0.650 irel= 1 ag i d9 5s7h nconf=71 kut=-1 corrf=0.000 class 0 k rdk( 4d, 6p, 4d, 7h) frac k rek( 4d, 6p, 4d, 7h) frac - ------------------------------------- ----- - ------------------------------------- ----- 4 0.00000359 ryd = 0.3943 cm-1 0.771 3 -0.00000033 ryd = -0.0357 cm-1 -0.923 ag i d9 5s6p -d9 5s7h 2 0.0004 5 0.0000 5 48 71 1 0.070 0.023 679.445 sec sqrtdel= 1.0000 1.0000 0.0004 0.0000 rcn mod 32 ee,eee= -0.01563 -0.06966 slater integrals for ag i d9 5s6p nconf=48 z= 47 ion= 0 exf=0.650 irel= 1 ag i d9 5s8h nconf=72 kut=-1 corrf=0.000 class 0 k rdk( 4d, 6p, 4d, 8h) frac k rek( 4d, 6p, 4d, 8h) frac - ------------------------------------- ----- - ------------------------------------- ----- 4 0.00000344 ryd = 0.3776 cm-1 0.762 3 -0.00000033 ryd = -0.0360 cm-1 -0.923 ag i d9 5s6p -d9 5s8h 2 0.0004 5 0.0000 5 48 72 1 0.031 0.016 679.500 sec sqrtdel= 1.0000 1.0000 0.0004 0.0000 rcn mod 32 ee,eee= -0.01235 -0.06802 slater integrals for ag i d9 5s6p nconf=48 z= 47 ion= 0 exf=0.650 irel= 1 ag i d9 5s9h nconf=73 kut=-1 corrf=0.000 class 0 k rdk( 4d, 6p, 4d, 9h) frac k rek( 4d, 6p, 4d, 9h) frac - ------------------------------------- ----- - ------------------------------------- ----- 4 0.00000316 ryd = 0.3470 cm-1 0.755 3 -0.00000031 ryd = -0.0342 cm-1 -0.923 ag i d9 5s6p -d9 5s9h 2 0.0003 5 0.0000 5 48 73 1 0.031 0.016 679.563 sec sqrtdel= 1.0000 1.0000 0.0003 0.0000 rcn mod 32 ee,eee= -0.06669 -0.03334 ee,eee= -0.04193 -0.05431 slater integrals for ag i d9 5s7p nconf=49 z= 47 ion= 0 exf=0.650 irel= 1 ag i d9 5s8p nconf=50 kut=-1 corrf=0.000 class 11 k rdk( 4d, 7p, 4d, 8p) frac k rek( 4d, 7p, 4d, 8p) frac - ------------------------------------- ----- - ------------------------------------- ----- 0 0.03543262 ryd = 3888.2802 cm-1 0.481 1 0.00161924 ryd = 177.6912 cm-1 0.531 2 0.00461032 ryd = 505.9243 cm-1 0.983 3 0.00138694 ryd = 152.1995 cm-1 0.815 - ------------------------------------- ----- - ------------------------------------- ----- 0 0.03543248 ryd = 3888.2645 cm-1 0.481 1 0.00161968 ryd = 177.7396 cm-1 0.531 2 0.00461065 ryd = 505.9604 cm-1 0.983 3 0.00138725 ryd = 152.2328 cm-1 0.815 - ------------------------------------- ----- - ------------------------------------- ----- 0 0.03543276 ryd = 3888.2960 cm-1 0.481 1 0.00161882 ryd = 177.6444 cm-1 0.531 2 0.00460999 ryd = 505.8882 cm-1 0.983 3 0.00138665 ryd = 152.1669 cm-1 0.815 - ------------------------------------- ----- - ------------------------------------- ----- 0 0.03543262 ryd = 3888.2802 cm-1 0.481 1 0.00161925 ryd = 177.6920 cm-1 0.531 2 0.00461032 ryd = 505.9243 cm-1 0.983 3 0.00138695 ryd = 152.1998 cm-1 0.815 9.00000 0.01457 2.00000 1.00000 1.00000 0.00000 -0.05431 0.00000 9.00000 0.01248 2.00000 3.00000 1.00000 0.00000 -0.05431 0.00000 ag i d9 5s7p -d9 5s8p 4 0.0000 5 0.5059 5 0.1777 5 0.1522 5 49 50 9 0.258 0.117 679.961 sec rcn mod 32 ee,eee= -0.06669 -0.03334 ee,eee= -0.04193 -0.05431 slater integrals for ag i d9 5s7p nconf=49 z= 47 ion= 0 exf=0.650 irel= 1 ag i d9 5s8p nconf=50 kut=-1 corrf=0.000 class 11 k rdk( 5s, 7p, 5s, 8p) frac k rek( 5s, 7p, 5s, 8p) frac - ------------------------------------- ----- - ------------------------------------- ----- 0 0.03342187 ryd = 3667.6257 cm-1 0.467 1 0.00672983 ryd = 738.5129 cm-1 0.858 - ------------------------------------- ----- - ------------------------------------- ----- 0 0.03341959 ryd = 3667.3759 cm-1 0.467 1 0.00672693 ryd = 738.1951 cm-1 0.858 - ------------------------------------- ----- - ------------------------------------- ----- 0 0.03342420 ryd = 3667.8821 cm-1 0.467 1 0.00673313 ryd = 738.8752 cm-1 0.859 - ------------------------------------- ----- - ------------------------------------- ----- 0 0.03342190 ryd = 3667.6290 cm-1 0.467 1 0.00673003 ryd = 738.5352 cm-1 0.859 1.00000 0.00673 0.00000 1.00000 1.00000 0.00000 -0.05431 0.00000 ag i d9 5s7p -d9 5s8p 2 0.0000 5 0.7385 5 49 50 9 0.852 0.063 680.875 sec sqrtdel= 1.0000 1.0000 0.0000 0.5059 0.1777 0.1522 0.0000 0.7385 rcn mod 32 ee,eee= -0.06669 -0.03334 ee,eee= -0.02883 -0.04776 slater integrals for ag i d9 5s7p nconf=49 z= 47 ion= 0 exf=0.650 irel= 1 ag i d9 5s9p nconf=51 kut=-1 corrf=0.000 class 11 k rdk( 4d, 7p, 4d, 9p) frac k rek( 4d, 7p, 4d, 9p) frac - ------------------------------------- ----- - ------------------------------------- ----- 0 0.02221109 ryd = 2437.3852 cm-1 0.431 1 0.00121628 ryd = 133.4713 cm-1 0.530 2 0.00342018 ryd = 375.3218 cm-1 0.978 3 0.00104311 ryd = 114.4677 cm-1 0.814 - ------------------------------------- ----- - ------------------------------------- ----- 0 0.02221094 ryd = 2437.3685 cm-1 0.431 1 0.00121675 ryd = 133.5227 cm-1 0.530 2 0.00342052 ryd = 375.3588 cm-1 0.978 3 0.00104343 ryd = 114.5030 cm-1 0.814 - ------------------------------------- ----- - ------------------------------------- ----- 0 0.02221124 ryd = 2437.4020 cm-1 0.431 1 0.00121584 ryd = 133.4226 cm-1 0.530 2 0.00341985 ryd = 375.2848 cm-1 0.978 3 0.00104279 ryd = 114.4335 cm-1 0.814 - ------------------------------------- ----- - ------------------------------------- ----- 0 0.02221109 ryd = 2437.3853 cm-1 0.431 1 0.00121629 ryd = 133.4726 cm-1 0.530 2 0.00342018 ryd = 375.3218 cm-1 0.978 3 0.00104311 ryd = 114.4682 cm-1 0.814 9.00000 0.01095 2.00000 1.00000 1.00000 0.00000 -0.04776 0.00000 9.00000 0.00939 2.00000 3.00000 1.00000 0.00000 -0.04776 0.00000 ag i d9 5s7p -d9 5s9p 4 0.0000 5 0.3753 5 0.1335 5 0.1145 5 49 51 10 0.313 0.078 681.273 sec rcn mod 32 ee,eee= -0.06669 -0.03334 ee,eee= -0.02883 -0.04776 slater integrals for ag i d9 5s7p nconf=49 z= 47 ion= 0 exf=0.650 irel= 1 ag i d9 5s9p nconf=51 kut=-1 corrf=0.000 class 11 k rdk( 5s, 7p, 5s, 9p) frac k rek( 5s, 7p, 5s, 9p) frac - ------------------------------------- ----- - ------------------------------------- ----- 0 0.02069825 ryd = 2271.3703 cm-1 0.414 1 0.00500841 ryd = 549.6092 cm-1 0.854 - ------------------------------------- ----- - ------------------------------------- ----- 0 0.02069586 ryd = 2271.1077 cm-1 0.414 1 0.00500541 ryd = 549.2804 cm-1 0.853 - ------------------------------------- ----- - ------------------------------------- ----- 0 0.02070071 ryd = 2271.6407 cm-1 0.414 1 0.00501205 ryd = 550.0093 cm-1 0.854 - ------------------------------------- ----- - ------------------------------------- ----- 0 0.02069829 ryd = 2271.3742 cm-1 0.414 1 0.00500873 ryd = 549.6449 cm-1 0.854 1.00000 0.00501 0.00000 1.00000 1.00000 0.00000 -0.04776 0.00000 ag i d9 5s7p -d9 5s9p 2 0.0000 5 0.5496 5 49 51 10 0.352 0.047 681.680 sec sqrtdel= 1.0000 1.0000 0.0000 0.3753 0.1335 0.1145 0.0000 0.5496 rcn mod 32 ee,eee= -0.06669 -0.03334 ee,eee= -0.43413 -0.25041 slater integrals for ag i d9 5s7p nconf=49 z= 47 ion= 0 exf=0.650 irel= 1 ag i d8 5s2 5p nconf=52 kut=-1 corrf=0.000 class 0 k rdk( 4d, 7p, 5s, 5p) frac k rek( 4d, 7p, 5s, 5p) frac - ------------------------------------- ----- - ------------------------------------- ----- 2 -0.01950562 ryd = -2140.4939 cm-1 -0.753 1 -0.01927364 ryd = -2115.0370 cm-1 -0.637 ag i d9 5s7p -d8 5s2 5p 2 -2.1405 5 -2.1150 5 49 52 11 0.352 0.016 682.063 sec sqrtdel= 1.0000 1.0000 -2.1405 -2.1150 rcn mod 32 ee,eee= -0.06669 -0.03334 ee,eee= -0.06287 -0.06478 slater integrals for ag i d9 5s7p nconf=49 z= 47 ion= 0 exf=0.650 irel= 1 ag i d10 4f nconf=53 kut=-1 corrf=0.000 class 0 k rdk( 5s, 7p, 4d, 4f) frac k rek( 5s, 7p, 4d, 4f) frac - ------------------------------------- ----- - ------------------------------------- ----- 2 -0.00033568 ryd = -36.8364 cm-1 -0.149 3 0.00030966 ryd = 33.9815 cm-1 0.902 ag i d9 5s7p -d10 4f 2 -0.0368 5 0.0340 5 49 53 12 0.391 0.047 682.531 sec sqrtdel= 1.0000 1.0000 -0.0368 0.0340 rcn mod 32 ee,eee= -0.04026 -0.05347 slater integrals for ag i d9 5s7p nconf=49 z= 47 ion= 0 exf=0.650 irel= 1 ag i d10 5f nconf=54 kut=-1 corrf=0.000 class 0 k rdk( 5s, 7p, 4d, 5f) frac k rek( 5s, 7p, 4d, 5f) frac - ------------------------------------- ----- - ------------------------------------- ----- 2 -0.00067819 ryd = -74.4228 cm-1 -0.402 3 0.00029057 ryd = 31.8860 cm-1 0.904 ag i d9 5s7p -d10 5f 2 -0.0744 5 0.0319 5 49 54 1 0.055 0.008 682.594 sec sqrtdel= 1.0000 1.0000 -0.0744 0.0319 rcn mod 32 ee,eee= -0.02795 -0.04732 slater integrals for ag i d9 5s7p nconf=49 z= 47 ion= 0 exf=0.650 irel= 1 ag i d10 6f nconf=55 kut=-1 corrf=0.000 class 0 k rdk( 5s, 7p, 4d, 6f) frac k rek( 5s, 7p, 4d, 6f) frac - ------------------------------------- ----- - ------------------------------------- ----- 2 -0.00055776 ryd = -61.2066 cm-1 -0.416 3 0.00025002 ryd = 27.4369 cm-1 0.905 ag i d9 5s7p -d10 6f 2 -0.0612 5 0.0274 5 49 55 1 0.023 0.031 682.656 sec sqrtdel= 1.0000 1.0000 -0.0612 0.0274 rcn mod 32 ee,eee= -0.02053 -0.04361 slater integrals for ag i d9 5s7p nconf=49 z= 47 ion= 0 exf=0.650 irel= 1 ag i d10 7f nconf=56 kut=-1 corrf=0.000 class 0 k rdk( 5s, 7p, 4d, 7f) frac k rek( 5s, 7p, 4d, 7f) frac - ------------------------------------- ----- - ------------------------------------- ----- 2 -0.00044523 ryd = -48.8587 cm-1 -0.407 3 0.00021284 ryd = 23.3564 cm-1 0.906 ag i d9 5s7p -d10 7f 2 -0.0489 5 0.0234 5 49 56 1 0.016 0.023 682.703 sec sqrtdel= 1.0000 1.0000 -0.0489 0.0234 rcn mod 32 ee,eee= -0.01571 -0.04120 slater integrals for ag i d9 5s7p nconf=49 z= 47 ion= 0 exf=0.650 irel= 1 ag i d10 8f nconf=57 kut=-1 corrf=0.000 class 0 k rdk( 5s, 7p, 4d, 8f) frac k rek( 5s, 7p, 4d, 8f) frac - ------------------------------------- ----- - ------------------------------------- ----- 2 -0.00036147 ryd = -39.6665 cm-1 -0.396 3 0.00018224 ryd = 19.9985 cm-1 0.906 ag i d9 5s7p -d10 8f 2 -0.0397 5 0.0200 5 49 57 1 0.203 0.016 682.930 sec sqrtdel= 1.0000 1.0000 -0.0397 0.0200 rcn mod 32 ee,eee= -0.01240 -0.03955 slater integrals for ag i d9 5s7p nconf=49 z= 47 ion= 0 exf=0.650 irel= 1 ag i d10 9f nconf=58 kut=-1 corrf=0.000 class 0 k rdk( 5s, 7p, 4d, 9f) frac k rek( 5s, 7p, 4d, 9f) frac - ------------------------------------- ----- - ------------------------------------- ----- 2 -0.00029974 ryd = -32.8927 cm-1 -0.387 3 0.00015758 ryd = 17.2922 cm-1 0.906 ag i d9 5s7p -d10 9f 2 -0.0329 5 0.0173 5 49 58 1 0.102 0.031 683.063 sec sqrtdel= 1.0000 1.0000 -0.0329 0.0173 rcn mod 32 ee,eee= -0.06669 -0.03334 ee,eee= -0.06339 -0.06504 slater integrals for ag i d9 5s7p nconf=49 z= 47 ion= 0 exf=0.650 irel= 1 ag i d9 5s4f nconf=59 kut=-1 corrf=0.000 class 0 k rdk( 4d, 7p, 4d, 4f) frac k rek( 4d, 7p, 4d, 4f) frac - ------------------------------------- ----- - ------------------------------------- ----- 2 0.00012967 ryd = 14.2301 cm-1 0.080 1 -0.00015868 ryd = -17.4132 cm-1 -0.617 4 -0.00010078 ryd = -11.0594 cm-1 -0.436 3 -0.00010213 ryd = -11.2077 cm-1 -0.755 ag i d9 5s7p -d9 5s4f 4 0.0142 5 -0.0111 5 -0.0174 5 -0.0112 5 49 59 18 0.484 0.023 683.570 sec sqrtdel= 1.0000 1.0000 0.0142 -0.0111 -0.0174 -0.0112 rcn mod 32 ee,eee= -0.04058 -0.05364 slater integrals for ag i d9 5s7p nconf=49 z= 47 ion= 0 exf=0.650 irel= 1 ag i d9 5s5f nconf=60 kut=-1 corrf=0.000 class 0 k rdk( 4d, 7p, 4d, 5f) frac k rek( 4d, 7p, 4d, 5f) frac - ------------------------------------- ----- - ------------------------------------- ----- 2 0.00036359 ryd = 39.8991 cm-1 0.291 1 -0.00015393 ryd = -16.8923 cm-1 -0.613 4 -0.00010246 ryd = -11.2442 cm-1 -0.476 3 -0.00009964 ryd = -10.9345 cm-1 -0.750 ag i d9 5s7p -d9 5s5f 4 0.0399 5 -0.0112 5 -0.0169 5 -0.0109 5 49 60 1 0.031 0.023 683.641 sec sqrtdel= 1.0000 1.0000 0.0399 -0.0112 -0.0169 -0.0109 rcn mod 32 ee,eee= -0.02815 -0.04742 slater integrals for ag i d9 5s7p nconf=49 z= 47 ion= 0 exf=0.650 irel= 1 ag i d9 5s6f nconf=61 kut=-1 corrf=0.000 class 0 k rdk( 4d, 7p, 4d, 6f) frac k rek( 4d, 7p, 4d, 6f) frac - ------------------------------------- ----- - ------------------------------------- ----- 2 0.00029067 ryd = 31.8970 cm-1 0.288 1 -0.00013512 ryd = -14.8272 cm-1 -0.611 4 -0.00009300 ryd = -10.2058 cm-1 -0.500 3 -0.00008772 ryd = -9.6258 cm-1 -0.748 ag i d9 5s7p -d9 5s6f 4 0.0319 5 -0.0102 5 -0.0148 5 -0.0096 5 49 61 1 0.031 0.031 683.742 sec sqrtdel= 1.0000 1.0000 0.0319 -0.0102 -0.0148 -0.0096 rcn mod 32 ee,eee= -0.02066 -0.04367 slater integrals for ag i d9 5s7p nconf=49 z= 47 ion= 0 exf=0.650 irel= 1 ag i d9 5s7f nconf=62 kut=-1 corrf=0.000 class 0 k rdk( 4d, 7p, 4d, 7f) frac k rek( 4d, 7p, 4d, 7f) frac - ------------------------------------- ----- - ------------------------------------- ----- 2 0.00022435 ryd = 24.6201 cm-1 0.269 1 -0.00011660 ryd = -12.7951 cm-1 -0.609 4 -0.00008198 ryd = -8.9966 cm-1 -0.516 3 -0.00007583 ryd = -8.3212 cm-1 -0.747 ag i d9 5s7p -d9 5s7f 4 0.0246 5 -0.0090 5 -0.0128 5 -0.0083 5 49 62 1 0.031 0.070 683.852 sec sqrtdel= 1.0000 1.0000 0.0246 -0.0090 -0.0128 -0.0083 rcn mod 32 ee,eee= -0.01580 -0.04124 slater integrals for ag i d9 5s7p nconf=49 z= 47 ion= 0 exf=0.650 irel= 1 ag i d9 5s8f nconf=63 kut=-1 corrf=0.000 class 0 k rdk( 4d, 7p, 4d, 8f) frac k rek( 4d, 7p, 4d, 8f) frac - ------------------------------------- ----- - ------------------------------------- ----- 2 0.00017672 ryd = 19.3932 cm-1 0.253 1 -0.00010084 ryd = -11.0662 cm-1 -0.609 4 -0.00007193 ryd = -7.8933 cm-1 -0.527 3 -0.00006566 ryd = -7.2052 cm-1 -0.746 ag i d9 5s7p -d9 5s8f 4 0.0194 5 -0.0079 5 -0.0111 5 -0.0072 5 49 63 1 0.031 0.039 683.922 sec sqrtdel= 1.0000 1.0000 0.0194 -0.0079 -0.0111 -0.0072 rcn mod 32 ee,eee= -0.01247 -0.03958 slater integrals for ag i d9 5s7p nconf=49 z= 47 ion= 0 exf=0.650 irel= 1 ag i d9 5s9f nconf=64 kut=-1 corrf=0.000 class 0 k rdk( 4d, 7p, 4d, 9f) frac k rek( 4d, 7p, 4d, 9f) frac - ------------------------------------- ----- - ------------------------------------- ----- 2 0.00014278 ryd = 15.6681 cm-1 0.239 1 -0.00008788 ryd = -9.6436 cm-1 -0.608 4 -0.00006333 ryd = -6.9492 cm-1 -0.534 3 -0.00005727 ryd = -6.2842 cm-1 -0.746 ag i d9 5s7p -d9 5s9f 4 0.0157 5 -0.0069 5 -0.0096 5 -0.0063 5 49 64 1 0.031 0.031 683.992 sec sqrtdel= 1.0000 1.0000 0.0157 -0.0069 -0.0096 -0.0063 rcn mod 32 ee,eee= -0.06347 -0.06508 slater integrals for ag i d9 5s7p nconf=49 z= 47 ion= 0 exf=0.650 irel= 1 ag i d8 5s2 4f nconf=65 kut=-1 corrf=0.000 class 0 k rdk( 4d, 7p, 5s, 4f) frac k rek( 4d, 7p, 5s, 4f) frac - ------------------------------------- ----- - ------------------------------------- ----- 2 -0.00022513 ryd = -24.7048 cm-1 -0.107 1 0.00045905 ryd = 50.3754 cm-1 0.919 ag i d9 5s7p -d8 5s2 4f 2 -0.0247 5 0.0504 5 49 65 1 0.031 0.016 684.047 sec sqrtdel= 1.0000 1.0000 -0.0247 0.0504 rcn mod 32 ee,eee= -0.02778 -0.04723 slater integrals for ag i d9 5s7p nconf=49 z= 47 ion= 0 exf=0.650 irel= 1 ag i d9 5s6h nconf=70 kut=-1 corrf=0.000 class 0 k rdk( 4d, 7p, 4d, 6h) frac k rek( 4d, 7p, 4d, 6h) frac - ------------------------------------- ----- - ------------------------------------- ----- 4 -0.00000037 ryd = -0.0409 cm-1 -0.133 3 -0.00000016 ryd = -0.0176 cm-1 -0.906 ag i d9 5s7p -d9 5s6h 2 0.0000 5 0.0000 5 49 70 5 0.109 0.023 684.195 sec sqrtdel= 1.0000 1.0000 0.0000 0.0000 rcn mod 32 ee,eee= -0.02041 -0.04355 slater integrals for ag i d9 5s7p nconf=49 z= 47 ion= 0 exf=0.650 irel= 1 ag i d9 5s7h nconf=71 kut=-1 corrf=0.000 class 0 k rdk( 4d, 7p, 4d, 7h) frac k rek( 4d, 7p, 4d, 7h) frac - ------------------------------------- ----- - ------------------------------------- ----- 4 -0.00000015 ryd = -0.0167 cm-1 -0.052 3 -0.00000019 ryd = -0.0209 cm-1 -0.906 ag i d9 5s7p -d9 5s7h 2 0.0000 5 0.0000 5 49 71 1 0.023 0.023 684.250 sec sqrtdel= 1.0000 1.0000 0.0000 0.0000 rcn mod 32 ee,eee= -0.01563 -0.04116 slater integrals for ag i d9 5s7p nconf=49 z= 47 ion= 0 exf=0.650 irel= 1 ag i d9 5s8h nconf=72 kut=-1 corrf=0.000 class 0 k rdk( 4d, 7p, 4d, 8h) frac k rek( 4d, 7p, 4d, 8h) frac - ------------------------------------- ----- - ------------------------------------- ----- 4 -0.00000001 ryd = -0.0007 cm-1 -0.002 3 -0.00000019 ryd = -0.0211 cm-1 -0.906 ag i d9 5s7p -d9 5s8h 2 0.0000 5 0.0000 5 49 72 1 0.031 0.023 684.305 sec sqrtdel= 1.0000 1.0000 0.0000 0.0000 rcn mod 32 ee,eee= -0.01235 -0.03952 slater integrals for ag i d9 5s7p nconf=49 z= 47 ion= 0 exf=0.650 irel= 1 ag i d9 5s9h nconf=73 kut=-1 corrf=0.000 class 0 k rdk( 4d, 7p, 4d, 9h) frac k rek( 4d, 7p, 4d, 9h) frac - ------------------------------------- ----- - ------------------------------------- ----- 4 0.00000007 ryd = 0.0082 cm-1 0.030 3 -0.00000018 ryd = -0.0201 cm-1 -0.906 ag i d9 5s7p -d9 5s9h 2 0.0000 5 0.0000 5 49 73 1 0.031 0.023 684.367 sec sqrtdel= 1.0000 1.0000 0.0000 0.0000 rcn mod 32 ee,eee= -0.04193 -0.02097 ee,eee= -0.02883 -0.03538 slater integrals for ag i d9 5s8p nconf=50 z= 47 ion= 0 exf=0.650 irel= 1 ag i d9 5s9p nconf=51 kut=-1 corrf=0.000 class 11 k rdk( 4d, 8p, 4d, 9p) frac k rek( 4d, 8p, 4d, 9p) frac - ------------------------------------- ----- - ------------------------------------- ----- 0 0.02481503 ryd = 2723.1341 cm-1 0.486 1 0.00084971 ryd = 93.2454 cm-1 0.528 2 0.00243831 ryd = 267.5737 cm-1 0.991 3 0.00073044 ryd = 80.1566 cm-1 0.813 - ------------------------------------- ----- - ------------------------------------- ----- 0 0.02481499 ryd = 2723.1307 cm-1 0.486 1 0.00084981 ryd = 93.2555 cm-1 0.528 2 0.00243838 ryd = 267.5817 cm-1 0.991 3 0.00073051 ryd = 80.1637 cm-1 0.813 - ------------------------------------- ----- - ------------------------------------- ----- 0 0.02481506 ryd = 2723.1376 cm-1 0.486 1 0.00084962 ryd = 93.2354 cm-1 0.528 2 0.00243824 ryd = 267.5657 cm-1 0.991 3 0.00073038 ryd = 80.1496 cm-1 0.813 - ------------------------------------- ----- - ------------------------------------- ----- 0 0.02481503 ryd = 2723.1342 cm-1 0.486 1 0.00084972 ryd = 93.2455 cm-1 0.528 2 0.00243831 ryd = 267.5737 cm-1 0.991 3 0.00073044 ryd = 80.1566 cm-1 0.813 9.00000 0.00765 2.00000 1.00000 1.00000 0.00000 -0.03538 0.00000 9.00000 0.00657 2.00000 3.00000 1.00000 0.00000 -0.03538 0.00000 ag i d9 5s8p -d9 5s9p 4 0.0000 5 0.2676 5 0.0932 5 0.0802 5 50 51 10 1.078 0.188 685.641 sec rcn mod 32 ee,eee= -0.04193 -0.02097 ee,eee= -0.02883 -0.03538 slater integrals for ag i d9 5s8p nconf=50 z= 47 ion= 0 exf=0.650 irel= 1 ag i d9 5s9p nconf=51 kut=-1 corrf=0.000 class 11 k rdk( 5s, 8p, 5s, 9p) frac k rek( 5s, 8p, 5s, 9p) frac - ------------------------------------- ----- - ------------------------------------- ----- 0 0.02375511 ryd = 2606.8215 cm-1 0.476 1 0.00344425 ryd = 377.9630 cm-1 0.846 - ------------------------------------- ----- - ------------------------------------- ----- 0 0.02375462 ryd = 2606.7685 cm-1 0.476 1 0.00344359 ryd = 377.8905 cm-1 0.846 - ------------------------------------- ----- - ------------------------------------- ----- 0 0.02375560 ryd = 2606.8754 cm-1 0.476 1 0.00344496 ryd = 378.0404 cm-1 0.846 - ------------------------------------- ----- - ------------------------------------- ----- 0 0.02375511 ryd = 2606.8219 cm-1 0.476 1 0.00344427 ryd = 377.9655 cm-1 0.846 1.00000 0.00344 0.00000 1.00000 1.00000 0.00000 -0.03538 0.00000 ag i d9 5s8p -d9 5s9p 2 0.0000 5 0.3780 5 50 51 10 0.289 0.063 685.992 sec sqrtdel= 1.0000 1.0000 0.0000 0.2676 0.0932 0.0802 0.0000 0.3780 rcn mod 32 ee,eee= -0.04193 -0.02097 ee,eee= -0.43413 -0.23803 slater integrals for ag i d9 5s8p nconf=50 z= 47 ion= 0 exf=0.650 irel= 1 ag i d8 5s2 5p nconf=52 kut=-1 corrf=0.000 class 0 k rdk( 4d, 8p, 5s, 5p) frac k rek( 4d, 8p, 5s, 5p) frac - ------------------------------------- ----- - ------------------------------------- ----- 2 -0.01330008 ryd = -1459.5154 cm-1 -0.739 1 -0.01319142 ryd = -1447.5910 cm-1 -0.627 ag i d9 5s8p -d8 5s2 5p 2 -1.4595 5 -1.4476 5 50 52 11 0.313 0.031 686.336 sec sqrtdel= 1.0000 1.0000 -1.4595 -1.4476 rcn mod 32 ee,eee= -0.04193 -0.02097 ee,eee= -0.06287 -0.05240 slater integrals for ag i d9 5s8p nconf=50 z= 47 ion= 0 exf=0.650 irel= 1 ag i d10 4f nconf=53 kut=-1 corrf=0.000 class 0 k rdk( 5s, 8p, 4d, 4f) frac k rek( 5s, 8p, 4d, 4f) frac - ------------------------------------- ----- - ------------------------------------- ----- 2 -0.00022005 ryd = -24.1478 cm-1 -0.147 3 0.00021205 ryd = 23.2697 cm-1 0.892 ag i d9 5s8p -d10 4f 2 -0.0241 5 0.0233 5 50 53 12 0.367 0.031 686.734 sec sqrtdel= 1.0000 1.0000 -0.0241 0.0233 rcn mod 32 ee,eee= -0.04026 -0.04110 slater integrals for ag i d9 5s8p nconf=50 z= 47 ion= 0 exf=0.650 irel= 1 ag i d10 5f nconf=54 kut=-1 corrf=0.000 class 0 k rdk( 5s, 8p, 4d, 5f) frac k rek( 5s, 8p, 4d, 5f) frac - ------------------------------------- ----- - ------------------------------------- ----- 2 -0.00020670 ryd = -22.6830 cm-1 -0.176 3 0.00019911 ryd = 21.8500 cm-1 0.894 ag i d9 5s8p -d10 5f 2 -0.0227 5 0.0219 5 50 54 1 0.031 0.016 686.781 sec sqrtdel= 1.0000 1.0000 -0.0227 0.0219 rcn mod 32 ee,eee= -0.02795 -0.03494 slater integrals for ag i d9 5s8p nconf=50 z= 47 ion= 0 exf=0.650 irel= 1 ag i d10 6f nconf=55 kut=-1 corrf=0.000 class 0 k rdk( 5s, 8p, 4d, 6f) frac k rek( 5s, 8p, 4d, 6f) frac - ------------------------------------- ----- - ------------------------------------- ----- 2 -0.00028421 ryd = -31.1880 cm-1 -0.315 3 0.00017139 ryd = 18.8083 cm-1 0.895 ag i d9 5s8p -d10 6f 2 -0.0312 5 0.0188 5 50 55 1 0.023 0.016 686.836 sec sqrtdel= 1.0000 1.0000 -0.0312 0.0188 rcn mod 32 ee,eee= -0.02053 -0.03123 slater integrals for ag i d9 5s8p nconf=50 z= 47 ion= 0 exf=0.650 irel= 1 ag i d10 7f nconf=56 kut=-1 corrf=0.000 class 0 k rdk( 5s, 8p, 4d, 7f) frac k rek( 5s, 8p, 4d, 7f) frac - ------------------------------------- ----- - ------------------------------------- ----- 2 -0.00025424 ryd = -27.9000 cm-1 -0.347 3 0.00014594 ryd = 16.0147 cm-1 0.896 ag i d9 5s8p -d10 7f 2 -0.0279 5 0.0160 5 50 56 1 0.031 0.016 686.891 sec sqrtdel= 1.0000 1.0000 -0.0279 0.0160 rcn mod 32 ee,eee= -0.01571 -0.02882 slater integrals for ag i d9 5s8p nconf=50 z= 47 ion= 0 exf=0.650 irel= 1 ag i d10 8f nconf=57 kut=-1 corrf=0.000 class 0 k rdk( 5s, 8p, 4d, 8f) frac k rek( 5s, 8p, 4d, 8f) frac - ------------------------------------- ----- - ------------------------------------- ----- 2 -0.00021743 ryd = -23.8601 cm-1 -0.355 3 0.00012498 ryd = 13.7144 cm-1 0.897 ag i d9 5s8p -d10 8f 2 -0.0239 5 0.0137 5 50 57 1 0.016 0.023 686.945 sec sqrtdel= 1.0000 1.0000 -0.0239 0.0137 rcn mod 32 ee,eee= -0.01240 -0.02717 slater integrals for ag i d9 5s8p nconf=50 z= 47 ion= 0 exf=0.650 irel= 1 ag i d10 9f nconf=58 kut=-1 corrf=0.000 class 0 k rdk( 5s, 8p, 4d, 9f) frac k rek( 5s, 8p, 4d, 9f) frac - ------------------------------------- ----- - ------------------------------------- ----- 2 -0.00018575 ryd = -20.3838 cm-1 -0.357 3 0.00010808 ryd = 11.8599 cm-1 0.897 ag i d9 5s8p -d10 9f 2 -0.0204 5 0.0119 5 50 58 1 0.031 0.023 687.016 sec sqrtdel= 1.0000 1.0000 -0.0204 0.0119 rcn mod 32 ee,eee= -0.04193 -0.02097 ee,eee= -0.06339 -0.05266 slater integrals for ag i d9 5s8p nconf=50 z= 47 ion= 0 exf=0.650 irel= 1 ag i d9 5s4f nconf=59 kut=-1 corrf=0.000 class 0 k rdk( 4d, 8p, 4d, 4f) frac k rek( 4d, 8p, 4d, 4f) frac - ------------------------------------- ----- - ------------------------------------- ----- 2 0.00008138 ryd = 8.9309 cm-1 0.076 1 -0.00011020 ryd = -12.0933 cm-1 -0.613 4 -0.00006903 ryd = -7.5749 cm-1 -0.431 3 -0.00007100 ryd = -7.7918 cm-1 -0.752 ag i d9 5s8p -d9 5s4f 4 0.0089 5 -0.0076 5 -0.0121 5 -0.0078 5 50 59 18 1.016 0.086 688.117 sec sqrtdel= 1.0000 1.0000 0.0089 -0.0076 -0.0121 -0.0078 rcn mod 32 ee,eee= -0.04058 -0.04126 slater integrals for ag i d9 5s8p nconf=50 z= 47 ion= 0 exf=0.650 irel= 1 ag i d9 5s5f nconf=60 kut=-1 corrf=0.000 class 0 k rdk( 4d, 8p, 4d, 5f) frac k rek( 4d, 8p, 4d, 5f) frac - ------------------------------------- ----- - ------------------------------------- ----- 2 0.00007187 ryd = 7.8871 cm-1 0.083 1 -0.00010693 ryd = -11.7343 cm-1 -0.609 4 -0.00007054 ryd = -7.7411 cm-1 -0.472 3 -0.00006930 ryd = -7.6043 cm-1 -0.747 ag i d9 5s8p -d9 5s5f 4 0.0079 5 -0.0077 5 -0.0117 5 -0.0076 5 50 60 1 0.016 0.055 688.195 sec sqrtdel= 1.0000 1.0000 0.0079 -0.0077 -0.0117 -0.0076 rcn mod 32 ee,eee= -0.02815 -0.03504 slater integrals for ag i d9 5s8p nconf=50 z= 47 ion= 0 exf=0.650 irel= 1 ag i d9 5s6f nconf=61 kut=-1 corrf=0.000 class 0 k rdk( 4d, 8p, 4d, 6f) frac k rek( 4d, 8p, 4d, 6f) frac - ------------------------------------- ----- - ------------------------------------- ----- 2 0.00013245 ryd = 14.5342 cm-1 0.194 1 -0.00009387 ryd = -10.3010 cm-1 -0.607 4 -0.00006356 ryd = -6.9745 cm-1 -0.493 3 -0.00006101 ryd = -6.6952 cm-1 -0.745 ag i d9 5s8p -d9 5s6f 4 0.0145 5 -0.0070 5 -0.0103 5 -0.0067 5 50 61 1 0.031 0.039 688.266 sec sqrtdel= 1.0000 1.0000 0.0145 -0.0070 -0.0103 -0.0067 rcn mod 32 ee,eee= -0.02066 -0.03130 slater integrals for ag i d9 5s8p nconf=50 z= 47 ion= 0 exf=0.650 irel= 1 ag i d9 5s7f nconf=62 kut=-1 corrf=0.000 class 0 k rdk( 4d, 8p, 4d, 7f) frac k rek( 4d, 8p, 4d, 7f) frac - ------------------------------------- ----- - ------------------------------------- ----- 2 0.00011956 ryd = 13.1198 cm-1 0.213 1 -0.00008101 ryd = -8.8898 cm-1 -0.606 4 -0.00005583 ryd = -6.1268 cm-1 -0.507 3 -0.00005275 ryd = -5.7883 cm-1 -0.744 ag i d9 5s8p -d9 5s7f 4 0.0131 5 -0.0061 5 -0.0089 5 -0.0058 5 50 62 1 0.031 0.023 688.320 sec sqrtdel= 1.0000 1.0000 0.0131 -0.0061 -0.0089 -0.0058 rcn mod 32 ee,eee= -0.01580 -0.02887 slater integrals for ag i d9 5s8p nconf=50 z= 47 ion= 0 exf=0.650 irel= 1 ag i d9 5s8f nconf=63 kut=-1 corrf=0.000 class 0 k rdk( 4d, 8p, 4d, 8f) frac k rek( 4d, 8p, 4d, 8f) frac - ------------------------------------- ----- - ------------------------------------- ----- 2 0.00010111 ryd = 11.0954 cm-1 0.214 1 -0.00007007 ryd = -7.6890 cm-1 -0.605 4 -0.00004889 ryd = -5.3654 cm-1 -0.516 3 -0.00004568 ryd = -5.0124 cm-1 -0.744 ag i d9 5s8p -d9 5s8f 4 0.0111 5 -0.0054 5 -0.0077 5 -0.0050 5 50 63 1 0.031 0.188 688.555 sec sqrtdel= 1.0000 1.0000 0.0111 -0.0054 -0.0077 -0.0050 rcn mod 32 ee,eee= -0.01247 -0.02720 slater integrals for ag i d9 5s8p nconf=50 z= 47 ion= 0 exf=0.650 irel= 1 ag i d9 5s9f nconf=64 kut=-1 corrf=0.000 class 0 k rdk( 4d, 8p, 4d, 9f) frac k rek( 4d, 8p, 4d, 9f) frac - ------------------------------------- ----- - ------------------------------------- ----- 2 0.00008515 ryd = 9.3437 cm-1 0.211 1 -0.00006106 ryd = -6.7007 cm-1 -0.605 4 -0.00004300 ryd = -4.7184 cm-1 -0.523 3 -0.00003984 ryd = -4.3719 cm-1 -0.743 ag i d9 5s8p -d9 5s9f 4 0.0093 5 -0.0047 5 -0.0067 5 -0.0044 5 50 64 1 0.031 0.031 688.617 sec sqrtdel= 1.0000 1.0000 0.0093 -0.0047 -0.0067 -0.0044 rcn mod 32 ee,eee= -0.06347 -0.05270 slater integrals for ag i d9 5s8p nconf=50 z= 47 ion= 0 exf=0.650 irel= 1 ag i d8 5s2 4f nconf=65 kut=-1 corrf=0.000 class 0 k rdk( 4d, 8p, 5s, 4f) frac k rek( 4d, 8p, 5s, 4f) frac - ------------------------------------- ----- - ------------------------------------- ----- 2 -0.00014544 ryd = -15.9599 cm-1 -0.103 1 0.00031409 ryd = 34.4671 cm-1 0.907 ag i d9 5s8p -d8 5s2 4f 2 -0.0160 5 0.0345 5 50 65 1 0.031 0.016 688.672 sec sqrtdel= 1.0000 1.0000 -0.0160 0.0345 rcn mod 32 ee,eee= -0.02778 -0.03486 slater integrals for ag i d9 5s8p nconf=50 z= 47 ion= 0 exf=0.650 irel= 1 ag i d9 5s6h nconf=70 kut=-1 corrf=0.000 class 0 k rdk( 4d, 8p, 4d, 6h) frac k rek( 4d, 8p, 4d, 6h) frac - ------------------------------------- ----- - ------------------------------------- ----- 4 0.00000014 ryd = 0.0152 cm-1 0.076 3 -0.00000011 ryd = -0.0121 cm-1 -0.897 ag i d9 5s8p -d9 5s6h 2 0.0000 5 0.0000 5 50 70 5 0.125 0.016 688.820 sec sqrtdel= 1.0000 1.0000 0.0000 0.0000 rcn mod 32 ee,eee= -0.02041 -0.03117 slater integrals for ag i d9 5s8p nconf=50 z= 47 ion= 0 exf=0.650 irel= 1 ag i d9 5s7h nconf=71 kut=-1 corrf=0.000 class 0 k rdk( 4d, 8p, 4d, 7h) frac k rek( 4d, 8p, 4d, 7h) frac - ------------------------------------- ----- - ------------------------------------- ----- 4 0.00000006 ryd = 0.0071 cm-1 0.034 3 -0.00000013 ryd = -0.0144 cm-1 -0.898 ag i d9 5s8p -d9 5s7h 2 0.0000 5 0.0000 5 50 71 1 0.031 0.016 688.883 sec sqrtdel= 1.0000 1.0000 0.0000 0.0000 rcn mod 32 ee,eee= -0.01563 -0.02878 slater integrals for ag i d9 5s8p nconf=50 z= 47 ion= 0 exf=0.650 irel= 1 ag i d9 5s8h nconf=72 kut=-1 corrf=0.000 class 0 k rdk( 4d, 8p, 4d, 8h) frac k rek( 4d, 8p, 4d, 8h) frac - ------------------------------------- ----- - ------------------------------------- ----- 4 0.00000005 ryd = 0.0056 cm-1 0.029 3 -0.00000013 ryd = -0.0145 cm-1 -0.898 ag i d9 5s8p -d9 5s8h 2 0.0000 5 0.0000 5 50 72 1 0.031 0.063 688.977 sec sqrtdel= 1.0000 1.0000 0.0000 0.0000 rcn mod 32 ee,eee= -0.01235 -0.02714 slater integrals for ag i d9 5s8p nconf=50 z= 47 ion= 0 exf=0.650 irel= 1 ag i d9 5s9h nconf=73 kut=-1 corrf=0.000 class 0 k rdk( 4d, 8p, 4d, 9h) frac k rek( 4d, 8p, 4d, 9h) frac - ------------------------------------- ----- - ------------------------------------- ----- 4 0.00000005 ryd = 0.0055 cm-1 0.031 3 -0.00000013 ryd = -0.0138 cm-1 -0.898 ag i d9 5s8p -d9 5s9h 2 0.0000 5 0.0000 5 50 73 1 0.031 0.031 689.047 sec sqrtdel= 1.0000 1.0000 0.0000 0.0000 rcn mod 32 ee,eee= -0.02883 -0.01442 ee,eee= -0.43413 -0.23148 slater integrals for ag i d9 5s9p nconf=51 z= 47 ion= 0 exf=0.650 irel= 1 ag i d8 5s2 5p nconf=52 kut=-1 corrf=0.000 class 0 k rdk( 4d, 9p, 5s, 5p) frac k rek( 4d, 9p, 5s, 5p) frac - ------------------------------------- ----- - ------------------------------------- ----- 2 -0.00985976 ryd = -1081.9839 cm-1 -0.732 1 -0.00979913 ryd = -1075.3302 cm-1 -0.621 ag i d9 5s9p -d8 5s2 5p 2 -1.0820 5 -1.0753 5 51 52 11 0.313 0.016 689.391 sec sqrtdel= 1.0000 1.0000 -1.0820 -1.0753 rcn mod 32 ee,eee= -0.02883 -0.01442 ee,eee= -0.06287 -0.04585 slater integrals for ag i d9 5s9p nconf=51 z= 47 ion= 0 exf=0.650 irel= 1 ag i d10 4f nconf=53 kut=-1 corrf=0.000 class 0 k rdk( 5s, 9p, 4d, 4f) frac k rek( 5s, 9p, 4d, 4f) frac - ------------------------------------- ----- - ------------------------------------- ----- 2 -0.00015508 ryd = -17.0181 cm-1 -0.140 3 0.00015756 ryd = 17.2907 cm-1 0.886 ag i d9 5s9p -d10 4f 2 -0.0170 5 0.0173 5 51 53 12 0.430 0.227 690.063 sec sqrtdel= 1.0000 1.0000 -0.0170 0.0173 rcn mod 32 ee,eee= -0.04026 -0.03455 slater integrals for ag i d9 5s9p nconf=51 z= 47 ion= 0 exf=0.650 irel= 1 ag i d10 5f nconf=54 kut=-1 corrf=0.000 class 0 k rdk( 5s, 9p, 4d, 5f) frac k rek( 5s, 9p, 4d, 5f) frac - ------------------------------------- ----- - ------------------------------------- ----- 2 -0.00014932 ryd = -16.3856 cm-1 -0.173 3 0.00014801 ryd = 16.2420 cm-1 0.888 ag i d9 5s9p -d10 5f 2 -0.0164 5 0.0162 5 51 54 1 0.031 0.047 690.141 sec sqrtdel= 1.0000 1.0000 -0.0164 0.0162 rcn mod 32 ee,eee= -0.02795 -0.02839 slater integrals for ag i d9 5s9p nconf=51 z= 47 ion= 0 exf=0.650 irel= 1 ag i d10 6f nconf=55 kut=-1 corrf=0.000 class 0 k rdk( 5s, 9p, 4d, 6f) frac k rek( 5s, 9p, 4d, 6f) frac - ------------------------------------- ----- - ------------------------------------- ----- 2 -0.00012876 ryd = -14.1300 cm-1 -0.189 3 0.00012743 ryd = 13.9837 cm-1 0.890 ag i d9 5s9p -d10 6f 2 -0.0141 5 0.0140 5 51 55 1 0.023 0.016 690.195 sec sqrtdel= 1.0000 1.0000 -0.0141 0.0140 rcn mod 32 ee,eee= -0.02053 -0.02468 slater integrals for ag i d9 5s9p nconf=51 z= 47 ion= 0 exf=0.650 irel= 1 ag i d10 7f nconf=56 kut=-1 corrf=0.000 class 0 k rdk( 5s, 9p, 4d, 7f) frac k rek( 5s, 9p, 4d, 7f) frac - ------------------------------------- ----- - ------------------------------------- ----- 2 -0.00014776 ryd = -16.2149 cm-1 -0.272 3 0.00010852 ryd = 11.9082 cm-1 0.891 ag i d9 5s9p -d10 7f 2 -0.0162 5 0.0119 5 51 56 1 0.031 0.023 690.266 sec sqrtdel= 1.0000 1.0000 -0.0162 0.0119 rcn mod 32 ee,eee= -0.01571 -0.02227 slater integrals for ag i d9 5s9p nconf=51 z= 47 ion= 0 exf=0.650 irel= 1 ag i d10 8f nconf=57 kut=-1 corrf=0.000 class 0 k rdk( 5s, 9p, 4d, 8f) frac k rek( 5s, 9p, 4d, 8f) frac - ------------------------------------- ----- - ------------------------------------- ----- 2 -0.00013544 ryd = -14.8625 cm-1 -0.301 3 0.00009294 ryd = 10.1986 cm-1 0.891 ag i d9 5s9p -d10 8f 2 -0.0149 5 0.0102 5 51 57 1 0.031 0.023 690.320 sec sqrtdel= 1.0000 1.0000 -0.0149 0.0102 rcn mod 32 ee,eee= -0.01240 -0.02062 slater integrals for ag i d9 5s9p nconf=51 z= 47 ion= 0 exf=0.650 irel= 1 ag i d10 9f nconf=58 kut=-1 corrf=0.000 class 0 k rdk( 5s, 9p, 4d, 9f) frac k rek( 5s, 9p, 4d, 9f) frac - ------------------------------------- ----- - ------------------------------------- ----- 2 -0.00011966 ryd = -13.1316 cm-1 -0.313 3 0.00008037 ryd = 8.8200 cm-1 0.892 ag i d9 5s9p -d10 9f 2 -0.0131 5 0.0088 5 51 58 1 0.031 0.023 690.375 sec sqrtdel= 1.0000 1.0000 -0.0131 0.0088 rcn mod 32 ee,eee= -0.02883 -0.01442 ee,eee= -0.06339 -0.04611 slater integrals for ag i d9 5s9p nconf=51 z= 47 ion= 0 exf=0.650 irel= 1 ag i d9 5s4f nconf=59 kut=-1 corrf=0.000 class 0 k rdk( 4d, 9p, 4d, 4f) frac k rek( 4d, 9p, 4d, 4f) frac - ------------------------------------- ----- - ------------------------------------- ----- 2 0.00005445 ryd = 5.9749 cm-1 0.068 1 -0.00008253 ryd = -9.0561 cm-1 -0.611 4 -0.00005122 ryd = -5.6208 cm-1 -0.428 3 -0.00005320 ryd = -5.8380 cm-1 -0.750 ag i d9 5s9p -d9 5s4f 4 0.0060 5 -0.0056 5 -0.0091 5 -0.0058 5 51 59 18 0.602 0.031 691.016 sec sqrtdel= 1.0000 1.0000 0.0060 -0.0056 -0.0091 -0.0058 rcn mod 32 ee,eee= -0.04058 -0.03471 slater integrals for ag i d9 5s9p nconf=51 z= 47 ion= 0 exf=0.650 irel= 1 ag i d9 5s5f nconf=60 kut=-1 corrf=0.000 class 0 k rdk( 4d, 9p, 4d, 5f) frac k rek( 4d, 9p, 4d, 5f) frac - ------------------------------------- ----- - ------------------------------------- ----- 2 0.00005015 ryd = 5.5037 cm-1 0.078 1 -0.00008009 ryd = -8.7883 cm-1 -0.607 4 -0.00005235 ryd = -5.7447 cm-1 -0.468 3 -0.00005193 ryd = -5.6985 cm-1 -0.746 ag i d9 5s9p -d9 5s5f 4 0.0055 5 -0.0057 5 -0.0088 5 -0.0057 5 51 60 1 0.031 0.070 691.125 sec sqrtdel= 1.0000 1.0000 0.0055 -0.0057 -0.0088 -0.0057 rcn mod 32 ee,eee= -0.02815 -0.02849 slater integrals for ag i d9 5s9p nconf=51 z= 47 ion= 0 exf=0.650 irel= 1 ag i d9 5s6f nconf=61 kut=-1 corrf=0.000 class 0 k rdk( 4d, 9p, 4d, 6f) frac k rek( 4d, 9p, 4d, 6f) frac - ------------------------------------- ----- - ------------------------------------- ----- 2 0.00004170 ryd = 4.5760 cm-1 0.081 1 -0.00007031 ryd = -7.7153 cm-1 -0.605 4 -0.00004722 ryd = -5.1820 cm-1 -0.489 3 -0.00004572 ryd = -5.0177 cm-1 -0.744 ag i d9 5s9p -d9 5s6f 4 0.0046 5 -0.0052 5 -0.0077 5 -0.0050 5 51 61 1 0.031 0.023 691.195 sec sqrtdel= 1.0000 1.0000 0.0046 -0.0052 -0.0077 -0.0050 rcn mod 32 ee,eee= -0.02066 -0.02475 slater integrals for ag i d9 5s9p nconf=51 z= 47 ion= 0 exf=0.650 irel= 1 ag i d9 5s7f nconf=62 kut=-1 corrf=0.000 class 0 k rdk( 4d, 9p, 4d, 7f) frac k rek( 4d, 9p, 4d, 7f) frac - ------------------------------------- ----- - ------------------------------------- ----- 2 0.00006073 ryd = 6.6647 cm-1 0.146 1 -0.00006068 ryd = -6.6586 cm-1 -0.604 4 -0.00004143 ryd = -4.5461 cm-1 -0.502 3 -0.00003953 ryd = -4.3382 cm-1 -0.743 ag i d9 5s9p -d9 5s7f 4 0.0067 5 -0.0045 5 -0.0067 5 -0.0043 5 51 62 1 0.031 0.023 691.266 sec sqrtdel= 1.0000 1.0000 0.0067 -0.0045 -0.0067 -0.0043 rcn mod 32 ee,eee= -0.01580 -0.02232 slater integrals for ag i d9 5s9p nconf=51 z= 47 ion= 0 exf=0.650 irel= 1 ag i d9 5s8f nconf=63 kut=-1 corrf=0.000 class 0 k rdk( 4d, 9p, 4d, 8f) frac k rek( 4d, 9p, 4d, 8f) frac - ------------------------------------- ----- - ------------------------------------- ----- 2 0.00005742 ryd = 6.3013 cm-1 0.165 1 -0.00005248 ryd = -5.7593 cm-1 -0.603 4 -0.00003625 ryd = -3.9777 cm-1 -0.511 3 -0.00003423 ryd = -3.7568 cm-1 -0.742 ag i d9 5s9p -d9 5s8f 4 0.0063 5 -0.0040 5 -0.0058 5 -0.0038 5 51 63 1 0.031 0.016 691.320 sec sqrtdel= 1.0000 1.0000 0.0063 -0.0040 -0.0058 -0.0038 rcn mod 32 ee,eee= -0.01247 -0.02065 slater integrals for ag i d9 5s9p nconf=51 z= 47 ion= 0 exf=0.650 irel= 1 ag i d9 5s9f nconf=64 kut=-1 corrf=0.000 class 0 k rdk( 4d, 9p, 4d, 9f) frac k rek( 4d, 9p, 4d, 9f) frac - ------------------------------------- ----- - ------------------------------------- ----- 2 0.00005092 ryd = 5.5878 cm-1 0.171 1 -0.00004574 ryd = -5.0192 cm-1 -0.603 4 -0.00003186 ryd = -3.4960 cm-1 -0.518 3 -0.00002986 ryd = -3.2768 cm-1 -0.741 ag i d9 5s9p -d9 5s9f 4 0.0056 5 -0.0035 5 -0.0050 5 -0.0033 5 51 64 1 0.031 0.016 691.391 sec sqrtdel= 1.0000 1.0000 0.0056 -0.0035 -0.0050 -0.0033 rcn mod 32 ee,eee= -0.06347 -0.04615 slater integrals for ag i d9 5s9p nconf=51 z= 47 ion= 0 exf=0.650 irel= 1 ag i d8 5s2 4f nconf=65 kut=-1 corrf=0.000 class 0 k rdk( 4d, 9p, 5s, 4f) frac k rek( 4d, 9p, 5s, 4f) frac - ------------------------------------- ----- - ------------------------------------- ----- 2 -0.00010070 ryd = -11.0509 cm-1 -0.097 1 0.00023329 ryd = 25.6001 cm-1 0.900 ag i d9 5s9p -d8 5s2 4f 2 -0.0111 5 0.0256 5 51 65 1 0.031 0.016 691.461 sec sqrtdel= 1.0000 1.0000 -0.0111 0.0256 rcn mod 32 ee,eee= -0.02778 -0.02831 slater integrals for ag i d9 5s9p nconf=51 z= 47 ion= 0 exf=0.650 irel= 1 ag i d9 5s6h nconf=70 kut=-1 corrf=0.000 class 0 k rdk( 4d, 9p, 4d, 6h) frac k rek( 4d, 9p, 4d, 6h) frac - ------------------------------------- ----- - ------------------------------------- ----- 4 0.00000009 ryd = 0.0100 cm-1 0.069 3 -0.00000008 ryd = -0.0090 cm-1 -0.892 ag i d9 5s9p -d9 5s6h 2 0.0000 5 0.0000 5 51 70 5 0.109 0.031 691.617 sec sqrtdel= 1.0000 1.0000 0.0000 0.0000 rcn mod 32 ee,eee= -0.02041 -0.02462 slater integrals for ag i d9 5s9p nconf=51 z= 47 ion= 0 exf=0.650 irel= 1 ag i d9 5s7h nconf=71 kut=-1 corrf=0.000 class 0 k rdk( 4d, 9p, 4d, 7h) frac k rek( 4d, 9p, 4d, 7h) frac - ------------------------------------- ----- - ------------------------------------- ----- 4 0.00000011 ryd = 0.0120 cm-1 0.079 3 -0.00000010 ryd = -0.0107 cm-1 -0.893 ag i d9 5s9p -d9 5s7h 2 0.0000 5 0.0000 5 51 71 1 0.031 0.023 691.680 sec sqrtdel= 1.0000 1.0000 0.0000 0.0000 rcn mod 32 ee,eee= -0.01563 -0.02223 slater integrals for ag i d9 5s9p nconf=51 z= 47 ion= 0 exf=0.650 irel= 1 ag i d9 5s8h nconf=72 kut=-1 corrf=0.000 class 0 k rdk( 4d, 9p, 4d, 8h) frac k rek( 4d, 9p, 4d, 8h) frac - ------------------------------------- ----- - ------------------------------------- ----- 4 0.00000009 ryd = 0.0099 cm-1 0.069 3 -0.00000010 ryd = -0.0108 cm-1 -0.893 ag i d9 5s9p -d9 5s8h 2 0.0000 5 0.0000 5 51 72 1 0.031 0.016 691.742 sec sqrtdel= 1.0000 1.0000 0.0000 0.0000 rcn mod 32 ee,eee= -0.01235 -0.02059 slater integrals for ag i d9 5s9p nconf=51 z= 47 ion= 0 exf=0.650 irel= 1 ag i d9 5s9h nconf=73 kut=-1 corrf=0.000 class 0 k rdk( 4d, 9p, 4d, 9h) frac k rek( 4d, 9p, 4d, 9h) frac - ------------------------------------- ----- - ------------------------------------- ----- 4 0.00000008 ryd = 0.0084 cm-1 0.064 3 -0.00000009 ryd = -0.0103 cm-1 -0.893 ag i d9 5s9p -d9 5s9h 2 0.0000 5 0.0000 5 51 73 1 0.031 0.070 691.844 sec sqrtdel= 1.0000 1.0000 0.0000 0.0000 rcn mod 32 ee,eee= -0.43413 -0.21707 ee,eee= -0.06339 -0.24876 slater integrals for ag i d8 5s2 5p nconf=52 z= 47 ion= 0 exf=0.650 irel= 1 ag i d9 5s4f nconf=59 kut=-1 corrf=0.000 class 0 k rdk( 5s, 5p, 4d, 4f) frac k rek( 5s, 5p, 4d, 4f) frac - ------------------------------------- ----- - ------------------------------------- ----- 2 0.00409758 ryd = 449.6576 cm-1 0.944 3 0.00168540 ryd = 184.9516 cm-1 0.954 ag i d8 5s2 5p -d9 5s4f 2 0.4497 5 0.1850 5 52 59 18 0.805 0.047 692.727 sec sqrtdel= 1.0000 1.0000 0.4497 0.1850 rcn mod 32 ee,eee= -0.04058 -0.23736 slater integrals for ag i d8 5s2 5p nconf=52 z= 47 ion= 0 exf=0.650 irel= 1 ag i d9 5s5f nconf=60 kut=-1 corrf=0.000 class 0 k rdk( 5s, 5p, 4d, 5f) frac k rek( 5s, 5p, 4d, 5f) frac - ------------------------------------- ----- - ------------------------------------- ----- 2 0.00378062 ryd = 414.8750 cm-1 0.943 3 0.00160703 ryd = 176.3516 cm-1 0.953 ag i d8 5s2 5p -d9 5s5f 2 0.4149 5 0.1764 5 52 60 1 0.180 0.023 692.945 sec sqrtdel= 1.0000 1.0000 0.4149 0.1764 rcn mod 32 ee,eee= -0.02815 -0.23114 slater integrals for ag i d8 5s2 5p nconf=52 z= 47 ion= 0 exf=0.650 irel= 1 ag i d9 5s6f nconf=61 kut=-1 corrf=0.000 class 0 k rdk( 5s, 5p, 4d, 6f) frac k rek( 5s, 5p, 4d, 6f) frac - ------------------------------------- ----- - ------------------------------------- ----- 2 0.00323274 ryd = 354.7517 cm-1 0.942 3 0.00139825 ryd = 153.4403 cm-1 0.952 ag i d8 5s2 5p -d9 5s6f 2 0.3548 5 0.1534 5 52 61 1 0.039 0.094 693.086 sec sqrtdel= 1.0000 1.0000 0.3548 0.1534 rcn mod 32 ee,eee= -0.02066 -0.22740 slater integrals for ag i d8 5s2 5p nconf=52 z= 47 ion= 0 exf=0.650 irel= 1 ag i d9 5s7f nconf=62 kut=-1 corrf=0.000 class 0 k rdk( 5s, 5p, 4d, 7f) frac k rek( 5s, 5p, 4d, 7f) frac - ------------------------------------- ----- - ------------------------------------- ----- 2 0.00274550 ryd = 301.2841 cm-1 0.942 3 0.00120024 ryd = 131.7113 cm-1 0.952 ag i d8 5s2 5p -d9 5s7f 2 0.3013 5 0.1317 5 52 62 1 0.031 0.016 693.133 sec sqrtdel= 1.0000 1.0000 0.3013 0.1317 rcn mod 32 ee,eee= -0.01580 -0.22497 slater integrals for ag i d8 5s2 5p nconf=52 z= 47 ion= 0 exf=0.650 irel= 1 ag i d9 5s8f nconf=63 kut=-1 corrf=0.000 class 0 k rdk( 5s, 5p, 4d, 8f) frac k rek( 5s, 5p, 4d, 8f) frac - ------------------------------------- ----- - ------------------------------------- ----- 2 0.00234930 ryd = 257.8057 cm-1 0.942 3 0.00103442 ryd = 113.5142 cm-1 0.952 ag i d8 5s2 5p -d9 5s8f 2 0.2578 5 0.1135 5 52 63 1 0.031 0.008 693.180 sec sqrtdel= 1.0000 1.0000 0.2578 0.1135 rcn mod 32 ee,eee= -0.01247 -0.22330 slater integrals for ag i d8 5s2 5p nconf=52 z= 47 ion= 0 exf=0.650 irel= 1 ag i d9 5s9f nconf=64 kut=-1 corrf=0.000 class 0 k rdk( 5s, 5p, 4d, 9f) frac k rek( 5s, 5p, 4d, 9f) frac - ------------------------------------- ----- - ------------------------------------- ----- 2 0.00203176 ryd = 222.9599 cm-1 0.941 3 0.00089920 ryd = 98.6755 cm-1 0.952 ag i d8 5s2 5p -d9 5s9f 2 0.2230 5 0.0987 5 52 64 1 0.031 0.016 693.242 sec sqrtdel= 1.0000 1.0000 0.2230 0.0987 rcn mod 32 ee,eee= -0.43413 -0.21707 ee,eee= -0.06347 -0.24880 slater integrals for ag i d8 5s2 5p nconf=52 z= 47 ion= 0 exf=0.650 irel= 1 ag i d8 5s2 4f nconf=65 kut=-1 corrf=0.000 class 0 k rdk( 4d, 5p, 4d, 4f) frac k rek( 4d, 5p, 4d, 4f) frac - ------------------------------------- ----- - ------------------------------------- ----- 2 -0.00349964 ryd = -384.0413 cm-1 -0.958 1 -0.00071107 ryd = -78.0314 cm-1 -0.591 4 -0.00093428 ryd = -102.5253 cm-1 -0.903 3 -0.00046090 ryd = -50.5777 cm-1 -0.721 ag i d8 5s2 5p -d8 5s2 4f 4 -0.3840 5 -0.1025 5 -0.0780 5 -0.0506 5 52 65 24 0.883 0.031 694.164 sec sqrtdel= 1.0000 1.0000 -0.3840 -0.1025 -0.0780 -0.0506 rcn mod 32 ee,eee= -1.68421 -0.84210 ee,eee= -1.08586 -1.38503 slater integrals for ag i d10 4f nconf=53 z= 47 ion= 0 exf=0.650 irel= 1 ag i d9 5s4f nconf=59 kut=-1 corrf=0.000 class 0 k rdk( 4d, 4d, 4d, 5s) frac k rek( 4d, 4d, 4d, 5s) frac - ------------------------------------- ----- - ------------------------------------- ----- 2 -0.13770095 ryd = -15110.9322 cm-1 -0.475 2 -0.13770122 ryd = -15110.9613 cm-1 -0.475 ag i d10 4f -d9 5s4f 1 -15.1109 5 53 59 18 0.914 0.055 695.180 sec rcn mod 32 ee,eee= -0.06287 -0.03144 ee,eee= -0.06339 -0.06313 slater integrals for ag i d10 4f nconf=53 z= 47 ion= 0 exf=0.650 irel= 1 ag i d9 5s4f nconf=59 kut=-1 corrf=0.000 class 0 k rdk( 4d, 4f, 5s, 4f) frac k rek( 4d, 4f, 5s, 4f) frac - ------------------------------------- ----- - ------------------------------------- ----- 2 -0.00237721 ryd = -260.8683 cm-1 -0.961 3 -0.00004767 ryd = -5.2313 cm-1 -0.998 ag i d10 4f -d9 5s4f 2 -0.2609 5 -0.0052 5 53 59 18 0.492 0.008 695.680 sec sqrtdel= 1.0000 1.0000 -15.1109 -0.2609 -0.0052 rcn mod 32 ee,eee= -1.68421 -0.84210 ee,eee= -1.13077 -1.40749 slater integrals for ag i d10 4f nconf=53 z= 47 ion= 0 exf=0.650 irel= 1 ag i d9 5s5f nconf=60 kut=-1 corrf=0.000 class 0 k rdk( 4d, 4d, 4d, 5s) frac k rek( 4d, 4d, 4d, 5s) frac - ------------------------------------- ----- - ------------------------------------- ----- 2 0.00000000 ryd = 0.0000 cm-1 0.000 2 0.00000000 ryd = 0.0000 cm-1 0.000 ag i d10 4f -d9 5s5f 1 0.0000 5 53 60 19 0.555 0.063 696.313 sec rcn mod 32 ee,eee= -0.06287 -0.03144 ee,eee= -0.04058 -0.05173 slater integrals for ag i d10 4f nconf=53 z= 47 ion= 0 exf=0.650 irel= 1 ag i d9 5s5f nconf=60 kut=-1 corrf=0.000 class 0 k rdk( 4d, 4f, 5s, 5f) frac k rek( 4d, 4f, 5s, 5f) frac - ------------------------------------- ----- - ------------------------------------- ----- 2 -0.00139326 ryd = -152.8927 cm-1 -0.849 3 -0.00004504 ryd = -4.9429 cm-1 -0.998 ag i d10 4f -d9 5s5f 2 -0.1529 5 -0.0049 5 53 60 19 0.992 0.031 697.336 sec sqrtdel= 1.0000 1.0000 0.0000 -0.1529 -0.0049 rcn mod 32 ee,eee= -1.68421 -0.84210 ee,eee= -1.15523 -1.41972 slater integrals for ag i d10 4f nconf=53 z= 47 ion= 0 exf=0.650 irel= 1 ag i d9 5s6f nconf=61 kut=-1 corrf=0.000 class 0 k rdk( 4d, 4d, 4d, 5s) frac k rek( 4d, 4d, 4d, 5s) frac - ------------------------------------- ----- - ------------------------------------- ----- 2 0.00000000 ryd = 0.0000 cm-1 0.000 2 0.00000000 ryd = 0.0000 cm-1 0.000 ag i d10 4f -d9 5s6f 1 0.0000 5 53 61 20 0.641 0.008 697.984 sec rcn mod 32 ee,eee= -0.06287 -0.03144 ee,eee= -0.02815 -0.04551 slater integrals for ag i d10 4f nconf=53 z= 47 ion= 0 exf=0.650 irel= 1 ag i d9 5s6f nconf=61 kut=-1 corrf=0.000 class 0 k rdk( 4d, 4f, 5s, 6f) frac k rek( 4d, 4f, 5s, 6f) frac - ------------------------------------- ----- - ------------------------------------- ----- 2 -0.00098586 ryd = -108.1857 cm-1 -0.806 3 -0.00003900 ryd = -4.2796 cm-1 -0.998 ag i d10 4f -d9 5s6f 2 -0.1082 5 -0.0043 5 53 61 20 0.531 0.016 698.563 sec sqrtdel= 1.0000 1.0000 0.0000 -0.1082 -0.0043 rcn mod 32 ee,eee= -1.68421 -0.84210 ee,eee= -1.17002 -1.42711 slater integrals for ag i d10 4f nconf=53 z= 47 ion= 0 exf=0.650 irel= 1 ag i d9 5s7f nconf=62 kut=-1 corrf=0.000 class 0 k rdk( 4d, 4d, 4d, 5s) frac k rek( 4d, 4d, 4d, 5s) frac - ------------------------------------- ----- - ------------------------------------- ----- 2 0.00000000 ryd = 0.0000 cm-1 0.000 2 0.00000000 ryd = 0.0000 cm-1 0.000 ag i d10 4f -d9 5s7f 1 0.0000 5 53 62 21 0.953 0.016 699.531 sec rcn mod 32 ee,eee= -0.06287 -0.03144 ee,eee= -0.02066 -0.04176 slater integrals for ag i d10 4f nconf=53 z= 47 ion= 0 exf=0.650 irel= 1 ag i d9 5s7f nconf=62 kut=-1 corrf=0.000 class 0 k rdk( 4d, 4f, 5s, 7f) frac k rek( 4d, 4f, 5s, 7f) frac - ------------------------------------- ----- - ------------------------------------- ----- 2 -0.00075376 ryd = -82.7159 cm-1 -0.783 3 -0.00003337 ryd = -3.6624 cm-1 -0.998 ag i d10 4f -d9 5s7f 2 -0.0827 5 -0.0037 5 53 62 21 0.570 0.016 700.117 sec sqrtdel= 1.0000 1.0000 0.0000 -0.0827 -0.0037 rcn mod 32 ee,eee= -1.68421 -0.84210 ee,eee= -1.17962 -1.43191 slater integrals for ag i d10 4f nconf=53 z= 47 ion= 0 exf=0.650 irel= 1 ag i d9 5s8f nconf=63 kut=-1 corrf=0.000 class 0 k rdk( 4d, 4d, 4d, 5s) frac k rek( 4d, 4d, 4d, 5s) frac - ------------------------------------- ----- - ------------------------------------- ----- 2 0.00000000 ryd = 0.0000 cm-1 0.000 2 0.00000000 ryd = 0.0000 cm-1 0.000 ag i d10 4f -d9 5s8f 1 0.0000 5 53 63 22 0.719 0.156 701.000 sec rcn mod 32 ee,eee= -0.06287 -0.03144 ee,eee= -0.01580 -0.03933 slater integrals for ag i d10 4f nconf=53 z= 47 ion= 0 exf=0.650 irel= 1 ag i d9 5s8f nconf=63 kut=-1 corrf=0.000 class 0 k rdk( 4d, 4f, 5s, 8f) frac k rek( 4d, 4f, 5s, 8f) frac - ------------------------------------- ----- - ------------------------------------- ----- 2 -0.00060360 ryd = -66.2374 cm-1 -0.769 3 -0.00002870 ryd = -3.1500 cm-1 -0.998 ag i d10 4f -d9 5s8f 2 -0.0662 5 -0.0031 5 53 63 22 1.336 0.031 702.367 sec sqrtdel= 1.0000 1.0000 0.0000 -0.0662 -0.0031 rcn mod 32 ee,eee= -1.68421 -0.84210 ee,eee= -1.18621 -1.43521 slater integrals for ag i d10 4f nconf=53 z= 47 ion= 0 exf=0.650 irel= 1 ag i d9 5s9f nconf=64 kut=-1 corrf=0.000 class 0 k rdk( 4d, 4d, 4d, 5s) frac k rek( 4d, 4d, 4d, 5s) frac - ------------------------------------- ----- - ------------------------------------- ----- 2 0.00000000 ryd = 0.0000 cm-1 0.000 2 0.00000000 ryd = 0.0000 cm-1 0.000 ag i d10 4f -d9 5s9f 1 0.0000 5 53 64 23 0.609 0.008 702.992 sec rcn mod 32 ee,eee= -0.06287 -0.03144 ee,eee= -0.01247 -0.03767 slater integrals for ag i d10 4f nconf=53 z= 47 ion= 0 exf=0.650 irel= 1 ag i d9 5s9f nconf=64 kut=-1 corrf=0.000 class 0 k rdk( 4d, 4f, 5s, 9f) frac k rek( 4d, 4f, 5s, 9f) frac - ------------------------------------- ----- - ------------------------------------- ----- 2 -0.00049886 ryd = -54.7439 cm-1 -0.760 3 -0.00002492 ryd = -2.7342 cm-1 -0.998 ag i d10 4f -d9 5s9f 2 -0.0547 5 -0.0027 5 53 64 23 0.625 0.008 703.633 sec sqrtdel= 1.0000 1.0000 0.0000 -0.0547 -0.0027 rcn mod 32 ee,eee= -1.68421 -0.84210 ee,eee= -1.16254 -1.42338 slater integrals for ag i d10 4f nconf=53 z= 47 ion= 0 exf=0.650 irel= 1 ag i d8 5s2 4f nconf=65 kut=-1 corrf=0.000 class 0 k rdk( 4d, 4d, 5s, 5s) frac k rek( 4d, 4d, 5s, 5s) frac - ------------------------------------- ----- - ------------------------------------- ----- 2 0.15540073 ryd = 17053.2580 cm-1 0.780 2 0.15540073 ryd = 17053.2580 cm-1 0.780 ag i d10 4f -d8 5s2 4f 1 17.0533 5 53 65 24 1.133 0.078 704.852 sec sqrtdel= 1.0000 1.0000 17.0533 rcn mod 32 ee,eee= -0.06287 -0.03144 ee,eee= -0.02778 -0.04532 slater integrals for ag i d10 4f nconf=53 z= 47 ion= 0 exf=0.650 irel= 1 ag i d9 5s6h nconf=70 kut=-1 corrf=0.000 class 0 k rdk( 4d, 4f, 5s, 6h) frac k rek( 4d, 4f, 5s, 6h) frac - ------------------------------------- ----- - ------------------------------------- ----- 2 -0.00027966 ryd = -30.6893 cm-1 -0.961 3 -0.00000019 ryd = -0.0208 cm-1 -1.000 ag i d10 4f -d9 5s6h 2 -0.0307 5 0.0000 5 53 70 29 0.852 0.016 705.750 sec sqrtdel= 1.0000 1.0000 -0.0307 0.0000 rcn mod 32 ee,eee= -0.02041 -0.04164 slater integrals for ag i d10 4f nconf=53 z= 47 ion= 0 exf=0.650 irel= 1 ag i d9 5s7h nconf=71 kut=-1 corrf=0.000 class 0 k rdk( 4d, 4f, 5s, 7h) frac k rek( 4d, 4f, 5s, 7h) frac - ------------------------------------- ----- - ------------------------------------- ----- 2 -0.00027168 ryd = -29.8136 cm-1 -0.959 3 -0.00000022 ryd = -0.0245 cm-1 -1.000 ag i d10 4f -d9 5s7h 2 -0.0298 5 0.0000 5 53 71 1 0.031 0.055 705.852 sec sqrtdel= 1.0000 1.0000 -0.0298 0.0000 rcn mod 32 ee,eee= -0.01563 -0.03925 slater integrals for ag i d10 4f nconf=53 z= 47 ion= 0 exf=0.650 irel= 1 ag i d9 5s8h nconf=72 kut=-1 corrf=0.000 class 0 k rdk( 4d, 4f, 5s, 8h) frac k rek( 4d, 4f, 5s, 8h) frac - ------------------------------------- ----- - ------------------------------------- ----- 2 -0.00024230 ryd = -26.5888 cm-1 -0.955 3 -0.00000022 ryd = -0.0245 cm-1 -1.000 ag i d10 4f -d9 5s8h 2 -0.0266 5 0.0000 5 53 72 1 0.016 0.031 705.914 sec sqrtdel= 1.0000 1.0000 -0.0266 0.0000 rcn mod 32 ee,eee= -0.01235 -0.03761 slater integrals for ag i d10 4f nconf=53 z= 47 ion= 0 exf=0.650 irel= 1 ag i d9 5s9h nconf=73 kut=-1 corrf=0.000 class 0 k rdk( 4d, 4f, 5s, 9h) frac k rek( 4d, 4f, 5s, 9h) frac - ------------------------------------- ----- - ------------------------------------- ----- 2 -0.00021277 ryd = -23.3484 cm-1 -0.951 3 -0.00000021 ryd = -0.0232 cm-1 -1.000 ag i d10 4f -d9 5s9h 2 -0.0233 5 0.0000 5 53 73 1 0.031 0.016 705.961 sec sqrtdel= 1.0000 1.0000 -0.0233 0.0000 rcn mod 32 ee,eee= -1.72918 -0.86459 ee,eee= -1.08586 -1.40752 slater integrals for ag i d10 5f nconf=54 z= 47 ion= 0 exf=0.650 irel= 1 ag i d9 5s4f nconf=59 kut=-1 corrf=0.000 class 0 k rdk( 4d, 4d, 4d, 5s) frac k rek( 4d, 4d, 4d, 5s) frac - ------------------------------------- ----- - ------------------------------------- ----- 2 0.00000000 ryd = 0.0000 cm-1 0.000 2 0.00000000 ryd = 0.0000 cm-1 0.000 ag i d10 5f -d9 5s4f 1 0.0000 5 54 59 18 0.766 0.008 706.773 sec rcn mod 32 ee,eee= -0.04026 -0.02013 ee,eee= -0.06339 -0.05182 slater integrals for ag i d10 5f nconf=54 z= 47 ion= 0 exf=0.650 irel= 1 ag i d9 5s4f nconf=59 kut=-1 corrf=0.000 class 0 k rdk( 4d, 5f, 5s, 4f) frac k rek( 4d, 5f, 5s, 4f) frac - ------------------------------------- ----- - ------------------------------------- ----- 2 -0.00139099 ryd = -152.6434 cm-1 -0.850 3 -0.00004381 ryd = -4.8080 cm-1 -0.998 ag i d10 5f -d9 5s4f 2 -0.1526 5 -0.0048 5 54 59 18 0.484 0.016 707.281 sec sqrtdel= 1.0000 1.0000 0.0000 -0.1526 -0.0048 rcn mod 32 ee,eee= -1.72918 -0.86459 ee,eee= -1.13077 -1.42997 slater integrals for ag i d10 5f nconf=54 z= 47 ion= 0 exf=0.650 irel= 1 ag i d9 5s5f nconf=60 kut=-1 corrf=0.000 class 0 k rdk( 4d, 4d, 4d, 5s) frac k rek( 4d, 4d, 4d, 5s) frac - ------------------------------------- ----- - ------------------------------------- ----- 2 -0.13770349 ryd = -15111.2105 cm-1 -0.475 2 -0.13770375 ryd = -15111.2396 cm-1 -0.475 ag i d10 5f -d9 5s5f 1 -15.1112 5 54 60 19 0.633 0.031 707.945 sec rcn mod 32 ee,eee= -0.04026 -0.02013 ee,eee= -0.04058 -0.04042 slater integrals for ag i d10 5f nconf=54 z= 47 ion= 0 exf=0.650 irel= 1 ag i d9 5s5f nconf=60 kut=-1 corrf=0.000 class 0 k rdk( 4d, 5f, 5s, 5f) frac k rek( 4d, 5f, 5s, 5f) frac - ------------------------------------- ----- - ------------------------------------- ----- 2 -0.00123281 ryd = -135.2850 cm-1 -0.961 3 -0.00004143 ryd = -4.5468 cm-1 -0.998 ag i d10 5f -d9 5s5f 2 -0.1353 5 -0.0045 5 54 60 19 0.508 0.023 708.477 sec sqrtdel= 1.0000 1.0000 -15.1112 -0.1353 -0.0045 rcn mod 32 ee,eee= -1.72918 -0.86459 ee,eee= -1.15523 -1.44221 slater integrals for ag i d10 5f nconf=54 z= 47 ion= 0 exf=0.650 irel= 1 ag i d9 5s6f nconf=61 kut=-1 corrf=0.000 class 0 k rdk( 4d, 4d, 4d, 5s) frac k rek( 4d, 4d, 4d, 5s) frac - ------------------------------------- ----- - ------------------------------------- ----- 2 0.00000000 ryd = 0.0000 cm-1 0.000 2 0.00000000 ryd = 0.0000 cm-1 0.000 ag i d10 5f -d9 5s6f 1 0.0000 5 54 61 20 1.438 0.000 709.914 sec rcn mod 32 ee,eee= -0.04026 -0.02013 ee,eee= -0.02815 -0.03421 slater integrals for ag i d10 5f nconf=54 z= 47 ion= 0 exf=0.650 irel= 1 ag i d9 5s6f nconf=61 kut=-1 corrf=0.000 class 0 k rdk( 4d, 5f, 5s, 6f) frac k rek( 4d, 5f, 5s, 6f) frac - ------------------------------------- ----- - ------------------------------------- ----- 2 -0.00086785 ryd = -95.2353 cm-1 -0.915 3 -0.00003589 ryd = -3.9385 cm-1 -0.998 ag i d10 5f -d9 5s6f 2 -0.0952 5 -0.0039 5 54 61 20 0.602 0.063 710.586 sec sqrtdel= 1.0000 1.0000 0.0000 -0.0952 -0.0039 rcn mod 32 ee,eee= -1.72918 -0.86459 ee,eee= -1.17002 -1.44960 slater integrals for ag i d10 5f nconf=54 z= 47 ion= 0 exf=0.650 irel= 1 ag i d9 5s7f nconf=62 kut=-1 corrf=0.000 class 0 k rdk( 4d, 4d, 4d, 5s) frac k rek( 4d, 4d, 4d, 5s) frac - ------------------------------------- ----- - ------------------------------------- ----- 2 0.00000000 ryd = 0.0000 cm-1 0.000 2 0.00000000 ryd = 0.0000 cm-1 0.000 ag i d10 5f -d9 5s7f 1 0.0000 5 54 62 21 0.820 0.023 711.484 sec rcn mod 32 ee,eee= -0.04026 -0.02013 ee,eee= -0.02066 -0.03046 slater integrals for ag i d10 5f nconf=54 z= 47 ion= 0 exf=0.650 irel= 1 ag i d9 5s7f nconf=62 kut=-1 corrf=0.000 class 0 k rdk( 4d, 5f, 5s, 7f) frac k rek( 4d, 5f, 5s, 7f) frac - ------------------------------------- ----- - ------------------------------------- ----- 2 -0.00066586 ryd = -73.0692 cm-1 -0.896 3 -0.00003072 ryd = -3.3714 cm-1 -0.998 ag i d10 5f -d9 5s7f 2 -0.0731 5 -0.0034 5 54 62 21 0.563 0.023 712.070 sec sqrtdel= 1.0000 1.0000 0.0000 -0.0731 -0.0034 rcn mod 32 ee,eee= -1.72918 -0.86459 ee,eee= -1.17962 -1.45440 slater integrals for ag i d10 5f nconf=54 z= 47 ion= 0 exf=0.650 irel= 1 ag i d9 5s8f nconf=63 kut=-1 corrf=0.000 class 0 k rdk( 4d, 4d, 4d, 5s) frac k rek( 4d, 4d, 4d, 5s) frac - ------------------------------------- ----- - ------------------------------------- ----- 2 0.00000000 ryd = 0.0000 cm-1 0.000 2 0.00000000 ryd = 0.0000 cm-1 0.000 ag i d10 5f -d9 5s8f 1 0.0000 5 54 63 22 0.625 0.008 712.703 sec rcn mod 32 ee,eee= -0.04026 -0.02013 ee,eee= -0.01580 -0.02803 slater integrals for ag i d10 5f nconf=54 z= 47 ion= 0 exf=0.650 irel= 1 ag i d9 5s8f nconf=63 kut=-1 corrf=0.000 class 0 k rdk( 4d, 5f, 5s, 8f) frac k rek( 4d, 5f, 5s, 8f) frac - ------------------------------------- ----- - ------------------------------------- ----- 2 -0.00053460 ryd = -58.6654 cm-1 -0.884 3 -0.00002643 ryd = -2.9002 cm-1 -0.998 ag i d10 5f -d9 5s8f 2 -0.0587 5 -0.0029 5 54 63 22 1.109 0.023 713.844 sec sqrtdel= 1.0000 1.0000 0.0000 -0.0587 -0.0029 rcn mod 32 ee,eee= -1.72918 -0.86459 ee,eee= -1.18621 -1.45770 slater integrals for ag i d10 5f nconf=54 z= 47 ion= 0 exf=0.650 irel= 1 ag i d9 5s9f nconf=64 kut=-1 corrf=0.000 class 0 k rdk( 4d, 4d, 4d, 5s) frac k rek( 4d, 4d, 4d, 5s) frac - ------------------------------------- ----- - ------------------------------------- ----- 2 0.00000000 ryd = 0.0000 cm-1 0.000 2 0.00000000 ryd = 0.0000 cm-1 0.000 ag i d10 5f -d9 5s9f 1 0.0000 5 54 64 23 0.680 0.016 714.547 sec rcn mod 32 ee,eee= -0.04026 -0.02013 ee,eee= -0.01247 -0.02636 slater integrals for ag i d10 5f nconf=54 z= 47 ion= 0 exf=0.650 irel= 1 ag i d9 5s9f nconf=64 kut=-1 corrf=0.000 class 0 k rdk( 4d, 5f, 5s, 9f) frac k rek( 4d, 5f, 5s, 9f) frac - ------------------------------------- ----- - ------------------------------------- ----- 2 -0.00044265 ryd = -48.5753 cm-1 -0.876 3 -0.00002294 ryd = -2.5178 cm-1 -0.998 ag i d10 5f -d9 5s9f 2 -0.0486 5 -0.0025 5 54 64 23 0.648 0.047 715.242 sec sqrtdel= 1.0000 1.0000 0.0000 -0.0486 -0.0025 rcn mod 32 ee,eee= -1.72918 -0.86459 ee,eee= -1.16254 -1.44586 slater integrals for ag i d10 5f nconf=54 z= 47 ion= 0 exf=0.650 irel= 1 ag i d8 5s2 4f nconf=65 kut=-1 corrf=0.000 class 0 k rdk( 4d, 4d, 5s, 5s) frac k rek( 4d, 4d, 5s, 5s) frac - ------------------------------------- ----- - ------------------------------------- ----- 2 0.00000000 ryd = 0.0000 cm-1 0.000 2 0.00000000 ryd = 0.0000 cm-1 0.000 ag i d10 5f -d8 5s2 4f 1 0.0000 5 54 65 24 1.180 0.023 716.445 sec sqrtdel= 1.0000 1.0000 0.0000 rcn mod 32 ee,eee= -0.04026 -0.02013 ee,eee= -0.02778 -0.03402 slater integrals for ag i d10 5f nconf=54 z= 47 ion= 0 exf=0.650 irel= 1 ag i d9 5s6h nconf=70 kut=-1 corrf=0.000 class 0 k rdk( 4d, 5f, 5s, 6h) frac k rek( 4d, 5f, 5s, 6h) frac - ------------------------------------- ----- - ------------------------------------- ----- 2 0.00006587 ryd = 7.2286 cm-1 0.288 3 -0.00000017 ryd = -0.0188 cm-1 -1.000 ag i d10 5f -d9 5s6h 2 0.0072 5 0.0000 5 54 70 29 1.094 0.016 717.563 sec sqrtdel= 1.0000 1.0000 0.0072 0.0000 rcn mod 32 ee,eee= -0.02041 -0.03033 slater integrals for ag i d10 5f nconf=54 z= 47 ion= 0 exf=0.650 irel= 1 ag i d9 5s7h nconf=71 kut=-1 corrf=0.000 class 0 k rdk( 4d, 5f, 5s, 7h) frac k rek( 4d, 5f, 5s, 7h) frac - ------------------------------------- ----- - ------------------------------------- ----- 2 -0.00000971 ryd = -1.0659 cm-1 -0.054 3 -0.00000020 ryd = -0.0221 cm-1 -1.000 ag i d10 5f -d9 5s7h 2 -0.0011 5 0.0000 5 54 71 1 0.031 0.023 717.617 sec sqrtdel= 1.0000 1.0000 -0.0011 0.0000 rcn mod 32 ee,eee= -0.01563 -0.02794 slater integrals for ag i d10 5f nconf=54 z= 47 ion= 0 exf=0.650 irel= 1 ag i d9 5s8h nconf=72 kut=-1 corrf=0.000 class 0 k rdk( 4d, 5f, 5s, 8h) frac k rek( 4d, 5f, 5s, 8h) frac - ------------------------------------- ----- - ------------------------------------- ----- 2 -0.00003684 ryd = -4.0425 cm-1 -0.244 3 -0.00000020 ryd = -0.0221 cm-1 -1.000 ag i d10 5f -d9 5s8h 2 -0.0040 5 0.0000 5 54 72 1 0.016 0.023 717.664 sec sqrtdel= 1.0000 1.0000 -0.0040 0.0000 rcn mod 32 ee,eee= -0.01235 -0.02630 slater integrals for ag i d10 5f nconf=54 z= 47 ion= 0 exf=0.650 irel= 1 ag i d9 5s9h nconf=73 kut=-1 corrf=0.000 class 0 k rdk( 4d, 5f, 5s, 9h) frac k rek( 4d, 5f, 5s, 9h) frac - ------------------------------------- ----- - ------------------------------------- ----- 2 -0.00004585 ryd = -5.0312 cm-1 -0.355 3 -0.00000019 ryd = -0.0209 cm-1 -1.000 ag i d10 5f -d9 5s9h 2 -0.0050 5 0.0000 5 54 73 1 0.023 0.070 717.914 sec sqrtdel= 1.0000 1.0000 -0.0050 0.0000 rcn mod 32 ee,eee= -1.75365 -0.87682 ee,eee= -1.08586 -1.41975 slater integrals for ag i d10 6f nconf=55 z= 47 ion= 0 exf=0.650 irel= 1 ag i d9 5s4f nconf=59 kut=-1 corrf=0.000 class 0 k rdk( 4d, 4d, 4d, 5s) frac k rek( 4d, 4d, 4d, 5s) frac - ------------------------------------- ----- - ------------------------------------- ----- 2 0.00000000 ryd = 0.0000 cm-1 0.000 2 0.00000000 ryd = 0.0000 cm-1 0.000 ag i d10 6f -d9 5s4f 1 0.0000 5 55 59 18 0.742 0.023 718.695 sec rcn mod 32 ee,eee= -0.02795 -0.01398 ee,eee= -0.06339 -0.04567 slater integrals for ag i d10 6f nconf=55 z= 47 ion= 0 exf=0.650 irel= 1 ag i d9 5s4f nconf=59 kut=-1 corrf=0.000 class 0 k rdk( 4d, 6f, 5s, 4f) frac k rek( 4d, 6f, 5s, 4f) frac - ------------------------------------- ----- - ------------------------------------- ----- 2 -0.00098234 ryd = -107.7993 cm-1 -0.807 3 -0.00003728 ryd = -4.0909 cm-1 -0.998 ag i d10 6f -d9 5s4f 2 -0.1078 5 -0.0041 5 55 59 18 0.602 0.016 719.320 sec sqrtdel= 1.0000 1.0000 0.0000 -0.1078 -0.0041 rcn mod 32 ee,eee= -1.75365 -0.87682 ee,eee= -1.13077 -1.44221 slater integrals for ag i d10 6f nconf=55 z= 47 ion= 0 exf=0.650 irel= 1 ag i d9 5s5f nconf=60 kut=-1 corrf=0.000 class 0 k rdk( 4d, 4d, 4d, 5s) frac k rek( 4d, 4d, 4d, 5s) frac - ------------------------------------- ----- - ------------------------------------- ----- 2 0.00000000 ryd = 0.0000 cm-1 0.000 2 0.00000000 ryd = 0.0000 cm-1 0.000 ag i d10 6f -d9 5s5f 1 0.0000 5 55 60 19 0.500 0.008 719.844 sec rcn mod 32 ee,eee= -0.02795 -0.01398 ee,eee= -0.04058 -0.03427 slater integrals for ag i d10 6f nconf=55 z= 47 ion= 0 exf=0.650 irel= 1 ag i d9 5s5f nconf=60 kut=-1 corrf=0.000 class 0 k rdk( 4d, 6f, 5s, 5f) frac k rek( 4d, 6f, 5s, 5f) frac - ------------------------------------- ----- - ------------------------------------- ----- 2 -0.00086709 ryd = -95.1520 cm-1 -0.916 3 -0.00003527 ryd = -3.8704 cm-1 -0.998 ag i d10 6f -d9 5s5f 2 -0.0952 5 -0.0039 5 55 60 19 0.508 0.023 720.375 sec sqrtdel= 1.0000 1.0000 0.0000 -0.0952 -0.0039 rcn mod 32 ee,eee= -1.75365 -0.87682 ee,eee= -1.15523 -1.45444 slater integrals for ag i d10 6f nconf=55 z= 47 ion= 0 exf=0.650 irel= 1 ag i d9 5s6f nconf=61 kut=-1 corrf=0.000 class 0 k rdk( 4d, 4d, 4d, 5s) frac k rek( 4d, 4d, 4d, 5s) frac - ------------------------------------- ----- - ------------------------------------- ----- 2 -0.13770655 ryd = -15111.5460 cm-1 -0.475 2 -0.13770681 ryd = -15111.5750 cm-1 -0.475 ag i d10 6f -d9 5s6f 1 -15.1115 5 55 61 20 0.969 0.023 721.375 sec rcn mod 32 ee,eee= -0.02795 -0.01398 ee,eee= -0.02815 -0.02805 slater integrals for ag i d10 6f nconf=55 z= 47 ion= 0 exf=0.650 irel= 1 ag i d9 5s6f nconf=61 kut=-1 corrf=0.000 class 0 k rdk( 4d, 6f, 5s, 6f) frac k rek( 4d, 6f, 5s, 6f) frac - ------------------------------------- ----- - ------------------------------------- ----- 2 -0.00072125 ryd = -79.1482 cm-1 -0.961 3 -0.00003056 ryd = -3.3534 cm-1 -0.998 ag i d10 6f -d9 5s6f 2 -0.0791 5 -0.0034 5 55 61 20 0.719 0.023 722.117 sec sqrtdel= 1.0000 1.0000 -15.1115 -0.0791 -0.0034 rcn mod 32 ee,eee= -1.75365 -0.87682 ee,eee= -1.17002 -1.46183 slater integrals for ag i d10 6f nconf=55 z= 47 ion= 0 exf=0.650 irel= 1 ag i d9 5s7f nconf=62 kut=-1 corrf=0.000 class 0 k rdk( 4d, 4d, 4d, 5s) frac k rek( 4d, 4d, 4d, 5s) frac - ------------------------------------- ----- - ------------------------------------- ----- 2 0.00000000 ryd = 0.0000 cm-1 0.000 2 0.00000000 ryd = 0.0000 cm-1 0.000 ag i d10 6f -d9 5s7f 1 0.0000 5 55 62 21 0.555 0.039 722.711 sec rcn mod 32 ee,eee= -0.02795 -0.01398 ee,eee= -0.02066 -0.02431 slater integrals for ag i d10 6f nconf=55 z= 47 ion= 0 exf=0.650 irel= 1 ag i d9 5s7f nconf=62 kut=-1 corrf=0.000 class 0 k rdk( 4d, 6f, 5s, 7f) frac k rek( 4d, 6f, 5s, 7f) frac - ------------------------------------- ----- - ------------------------------------- ----- 2 -0.00055076 ryd = -60.4389 cm-1 -0.937 3 -0.00002616 ryd = -2.8711 cm-1 -0.998 ag i d10 6f -d9 5s7f 2 -0.0604 5 -0.0029 5 55 62 21 1.016 0.023 723.750 sec sqrtdel= 1.0000 1.0000 0.0000 -0.0604 -0.0029 rcn mod 32 ee,eee= -1.75365 -0.87682 ee,eee= -1.17962 -1.46663 slater integrals for ag i d10 6f nconf=55 z= 47 ion= 0 exf=0.650 irel= 1 ag i d9 5s8f nconf=63 kut=-1 corrf=0.000 class 0 k rdk( 4d, 4d, 4d, 5s) frac k rek( 4d, 4d, 4d, 5s) frac - ------------------------------------- ----- - ------------------------------------- ----- 2 0.00000000 ryd = 0.0000 cm-1 0.000 2 0.00000000 ryd = 0.0000 cm-1 0.000 ag i d10 6f -d9 5s8f 1 0.0000 5 55 63 22 0.586 0.016 724.367 sec rcn mod 32 ee,eee= -0.02795 -0.01398 ee,eee= -0.01580 -0.02188 slater integrals for ag i d10 6f nconf=55 z= 47 ion= 0 exf=0.650 irel= 1 ag i d9 5s8f nconf=63 kut=-1 corrf=0.000 class 0 k rdk( 4d, 6f, 5s, 8f) frac k rek( 4d, 6f, 5s, 8f) frac - ------------------------------------- ----- - ------------------------------------- ----- 2 -0.00044280 ryd = -48.5914 cm-1 -0.926 3 -0.00002251 ryd = -2.4701 cm-1 -0.998 ag i d10 6f -d9 5s8f 2 -0.0486 5 -0.0025 5 55 63 22 0.773 0.094 725.234 sec sqrtdel= 1.0000 1.0000 0.0000 -0.0486 -0.0025 rcn mod 32 ee,eee= -1.75365 -0.87682 ee,eee= -1.18621 -1.46993 slater integrals for ag i d10 6f nconf=55 z= 47 ion= 0 exf=0.650 irel= 1 ag i d9 5s9f nconf=64 kut=-1 corrf=0.000 class 0 k rdk( 4d, 4d, 4d, 5s) frac k rek( 4d, 4d, 4d, 5s) frac - ------------------------------------- ----- - ------------------------------------- ----- 2 0.00000000 ryd = 0.0000 cm-1 0.000 2 0.00000000 ryd = 0.0000 cm-1 0.000 ag i d10 6f -d9 5s9f 1 0.0000 5 55 64 23 1.234 0.016 726.500 sec rcn mod 32 ee,eee= -0.02795 -0.01398 ee,eee= -0.01247 -0.02021 slater integrals for ag i d10 6f nconf=55 z= 47 ion= 0 exf=0.650 irel= 1 ag i d9 5s9f nconf=64 kut=-1 corrf=0.000 class 0 k rdk( 4d, 6f, 5s, 9f) frac k rek( 4d, 6f, 5s, 9f) frac - ------------------------------------- ----- - ------------------------------------- ----- 2 -0.00036710 ryd = -40.2847 cm-1 -0.919 3 -0.00001954 ryd = -2.1445 cm-1 -0.998 ag i d10 6f -d9 5s9f 2 -0.0403 5 -0.0021 5 55 64 23 0.625 0.016 727.141 sec sqrtdel= 1.0000 1.0000 0.0000 -0.0403 -0.0021 rcn mod 32 ee,eee= -1.75365 -0.87682 ee,eee= -1.16254 -1.45810 slater integrals for ag i d10 6f nconf=55 z= 47 ion= 0 exf=0.650 irel= 1 ag i d8 5s2 4f nconf=65 kut=-1 corrf=0.000 class 0 k rdk( 4d, 4d, 5s, 5s) frac k rek( 4d, 4d, 5s, 5s) frac - ------------------------------------- ----- - ------------------------------------- ----- 2 0.00000000 ryd = 0.0000 cm-1 0.000 2 0.00000000 ryd = 0.0000 cm-1 0.000 ag i d10 6f -d8 5s2 4f 1 0.0000 5 55 65 24 1.031 0.023 728.195 sec sqrtdel= 1.0000 1.0000 0.0000 rcn mod 32 ee,eee= -0.02795 -0.01398 ee,eee= -0.02778 -0.02787 slater integrals for ag i d10 6f nconf=55 z= 47 ion= 0 exf=0.650 irel= 1 ag i d9 5s6h nconf=70 kut=-1 corrf=0.000 class 0 k rdk( 4d, 6f, 5s, 6h) frac k rek( 4d, 6f, 5s, 6h) frac - ------------------------------------- ----- - ------------------------------------- ----- 2 0.00000007 ryd = 0.0079 cm-1 0.000 3 -0.00000014 ryd = -0.0158 cm-1 -1.000 ag i d10 6f -d9 5s6h 2 0.0000 5 0.0000 5 55 70 29 0.766 0.023 729.000 sec sqrtdel= 1.0000 1.0000 0.0000 0.0000 rcn mod 32 ee,eee= -0.02041 -0.02418 slater integrals for ag i d10 6f nconf=55 z= 47 ion= 0 exf=0.650 irel= 1 ag i d9 5s7h nconf=71 kut=-1 corrf=0.000 class 0 k rdk( 4d, 6f, 5s, 7h) frac k rek( 4d, 6f, 5s, 7h) frac - ------------------------------------- ----- - ------------------------------------- ----- 2 0.00002960 ryd = 3.2481 cm-1 0.215 3 -0.00000017 ryd = -0.0186 cm-1 -1.000 ag i d10 6f -d9 5s7h 2 0.0032 5 0.0000 5 55 71 1 0.211 0.016 729.242 sec sqrtdel= 1.0000 1.0000 0.0032 0.0000 rcn mod 32 ee,eee= -0.01563 -0.02179 slater integrals for ag i d10 6f nconf=55 z= 47 ion= 0 exf=0.650 irel= 1 ag i d9 5s8h nconf=72 kut=-1 corrf=0.000 class 0 k rdk( 4d, 6f, 5s, 8h) frac k rek( 4d, 6f, 5s, 8h) frac - ------------------------------------- ----- - ------------------------------------- ----- 2 0.00001230 ryd = 1.3501 cm-1 0.105 3 -0.00000017 ryd = -0.0186 cm-1 -1.000 ag i d10 6f -d9 5s8h 2 0.0014 5 0.0000 5 55 72 1 0.031 0.031 729.305 sec sqrtdel= 1.0000 1.0000 0.0014 0.0000 rcn mod 32 ee,eee= -0.01235 -0.02015 slater integrals for ag i d10 6f nconf=55 z= 47 ion= 0 exf=0.650 irel= 1 ag i d9 5s9h nconf=73 kut=-1 corrf=0.000 class 0 k rdk( 4d, 6f, 5s, 9h) frac k rek( 4d, 6f, 5s, 9h) frac - ------------------------------------- ----- - ------------------------------------- ----- 2 0.00000128 ryd = 0.1402 cm-1 0.013 3 -0.00000016 ryd = -0.0176 cm-1 -1.000 ag i d10 6f -d9 5s9h 2 0.0001 5 0.0000 5 55 73 1 0.031 0.016 729.352 sec sqrtdel= 1.0000 1.0000 0.0001 0.0000 rcn mod 32 ee,eee= -1.76841 -0.88421 ee,eee= -1.08586 -1.42714 slater integrals for ag i d10 7f nconf=56 z= 47 ion= 0 exf=0.650 irel= 1 ag i d9 5s4f nconf=59 kut=-1 corrf=0.000 class 0 k rdk( 4d, 4d, 4d, 5s) frac k rek( 4d, 4d, 4d, 5s) frac - ------------------------------------- ----- - ------------------------------------- ----- 2 0.00000000 ryd = 0.0000 cm-1 0.000 2 0.00000000 ryd = 0.0000 cm-1 0.000 ag i d10 7f -d9 5s4f 1 0.0000 5 56 59 18 0.484 0.016 729.883 sec rcn mod 32 ee,eee= -0.02053 -0.01026 ee,eee= -0.06339 -0.04196 slater integrals for ag i d10 7f nconf=56 z= 47 ion= 0 exf=0.650 irel= 1 ag i d9 5s4f nconf=59 kut=-1 corrf=0.000 class 0 k rdk( 4d, 7f, 5s, 4f) frac k rek( 4d, 7f, 5s, 4f) frac - ------------------------------------- ----- - ------------------------------------- ----- 2 -0.00074982 ryd = -82.2837 cm-1 -0.784 3 -0.00003151 ryd = -3.4581 cm-1 -0.998 ag i d10 7f -d9 5s4f 2 -0.0823 5 -0.0035 5 56 59 18 1.078 0.031 730.992 sec sqrtdel= 1.0000 1.0000 0.0000 -0.0823 -0.0035 rcn mod 32 ee,eee= -1.76841 -0.88421 ee,eee= -1.13077 -1.44959 slater integrals for ag i d10 7f nconf=56 z= 47 ion= 0 exf=0.650 irel= 1 ag i d9 5s5f nconf=60 kut=-1 corrf=0.000 class 0 k rdk( 4d, 4d, 4d, 5s) frac k rek( 4d, 4d, 4d, 5s) frac - ------------------------------------- ----- - ------------------------------------- ----- 2 0.00000000 ryd = 0.0000 cm-1 0.000 2 0.00000000 ryd = 0.0000 cm-1 0.000 ag i d10 7f -d9 5s5f 1 0.0000 5 56 60 19 0.508 0.070 731.570 sec rcn mod 32 ee,eee= -0.02053 -0.01026 ee,eee= -0.04058 -0.03056 slater integrals for ag i d10 7f nconf=56 z= 47 ion= 0 exf=0.650 irel= 1 ag i d9 5s5f nconf=60 kut=-1 corrf=0.000 class 0 k rdk( 4d, 7f, 5s, 5f) frac k rek( 4d, 7f, 5s, 5f) frac - ------------------------------------- ----- - ------------------------------------- ----- 2 -0.00066438 ryd = -72.9071 cm-1 -0.897 3 -0.00002982 ryd = -3.2727 cm-1 -0.998 ag i d10 7f -d9 5s5f 2 -0.0729 5 -0.0033 5 56 60 19 0.516 0.016 732.102 sec sqrtdel= 1.0000 1.0000 0.0000 -0.0729 -0.0033 rcn mod 32 ee,eee= -1.76841 -0.88421 ee,eee= -1.15523 -1.46182 slater integrals for ag i d10 7f nconf=56 z= 47 ion= 0 exf=0.650 irel= 1 ag i d9 5s6f nconf=61 kut=-1 corrf=0.000 class 0 k rdk( 4d, 4d, 4d, 5s) frac k rek( 4d, 4d, 4d, 5s) frac - ------------------------------------- ----- - ------------------------------------- ----- 2 0.00000000 ryd = 0.0000 cm-1 0.000 2 0.00000000 ryd = 0.0000 cm-1 0.000 ag i d10 7f -d9 5s6f 1 0.0000 5 56 61 20 0.828 0.008 732.953 sec rcn mod 32 ee,eee= -0.02053 -0.01026 ee,eee= -0.02815 -0.02434 slater integrals for ag i d10 7f nconf=56 z= 47 ion= 0 exf=0.650 irel= 1 ag i d9 5s6f nconf=61 kut=-1 corrf=0.000 class 0 k rdk( 4d, 7f, 5s, 6f) frac k rek( 4d, 7f, 5s, 6f) frac - ------------------------------------- ----- - ------------------------------------- ----- 2 -0.00055045 ryd = -60.4054 cm-1 -0.937 3 -0.00002584 ryd = -2.8360 cm-1 -0.998 ag i d10 7f -d9 5s6f 2 -0.0604 5 -0.0028 5 56 61 20 0.977 0.023 733.953 sec sqrtdel= 1.0000 1.0000 0.0000 -0.0604 -0.0028 rcn mod 32 ee,eee= -1.76841 -0.88421 ee,eee= -1.17002 -1.46922 slater integrals for ag i d10 7f nconf=56 z= 47 ion= 0 exf=0.650 irel= 1 ag i d9 5s7f nconf=62 kut=-1 corrf=0.000 class 0 k rdk( 4d, 4d, 4d, 5s) frac k rek( 4d, 4d, 4d, 5s) frac - ------------------------------------- ----- - ------------------------------------- ----- 2 -0.13770862 ryd = -15111.7740 cm-1 -0.475 2 -0.13770889 ryd = -15111.8031 cm-1 -0.475 ag i d10 7f -d9 5s7f 1 -15.1118 5 56 62 21 0.672 0.039 734.672 sec rcn mod 32 ee,eee= -0.02053 -0.01026 ee,eee= -0.02066 -0.02059 slater integrals for ag i d10 7f nconf=56 z= 47 ion= 0 exf=0.650 irel= 1 ag i d9 5s7f nconf=62 kut=-1 corrf=0.000 class 0 k rdk( 4d, 7f, 5s, 7f) frac k rek( 4d, 7f, 5s, 7f) frac - ------------------------------------- ----- - ------------------------------------- ----- 2 -0.00045825 ryd = -50.2866 cm-1 -0.961 3 -0.00002213 ryd = -2.4283 cm-1 -0.998 ag i d10 7f -d9 5s7f 2 -0.0503 5 -0.0024 5 56 62 21 0.844 0.031 735.547 sec sqrtdel= 1.0000 1.0000 -15.1118 -0.0503 -0.0024 rcn mod 32 ee,eee= -1.76841 -0.88421 ee,eee= -1.17962 -1.47402 slater integrals for ag i d10 7f nconf=56 z= 47 ion= 0 exf=0.650 irel= 1 ag i d9 5s8f nconf=63 kut=-1 corrf=0.000 class 0 k rdk( 4d, 4d, 4d, 5s) frac k rek( 4d, 4d, 4d, 5s) frac - ------------------------------------- ----- - ------------------------------------- ----- 2 0.00000000 ryd = 0.0000 cm-1 0.000 2 0.00000000 ryd = 0.0000 cm-1 0.000 ag i d10 7f -d9 5s8f 1 0.0000 5 56 63 22 0.672 0.047 736.273 sec rcn mod 32 ee,eee= -0.02053 -0.01026 ee,eee= -0.01580 -0.01816 slater integrals for ag i d10 7f nconf=56 z= 47 ion= 0 exf=0.650 irel= 1 ag i d9 5s8f nconf=63 kut=-1 corrf=0.000 class 0 k rdk( 4d, 7f, 5s, 8f) frac k rek( 4d, 7f, 5s, 8f) frac - ------------------------------------- ----- - ------------------------------------- ----- 2 -0.00036703 ryd = -40.2772 cm-1 -0.946 3 -0.00001904 ryd = -2.0893 cm-1 -0.998 ag i d10 7f -d9 5s8f 2 -0.0403 5 -0.0021 5 56 63 22 0.602 0.016 736.891 sec sqrtdel= 1.0000 1.0000 0.0000 -0.0403 -0.0021 rcn mod 32 ee,eee= -1.76841 -0.88421 ee,eee= -1.18621 -1.47731 slater integrals for ag i d10 7f nconf=56 z= 47 ion= 0 exf=0.650 irel= 1 ag i d9 5s9f nconf=64 kut=-1 corrf=0.000 class 0 k rdk( 4d, 4d, 4d, 5s) frac k rek( 4d, 4d, 4d, 5s) frac - ------------------------------------- ----- - ------------------------------------- ----- 2 0.00000000 ryd = 0.0000 cm-1 0.000 2 0.00000000 ryd = 0.0000 cm-1 0.000 ag i d10 7f -d9 5s9f 1 0.0000 5 56 64 23 1.242 0.000 738.133 sec rcn mod 32 ee,eee= -0.02053 -0.01026 ee,eee= -0.01247 -0.01650 slater integrals for ag i d10 7f nconf=56 z= 47 ion= 0 exf=0.650 irel= 1 ag i d9 5s9f nconf=64 kut=-1 corrf=0.000 class 0 k rdk( 4d, 7f, 5s, 9f) frac k rek( 4d, 7f, 5s, 9f) frac - ------------------------------------- ----- - ------------------------------------- ----- 2 -0.00030445 ryd = -33.4090 cm-1 -0.940 3 -0.00001653 ryd = -1.8140 cm-1 -0.998 ag i d10 7f -d9 5s9f 2 -0.0334 5 -0.0018 5 56 64 23 0.711 0.023 738.875 sec sqrtdel= 1.0000 1.0000 0.0000 -0.0334 -0.0018 rcn mod 32 ee,eee= -1.76841 -0.88421 ee,eee= -1.16254 -1.46548 slater integrals for ag i d10 7f nconf=56 z= 47 ion= 0 exf=0.650 irel= 1 ag i d8 5s2 4f nconf=65 kut=-1 corrf=0.000 class 0 k rdk( 4d, 4d, 5s, 5s) frac k rek( 4d, 4d, 5s, 5s) frac - ------------------------------------- ----- - ------------------------------------- ----- 2 0.00000000 ryd = 0.0000 cm-1 0.000 2 0.00000000 ryd = 0.0000 cm-1 0.000 ag i d10 7f -d8 5s2 4f 1 0.0000 5 56 65 24 0.719 0.055 739.656 sec sqrtdel= 1.0000 1.0000 0.0000 rcn mod 32 ee,eee= -0.02053 -0.01026 ee,eee= -0.02778 -0.02415 slater integrals for ag i d10 7f nconf=56 z= 47 ion= 0 exf=0.650 irel= 1 ag i d9 5s6h nconf=70 kut=-1 corrf=0.000 class 0 k rdk( 4d, 7f, 5s, 6h) frac k rek( 4d, 7f, 5s, 6h) frac - ------------------------------------- ----- - ------------------------------------- ----- 2 -0.00000084 ryd = -0.0924 cm-1 -0.007 3 -0.00000012 ryd = -0.0133 cm-1 -1.000 ag i d10 7f -d9 5s6h 2 -0.0001 5 0.0000 5 56 70 29 1.063 0.008 740.742 sec sqrtdel= 1.0000 1.0000 -0.0001 0.0000 rcn mod 32 ee,eee= -0.02041 -0.02047 slater integrals for ag i d10 7f nconf=56 z= 47 ion= 0 exf=0.650 irel= 1 ag i d9 5s7h nconf=71 kut=-1 corrf=0.000 class 0 k rdk( 4d, 7f, 5s, 7h) frac k rek( 4d, 7f, 5s, 7h) frac - ------------------------------------- ----- - ------------------------------------- ----- 2 0.00000008 ryd = 0.0083 cm-1 0.001 3 -0.00000014 ryd = -0.0156 cm-1 -1.000 ag i d10 7f -d9 5s7h 2 0.0000 5 0.0000 5 56 71 1 0.031 0.023 740.805 sec sqrtdel= 1.0000 1.0000 0.0000 0.0000 rcn mod 32 ee,eee= -0.01563 -0.01808 slater integrals for ag i d10 7f nconf=56 z= 47 ion= 0 exf=0.650 irel= 1 ag i d9 5s8h nconf=72 kut=-1 corrf=0.000 class 0 k rdk( 4d, 7f, 5s, 8h) frac k rek( 4d, 7f, 5s, 8h) frac - ------------------------------------- ----- - ------------------------------------- ----- 2 0.00001376 ryd = 1.5100 cm-1 0.155 3 -0.00000014 ryd = -0.0156 cm-1 -1.000 ag i d10 7f -d9 5s8h 2 0.0015 5 0.0000 5 56 72 1 0.031 0.016 740.852 sec sqrtdel= 1.0000 1.0000 0.0015 0.0000 rcn mod 32 ee,eee= -0.01235 -0.01644 slater integrals for ag i d10 7f nconf=56 z= 47 ion= 0 exf=0.650 irel= 1 ag i d9 5s9h nconf=73 kut=-1 corrf=0.000 class 0 k rdk( 4d, 7f, 5s, 9h) frac k rek( 4d, 7f, 5s, 9h) frac - ------------------------------------- ----- - ------------------------------------- ----- 2 0.00000968 ryd = 1.0619 cm-1 0.124 3 -0.00000013 ryd = -0.0148 cm-1 -1.000 ag i d10 7f -d9 5s9h 2 0.0011 5 0.0000 5 56 73 1 0.016 0.023 740.914 sec sqrtdel= 1.0000 1.0000 0.0011 0.0000 rcn mod 32 ee,eee= -1.77801 -0.88900 ee,eee= -1.08586 -1.43193 slater integrals for ag i d10 8f nconf=57 z= 47 ion= 0 exf=0.650 irel= 1 ag i d9 5s4f nconf=59 kut=-1 corrf=0.000 class 0 k rdk( 4d, 4d, 4d, 5s) frac k rek( 4d, 4d, 4d, 5s) frac - ------------------------------------- ----- - ------------------------------------- ----- 2 0.00000000 ryd = 0.0000 cm-1 0.000 2 0.00000000 ryd = 0.0000 cm-1 0.000 ag i d10 8f -d9 5s4f 1 0.0000 5 57 59 18 0.547 0.016 741.492 sec rcn mod 32 ee,eee= -0.01571 -0.00785 ee,eee= -0.06339 -0.03955 slater integrals for ag i d10 8f nconf=57 z= 47 ion= 0 exf=0.650 irel= 1 ag i d9 5s4f nconf=59 kut=-1 corrf=0.000 class 0 k rdk( 4d, 8f, 5s, 4f) frac k rek( 4d, 8f, 5s, 4f) frac - ------------------------------------- ----- - ------------------------------------- ----- 2 -0.00059962 ryd = -65.8002 cm-1 -0.771 3 -0.00002685 ryd = -2.9469 cm-1 -0.998 ag i d10 8f -d9 5s4f 2 -0.0658 5 -0.0029 5 57 59 18 1.219 0.031 742.742 sec sqrtdel= 1.0000 1.0000 0.0000 -0.0658 -0.0029 rcn mod 32 ee,eee= -1.77801 -0.88900 ee,eee= -1.13077 -1.45439 slater integrals for ag i d10 8f nconf=57 z= 47 ion= 0 exf=0.650 irel= 1 ag i d9 5s5f nconf=60 kut=-1 corrf=0.000 class 0 k rdk( 4d, 4d, 4d, 5s) frac k rek( 4d, 4d, 4d, 5s) frac - ------------------------------------- ----- - ------------------------------------- ----- 2 0.00000000 ryd = 0.0000 cm-1 0.000 2 0.00000000 ryd = 0.0000 cm-1 0.000 ag i d10 8f -d9 5s5f 1 0.0000 5 57 60 19 0.516 0.008 743.273 sec rcn mod 32 ee,eee= -0.01571 -0.00785 ee,eee= -0.04058 -0.02815 slater integrals for ag i d10 8f nconf=57 z= 47 ion= 0 exf=0.650 irel= 1 ag i d9 5s5f nconf=60 kut=-1 corrf=0.000 class 0 k rdk( 4d, 8f, 5s, 5f) frac k rek( 4d, 8f, 5s, 5f) frac - ------------------------------------- ----- - ------------------------------------- ----- 2 -0.00053274 ryd = -58.4615 cm-1 -0.886 3 -0.00002542 ryd = -2.7894 cm-1 -0.998 ag i d10 8f -d9 5s5f 2 -0.0585 5 -0.0028 5 57 60 19 0.539 0.023 743.836 sec sqrtdel= 1.0000 1.0000 0.0000 -0.0585 -0.0028 rcn mod 32 ee,eee= -1.77801 -0.88900 ee,eee= -1.15523 -1.46662 slater integrals for ag i d10 8f nconf=57 z= 47 ion= 0 exf=0.650 irel= 1 ag i d9 5s6f nconf=61 kut=-1 corrf=0.000 class 0 k rdk( 4d, 4d, 4d, 5s) frac k rek( 4d, 4d, 4d, 5s) frac - ------------------------------------- ----- - ------------------------------------- ----- 2 0.00000000 ryd = 0.0000 cm-1 0.000 2 0.00000000 ryd = 0.0000 cm-1 0.000 ag i d10 8f -d9 5s6f 1 0.0000 5 57 61 20 1.070 0.016 744.930 sec rcn mod 32 ee,eee= -0.01571 -0.00785 ee,eee= -0.02815 -0.02193 slater integrals for ag i d10 8f nconf=57 z= 47 ion= 0 exf=0.650 irel= 1 ag i d9 5s6f nconf=61 kut=-1 corrf=0.000 class 0 k rdk( 4d, 8f, 5s, 6f) frac k rek( 4d, 8f, 5s, 6f) frac - ------------------------------------- ----- - ------------------------------------- ----- 2 -0.00044210 ryd = -48.5150 cm-1 -0.927 3 -0.00002203 ryd = -2.4175 cm-1 -0.998 ag i d10 8f -d9 5s6f 2 -0.0485 5 -0.0024 5 57 61 20 0.703 0.063 745.695 sec sqrtdel= 1.0000 1.0000 0.0000 -0.0485 -0.0024 rcn mod 32 ee,eee= -1.77801 -0.88900 ee,eee= -1.17002 -1.47401 slater integrals for ag i d10 8f nconf=57 z= 47 ion= 0 exf=0.650 irel= 1 ag i d9 5s7f nconf=62 kut=-1 corrf=0.000 class 0 k rdk( 4d, 4d, 4d, 5s) frac k rek( 4d, 4d, 4d, 5s) frac - ------------------------------------- ----- - ------------------------------------- ----- 2 0.00000000 ryd = 0.0000 cm-1 0.000 2 0.00000000 ryd = 0.0000 cm-1 0.000 ag i d10 8f -d9 5s7f 1 0.0000 5 57 62 21 0.570 0.039 746.305 sec rcn mod 32 ee,eee= -0.01571 -0.00785 ee,eee= -0.02066 -0.01818 slater integrals for ag i d10 8f nconf=57 z= 47 ion= 0 exf=0.650 irel= 1 ag i d9 5s7f nconf=62 kut=-1 corrf=0.000 class 0 k rdk( 4d, 8f, 5s, 7f) frac k rek( 4d, 8f, 5s, 7f) frac - ------------------------------------- ----- - ------------------------------------- ----- 2 -0.00036687 ryd = -40.2598 cm-1 -0.947 3 -0.00001886 ryd = -2.0701 cm-1 -0.998 ag i d10 8f -d9 5s7f 2 -0.0403 5 -0.0021 5 57 62 21 0.906 0.023 747.234 sec sqrtdel= 1.0000 1.0000 0.0000 -0.0403 -0.0021 rcn mod 32 ee,eee= -1.77801 -0.88900 ee,eee= -1.17962 -1.47881 slater integrals for ag i d10 8f nconf=57 z= 47 ion= 0 exf=0.650 irel= 1 ag i d9 5s8f nconf=63 kut=-1 corrf=0.000 class 0 k rdk( 4d, 4d, 4d, 5s) frac k rek( 4d, 4d, 4d, 5s) frac - ------------------------------------- ----- - ------------------------------------- ----- 2 -0.13770996 ryd = -15111.9202 cm-1 -0.475 2 -0.13771022 ryd = -15111.9493 cm-1 -0.475 ag i d10 8f -d9 5s8f 1 -15.1119 5 57 63 22 0.711 0.023 747.977 sec rcn mod 32 ee,eee= -0.01571 -0.00785 ee,eee= -0.01580 -0.01575 slater integrals for ag i d10 8f nconf=57 z= 47 ion= 0 exf=0.650 irel= 1 ag i d9 5s8f nconf=63 kut=-1 corrf=0.000 class 0 k rdk( 4d, 8f, 5s, 8f) frac k rek( 4d, 8f, 5s, 8f) frac - ------------------------------------- ----- - ------------------------------------- ----- 2 -0.00030923 ryd = -33.9339 cm-1 -0.961 3 -0.00001623 ryd = -1.7812 cm-1 -0.998 ag i d10 8f -d9 5s8f 2 -0.0339 5 -0.0018 5 57 63 22 0.586 0.023 748.586 sec sqrtdel= 1.0000 1.0000 -15.1119 -0.0339 -0.0018 rcn mod 32 ee,eee= -1.77801 -0.88900 ee,eee= -1.18621 -1.48211 slater integrals for ag i d10 8f nconf=57 z= 47 ion= 0 exf=0.650 irel= 1 ag i d9 5s9f nconf=64 kut=-1 corrf=0.000 class 0 k rdk( 4d, 4d, 4d, 5s) frac k rek( 4d, 4d, 4d, 5s) frac - ------------------------------------- ----- - ------------------------------------- ----- 2 0.00000000 ryd = 0.0000 cm-1 0.000 2 0.00000000 ryd = 0.0000 cm-1 0.000 ag i d10 8f -d9 5s9f 1 0.0000 5 57 64 23 0.898 0.031 749.523 sec rcn mod 32 ee,eee= -0.01571 -0.00785 ee,eee= -0.01247 -0.01409 slater integrals for ag i d10 8f nconf=57 z= 47 ion= 0 exf=0.650 irel= 1 ag i d9 5s9f nconf=64 kut=-1 corrf=0.000 class 0 k rdk( 4d, 8f, 5s, 9f) frac k rek( 4d, 8f, 5s, 9f) frac - ------------------------------------- ----- - ------------------------------------- ----- 2 -0.00025576 ryd = -28.0660 cm-1 -0.951 3 -0.00001409 ryd = -1.5465 cm-1 -0.998 ag i d10 8f -d9 5s9f 2 -0.0281 5 -0.0015 5 57 64 23 1.125 0.031 750.711 sec sqrtdel= 1.0000 1.0000 0.0000 -0.0281 -0.0015 rcn mod 32 ee,eee= -1.77801 -0.88900 ee,eee= -1.16254 -1.47027 slater integrals for ag i d10 8f nconf=57 z= 47 ion= 0 exf=0.650 irel= 1 ag i d8 5s2 4f nconf=65 kut=-1 corrf=0.000 class 0 k rdk( 4d, 4d, 5s, 5s) frac k rek( 4d, 4d, 5s, 5s) frac - ------------------------------------- ----- - ------------------------------------- ----- 2 0.00000000 ryd = 0.0000 cm-1 0.000 2 0.00000000 ryd = 0.0000 cm-1 0.000 ag i d10 8f -d8 5s2 4f 1 0.0000 5 57 65 24 0.695 0.023 751.445 sec sqrtdel= 1.0000 1.0000 0.0000 rcn mod 32 ee,eee= -0.01571 -0.00785 ee,eee= -0.02778 -0.02174 slater integrals for ag i d10 8f nconf=57 z= 47 ion= 0 exf=0.650 irel= 1 ag i d9 5s6h nconf=70 kut=-1 corrf=0.000 class 0 k rdk( 4d, 8f, 5s, 6h) frac k rek( 4d, 8f, 5s, 6h) frac - ------------------------------------- ----- - ------------------------------------- ----- 2 -0.00000108 ryd = -0.1186 cm-1 -0.012 3 -0.00000010 ryd = -0.0113 cm-1 -1.000 ag i d10 8f -d9 5s6h 2 -0.0001 5 0.0000 5 57 70 29 1.133 0.023 752.641 sec sqrtdel= 1.0000 1.0000 -0.0001 0.0000 rcn mod 32 ee,eee= -0.02041 -0.01806 slater integrals for ag i d10 8f nconf=57 z= 47 ion= 0 exf=0.650 irel= 1 ag i d9 5s7h nconf=71 kut=-1 corrf=0.000 class 0 k rdk( 4d, 8f, 5s, 7h) frac k rek( 4d, 8f, 5s, 7h) frac - ------------------------------------- ----- - ------------------------------------- ----- 2 -0.00000059 ryd = -0.0647 cm-1 -0.007 3 -0.00000012 ryd = -0.0132 cm-1 -1.000 ag i d10 8f -d9 5s7h 2 -0.0001 5 0.0000 5 57 71 1 0.023 0.023 752.703 sec sqrtdel= 1.0000 1.0000 -0.0001 0.0000 rcn mod 32 ee,eee= -0.01563 -0.01567 slater integrals for ag i d10 8f nconf=57 z= 47 ion= 0 exf=0.650 irel= 1 ag i d9 5s8h nconf=72 kut=-1 corrf=0.000 class 0 k rdk( 4d, 8f, 5s, 8h) frac k rek( 4d, 8f, 5s, 8h) frac - ------------------------------------- ----- - ------------------------------------- ----- 2 0.00000007 ryd = 0.0075 cm-1 0.001 3 -0.00000012 ryd = -0.0132 cm-1 -1.000 ag i d10 8f -d9 5s8h 2 0.0000 5 0.0000 5 57 72 1 0.031 0.078 752.813 sec sqrtdel= 1.0000 1.0000 0.0000 0.0000 rcn mod 32 ee,eee= -0.01235 -0.01403 slater integrals for ag i d10 8f nconf=57 z= 47 ion= 0 exf=0.650 irel= 1 ag i d9 5s9h nconf=73 kut=-1 corrf=0.000 class 0 k rdk( 4d, 8f, 5s, 9h) frac k rek( 4d, 8f, 5s, 9h) frac - ------------------------------------- ----- - ------------------------------------- ----- 2 0.00000687 ryd = 0.7540 cm-1 0.113 3 -0.00000011 ryd = -0.0125 cm-1 -1.000 ag i d10 8f -d9 5s9h 2 0.0008 5 0.0000 5 57 73 1 0.031 0.031 752.875 sec sqrtdel= 1.0000 1.0000 0.0008 0.0000 rcn mod 32 ee,eee= -1.78458 -0.89229 ee,eee= -1.08586 -1.43522 slater integrals for ag i d10 9f nconf=58 z= 47 ion= 0 exf=0.650 irel= 1 ag i d9 5s4f nconf=59 kut=-1 corrf=0.000 class 0 k rdk( 4d, 4d, 4d, 5s) frac k rek( 4d, 4d, 4d, 5s) frac - ------------------------------------- ----- - ------------------------------------- ----- 2 0.00000000 ryd = 0.0000 cm-1 0.000 2 0.00000000 ryd = 0.0000 cm-1 0.000 ag i d10 9f -d9 5s4f 1 0.0000 5 58 59 18 0.766 0.016 753.672 sec rcn mod 32 ee,eee= -0.01240 -0.00620 ee,eee= -0.06339 -0.03790 slater integrals for ag i d10 9f nconf=58 z= 47 ion= 0 exf=0.650 irel= 1 ag i d9 5s4f nconf=59 kut=-1 corrf=0.000 class 0 k rdk( 4d, 9f, 5s, 4f) frac k rek( 4d, 9f, 5s, 4f) frac - ------------------------------------- ----- - ------------------------------------- ----- 2 -0.00049500 ryd = -54.3195 cm-1 -0.762 3 -0.00002314 ryd = -2.5393 cm-1 -0.998 ag i d10 9f -d9 5s4f 2 -0.0543 5 -0.0025 5 58 59 18 0.742 0.016 754.430 sec sqrtdel= 1.0000 1.0000 0.0000 -0.0543 -0.0025 rcn mod 32 ee,eee= -1.78458 -0.89229 ee,eee= -1.13077 -1.45767 slater integrals for ag i d10 9f nconf=58 z= 47 ion= 0 exf=0.650 irel= 1 ag i d9 5s5f nconf=60 kut=-1 corrf=0.000 class 0 k rdk( 4d, 4d, 4d, 5s) frac k rek( 4d, 4d, 4d, 5s) frac - ------------------------------------- ----- - ------------------------------------- ----- 2 0.00000000 ryd = 0.0000 cm-1 0.000 2 0.00000000 ryd = 0.0000 cm-1 0.000 ag i d10 9f -d9 5s5f 1 0.0000 5 58 60 19 0.586 0.023 755.055 sec rcn mod 32 ee,eee= -0.01240 -0.00620 ee,eee= -0.04058 -0.02649 slater integrals for ag i d10 9f nconf=58 z= 47 ion= 0 exf=0.650 irel= 1 ag i d9 5s5f nconf=60 kut=-1 corrf=0.000 class 0 k rdk( 4d, 9f, 5s, 5f) frac k rek( 4d, 9f, 5s, 5f) frac - ------------------------------------- ----- - ------------------------------------- ----- 2 -0.00044062 ryd = -48.3523 cm-1 -0.878 3 -0.00002191 ryd = -2.4040 cm-1 -0.998 ag i d10 9f -d9 5s5f 2 -0.0484 5 -0.0024 5 58 60 19 0.508 0.031 755.602 sec sqrtdel= 1.0000 1.0000 0.0000 -0.0484 -0.0024 rcn mod 32 ee,eee= -1.78458 -0.89229 ee,eee= -1.15523 -1.46991 slater integrals for ag i d10 9f nconf=58 z= 47 ion= 0 exf=0.650 irel= 1 ag i d9 5s6f nconf=61 kut=-1 corrf=0.000 class 0 k rdk( 4d, 4d, 4d, 5s) frac k rek( 4d, 4d, 4d, 5s) frac - ------------------------------------- ----- - ------------------------------------- ----- 2 0.00000000 ryd = 0.0000 cm-1 0.000 2 0.00000000 ryd = 0.0000 cm-1 0.000 ag i d10 9f -d9 5s6f 1 0.0000 5 58 61 20 0.922 0.008 756.531 sec rcn mod 32 ee,eee= -0.01240 -0.00620 ee,eee= -0.02815 -0.02028 slater integrals for ag i d10 9f nconf=58 z= 47 ion= 0 exf=0.650 irel= 1 ag i d9 5s6f nconf=61 kut=-1 corrf=0.000 class 0 k rdk( 4d, 9f, 5s, 6f) frac k rek( 4d, 9f, 5s, 6f) frac - ------------------------------------- ----- - ------------------------------------- ----- 2 -0.00036615 ryd = -40.1806 cm-1 -0.921 3 -0.00001899 ryd = -2.0836 cm-1 -0.998 ag i d10 9f -d9 5s6f 2 -0.0402 5 -0.0021 5 58 61 20 0.531 0.023 757.086 sec sqrtdel= 1.0000 1.0000 0.0000 -0.0402 -0.0021 rcn mod 32 ee,eee= -1.78458 -0.89229 ee,eee= -1.17002 -1.47730 slater integrals for ag i d10 9f nconf=58 z= 47 ion= 0 exf=0.650 irel= 1 ag i d9 5s7f nconf=62 kut=-1 corrf=0.000 class 0 k rdk( 4d, 4d, 4d, 5s) frac k rek( 4d, 4d, 4d, 5s) frac - ------------------------------------- ----- - ------------------------------------- ----- 2 0.00000000 ryd = 0.0000 cm-1 0.000 2 0.00000000 ryd = 0.0000 cm-1 0.000 ag i d10 9f -d9 5s7f 1 0.0000 5 58 62 21 0.852 0.016 757.961 sec rcn mod 32 ee,eee= -0.01240 -0.00620 ee,eee= -0.02066 -0.01653 slater integrals for ag i d10 9f nconf=58 z= 47 ion= 0 exf=0.650 irel= 1 ag i d9 5s7f nconf=62 kut=-1 corrf=0.000 class 0 k rdk( 4d, 9f, 5s, 7f) frac k rek( 4d, 9f, 5s, 7f) frac - ------------------------------------- ----- - ------------------------------------- ----- 2 -0.00030406 ryd = -33.3670 cm-1 -0.941 3 -0.00001626 ryd = -1.7843 cm-1 -0.998 ag i d10 9f -d9 5s7f 2 -0.0334 5 -0.0018 5 58 62 21 1.305 0.031 759.297 sec sqrtdel= 1.0000 1.0000 0.0000 -0.0334 -0.0018 rcn mod 32 ee,eee= -1.78458 -0.89229 ee,eee= -1.17962 -1.48210 slater integrals for ag i d10 9f nconf=58 z= 47 ion= 0 exf=0.650 irel= 1 ag i d9 5s8f nconf=63 kut=-1 corrf=0.000 class 0 k rdk( 4d, 4d, 4d, 5s) frac k rek( 4d, 4d, 4d, 5s) frac - ------------------------------------- ----- - ------------------------------------- ----- 2 0.00000000 ryd = 0.0000 cm-1 0.000 2 0.00000000 ryd = 0.0000 cm-1 0.000 ag i d10 9f -d9 5s8f 1 0.0000 5 58 63 22 0.578 0.063 759.945 sec rcn mod 32 ee,eee= -0.01240 -0.00620 ee,eee= -0.01580 -0.01410 slater integrals for ag i d10 9f nconf=58 z= 47 ion= 0 exf=0.650 irel= 1 ag i d9 5s8f nconf=63 kut=-1 corrf=0.000 class 0 k rdk( 4d, 9f, 5s, 8f) frac k rek( 4d, 9f, 5s, 8f) frac - ------------------------------------- ----- - ------------------------------------- ----- 2 -0.00025566 ryd = -28.0551 cm-1 -0.951 3 -0.00001399 ryd = -1.5353 cm-1 -0.998 ag i d10 9f -d9 5s8f 2 -0.0281 5 -0.0015 5 58 63 22 0.586 0.063 760.594 sec sqrtdel= 1.0000 1.0000 0.0000 -0.0281 -0.0015 rcn mod 32 ee,eee= -1.78458 -0.89229 ee,eee= -1.18621 -1.48540 slater integrals for ag i d10 9f nconf=58 z= 47 ion= 0 exf=0.650 irel= 1 ag i d9 5s9f nconf=64 kut=-1 corrf=0.000 class 0 k rdk( 4d, 4d, 4d, 5s) frac k rek( 4d, 4d, 4d, 5s) frac - ------------------------------------- ----- - ------------------------------------- ----- 2 -0.13771082 ryd = -15112.0153 cm-1 -0.475 2 -0.13771109 ryd = -15112.0444 cm-1 -0.475 ag i d10 9f -d9 5s9f 1 -15.1120 5 58 64 23 1.086 0.016 761.695 sec rcn mod 32 ee,eee= -0.01240 -0.00620 ee,eee= -0.01247 -0.01244 slater integrals for ag i d10 9f nconf=58 z= 47 ion= 0 exf=0.650 irel= 1 ag i d9 5s9f nconf=64 kut=-1 corrf=0.000 class 0 k rdk( 4d, 9f, 5s, 9f) frac k rek( 4d, 9f, 5s, 9f) frac - ------------------------------------- ----- - ------------------------------------- ----- 2 -0.00021850 ryd = -23.9781 cm-1 -0.961 3 -0.00001215 ryd = -1.3331 cm-1 -0.998 ag i d10 9f -d9 5s9f 2 -0.0240 5 -0.0013 5 58 64 23 0.688 0.031 762.414 sec sqrtdel= 1.0000 1.0000 -15.1120 -0.0240 -0.0013 rcn mod 32 ee,eee= -1.78458 -0.89229 ee,eee= -1.16254 -1.47356 slater integrals for ag i d10 9f nconf=58 z= 47 ion= 0 exf=0.650 irel= 1 ag i d8 5s2 4f nconf=65 kut=-1 corrf=0.000 class 0 k rdk( 4d, 4d, 5s, 5s) frac k rek( 4d, 4d, 5s, 5s) frac - ------------------------------------- ----- - ------------------------------------- ----- 2 0.00000000 ryd = 0.0000 cm-1 0.000 2 0.00000000 ryd = 0.0000 cm-1 0.000 ag i d10 9f -d8 5s2 4f 1 0.0000 5 58 65 24 0.703 0.008 763.133 sec sqrtdel= 1.0000 1.0000 0.0000 rcn mod 32 ee,eee= -0.01240 -0.00620 ee,eee= -0.02778 -0.02009 slater integrals for ag i d10 9f nconf=58 z= 47 ion= 0 exf=0.650 irel= 1 ag i d9 5s6h nconf=70 kut=-1 corrf=0.000 class 0 k rdk( 4d, 9f, 5s, 6h) frac k rek( 4d, 9f, 5s, 6h) frac - ------------------------------------- ----- - ------------------------------------- ----- 2 -0.00000106 ryd = -0.1163 cm-1 -0.014 3 -0.00000009 ryd = -0.0097 cm-1 -1.000 ag i d10 9f -d9 5s6h 2 -0.0001 5 0.0000 5 58 70 29 1.047 0.023 764.227 sec sqrtdel= 1.0000 1.0000 -0.0001 0.0000 rcn mod 32 ee,eee= -0.02041 -0.01641 slater integrals for ag i d10 9f nconf=58 z= 47 ion= 0 exf=0.650 irel= 1 ag i d9 5s7h nconf=71 kut=-1 corrf=0.000 class 0 k rdk( 4d, 9f, 5s, 7h) frac k rek( 4d, 9f, 5s, 7h) frac - ------------------------------------- ----- - ------------------------------------- ----- 2 -0.00000084 ryd = -0.0921 cm-1 -0.013 3 -0.00000010 ryd = -0.0114 cm-1 -1.000 ag i d10 9f -d9 5s7h 2 -0.0001 5 0.0000 5 58 71 1 0.023 0.031 764.281 sec sqrtdel= 1.0000 1.0000 -0.0001 0.0000 rcn mod 32 ee,eee= -0.01563 -0.01402 slater integrals for ag i d10 9f nconf=58 z= 47 ion= 0 exf=0.650 irel= 1 ag i d9 5s8h nconf=72 kut=-1 corrf=0.000 class 0 k rdk( 4d, 9f, 5s, 8h) frac k rek( 4d, 9f, 5s, 8h) frac - ------------------------------------- ----- - ------------------------------------- ----- 2 -0.00000036 ryd = -0.0400 cm-1 -0.006 3 -0.00000010 ryd = -0.0114 cm-1 -1.000 ag i d10 9f -d9 5s8h 2 0.0000 5 0.0000 5 58 72 1 0.031 0.023 764.336 sec sqrtdel= 1.0000 1.0000 0.0000 0.0000 rcn mod 32 ee,eee= -0.01235 -0.01237 slater integrals for ag i d10 9f nconf=58 z= 47 ion= 0 exf=0.650 irel= 1 ag i d9 5s9h nconf=73 kut=-1 corrf=0.000 class 0 k rdk( 4d, 9f, 5s, 9h) frac k rek( 4d, 9f, 5s, 9h) frac - ------------------------------------- ----- - ------------------------------------- ----- 2 0.00000006 ryd = 0.0064 cm-1 0.001 3 -0.00000010 ryd = -0.0108 cm-1 -1.000 ag i d10 9f -d9 5s9h 2 0.0000 5 0.0000 5 58 73 1 0.031 0.016 764.391 sec sqrtdel= 1.0000 1.0000 0.0000 0.0000 rcn mod 32 ee,eee= -0.06339 -0.03169 ee,eee= -0.04058 -0.05199 slater integrals for ag i d9 5s4f nconf=59 z= 47 ion= 0 exf=0.650 irel= 1 ag i d9 5s5f nconf=60 kut=-1 corrf=0.000 class 11 k rdk( 4d, 4f, 4d, 5f) frac k rek( 4d, 4f, 4d, 5f) frac - ------------------------------------- ----- - ------------------------------------- ----- 0 0.03011088 ryd = 3304.2865 cm-1 0.407 1 0.00001850 ryd = 2.0302 cm-1 0.999 2 0.00097160 ryd = 106.6207 cm-1 0.885 3 0.00001028 ryd = 1.1278 cm-1 1.000 4 0.00007182 ryd = 7.8815 cm-1 0.989 5 0.00000696 ryd = 0.7637 cm-1 1.000 - ------------------------------------- ----- - ------------------------------------- ----- 0 0.03011088 ryd = 3304.2865 cm-1 0.407 1 0.00001850 ryd = 2.0302 cm-1 0.999 2 0.00097160 ryd = 106.6207 cm-1 0.885 3 0.00001028 ryd = 1.1278 cm-1 1.000 4 0.00007182 ryd = 7.8815 cm-1 0.989 5 0.00000696 ryd = 0.7637 cm-1 1.000 - ------------------------------------- ----- - ------------------------------------- ----- 0 0.03011088 ryd = 3304.2865 cm-1 0.407 1 0.00001850 ryd = 2.0301 cm-1 0.999 2 0.00097160 ryd = 106.6207 cm-1 0.885 3 0.00001028 ryd = 1.1278 cm-1 1.000 4 0.00007182 ryd = 7.8815 cm-1 0.989 5 0.00000696 ryd = 0.7637 cm-1 1.000 - ------------------------------------- ----- - ------------------------------------- ----- 0 0.03011088 ryd = 3304.2865 cm-1 0.407 1 0.00001850 ryd = 2.0302 cm-1 0.999 2 0.00097160 ryd = 106.6207 cm-1 0.885 3 0.00001028 ryd = 1.1278 cm-1 1.000 4 0.00007182 ryd = 7.8815 cm-1 0.989 5 0.00000696 ryd = 0.7637 cm-1 1.000 9.00000 0.00017 2.00000 1.00000 3.00000 0.00000 -0.05199 0.00000 9.00000 0.00009 2.00000 3.00000 3.00000 0.00000 -0.05199 0.00000 9.00000 0.00006 2.00000 5.00000 3.00000 0.00000 -0.05199 0.00000 ag i d9 5s4f -d9 5s5f 6 0.0000 5 0.1066 5 0.0079 5 0.0020 5 0.0011 5 0.0008 5 59 60 19 0.641 0.180 765.234 sec rcn mod 32 ee,eee= -0.06339 -0.03169 ee,eee= -0.04058 -0.05199 slater integrals for ag i d9 5s4f nconf=59 z= 47 ion= 0 exf=0.650 irel= 1 ag i d9 5s5f nconf=60 kut=-1 corrf=0.000 class 11 k rdk( 5s, 4f, 5s, 5f) frac k rek( 5s, 4f, 5s, 5f) frac - ------------------------------------- ----- - ------------------------------------- ----- 0 0.03009762 ryd = 3302.8323 cm-1 0.407 3 0.00021041 ryd = 23.0900 cm-1 1.000 - ------------------------------------- ----- - ------------------------------------- ----- 0 0.03009762 ryd = 3302.8319 cm-1 0.407 3 0.00021047 ryd = 23.0964 cm-1 1.000 - ------------------------------------- ----- - ------------------------------------- ----- 0 0.03009763 ryd = 3302.8327 cm-1 0.407 3 0.00021036 ryd = 23.0840 cm-1 1.000 - ------------------------------------- ----- - ------------------------------------- ----- 0 0.03009762 ryd = 3302.8323 cm-1 0.407 3 0.00021041 ryd = 23.0902 cm-1 1.000 1.00000 0.00021 0.00000 3.00000 3.00000 0.00000 -0.05199 0.00000 ag i d9 5s4f -d9 5s5f 2 0.0000 5 0.0231 5 59 60 19 1.313 0.188 766.734 sec sqrtdel= 1.0000 1.0000 0.0000 0.1066 0.0079 0.0020 0.0011 0.0008 0.0000 0.0231 rcn mod 32 ee,eee= -0.06339 -0.03169 ee,eee= -0.02815 -0.04577 slater integrals for ag i d9 5s4f nconf=59 z= 47 ion= 0 exf=0.650 irel= 1 ag i d9 5s6f nconf=61 kut=-1 corrf=0.000 class 11 k rdk( 4d, 4f, 4d, 6f) frac k rek( 4d, 4f, 4d, 6f) frac - ------------------------------------- ----- - ------------------------------------- ----- 0 0.01710229 ryd = 1876.7590 cm-1 0.331 1 0.00001622 ryd = 1.7802 cm-1 0.999 2 0.00068996 ryd = 75.7139 cm-1 0.841 3 0.00000901 ryd = 0.9891 cm-1 1.000 4 0.00005766 ryd = 6.3277 cm-1 0.983 5 0.00000610 ryd = 0.6698 cm-1 1.000 - ------------------------------------- ----- - ------------------------------------- ----- 0 0.01710229 ryd = 1876.7590 cm-1 0.331 1 0.00001622 ryd = 1.7802 cm-1 0.999 2 0.00068996 ryd = 75.7140 cm-1 0.841 3 0.00000901 ryd = 0.9892 cm-1 1.000 4 0.00005766 ryd = 6.3277 cm-1 0.983 5 0.00000610 ryd = 0.6698 cm-1 1.000 - ------------------------------------- ----- - ------------------------------------- ----- 0 0.01710229 ryd = 1876.7590 cm-1 0.331 1 0.00001622 ryd = 1.7801 cm-1 0.999 2 0.00068996 ryd = 75.7139 cm-1 0.841 3 0.00000901 ryd = 0.9891 cm-1 1.000 4 0.00005766 ryd = 6.3277 cm-1 0.983 5 0.00000610 ryd = 0.6698 cm-1 1.000 - ------------------------------------- ----- - ------------------------------------- ----- 0 0.01710229 ryd = 1876.7590 cm-1 0.331 1 0.00001622 ryd = 1.7802 cm-1 0.999 2 0.00068996 ryd = 75.7139 cm-1 0.841 3 0.00000901 ryd = 0.9891 cm-1 1.000 4 0.00005766 ryd = 6.3277 cm-1 0.983 5 0.00000610 ryd = 0.6698 cm-1 1.000 9.00000 0.00015 2.00000 1.00000 3.00000 0.00000 -0.04577 0.00000 9.00000 0.00008 2.00000 3.00000 3.00000 0.00000 -0.04577 0.00000 9.00000 0.00005 2.00000 5.00000 3.00000 0.00000 -0.04577 0.00000 ag i d9 5s4f -d9 5s6f 6 0.0000 5 0.0757 5 0.0063 5 0.0018 5 0.0010 5 0.0007 5 59 61 20 0.594 0.164 767.500 sec rcn mod 32 ee,eee= -0.06339 -0.03169 ee,eee= -0.02815 -0.04577 slater integrals for ag i d9 5s4f nconf=59 z= 47 ion= 0 exf=0.650 irel= 1 ag i d9 5s6f nconf=61 kut=-1 corrf=0.000 class 11 k rdk( 5s, 4f, 5s, 6f) frac k rek( 5s, 4f, 5s, 6f) frac - ------------------------------------- ----- - ------------------------------------- ----- 0 0.01709074 ryd = 1875.4923 cm-1 0.331 3 0.00017988 ryd = 19.7395 cm-1 0.999 - ------------------------------------- ----- - ------------------------------------- ----- 0 0.01709074 ryd = 1875.4917 cm-1 0.331 3 0.00017997 ryd = 19.7495 cm-1 0.999 - ------------------------------------- ----- - ------------------------------------- ----- 0 0.01709075 ryd = 1875.4929 cm-1 0.331 3 0.00017979 ryd = 19.7302 cm-1 0.999 - ------------------------------------- ----- - ------------------------------------- ----- 0 0.01709074 ryd = 1875.4923 cm-1 0.331 3 0.00017988 ryd = 19.7398 cm-1 0.999 1.00000 0.00018 0.00000 3.00000 3.00000 0.00000 -0.04577 0.00000 ag i d9 5s4f -d9 5s6f 2 0.0000 5 0.0197 5 59 61 20 0.547 0.305 768.352 sec sqrtdel= 1.0000 1.0000 0.0000 0.0757 0.0063 0.0018 0.0010 0.0007 0.0000 0.0197 rcn mod 32 ee,eee= -0.06339 -0.03169 ee,eee= -0.02066 -0.04202 slater integrals for ag i d9 5s4f nconf=59 z= 47 ion= 0 exf=0.650 irel= 1 ag i d9 5s7f nconf=62 kut=-1 corrf=0.000 class 11 k rdk( 4d, 4f, 4d, 7f) frac k rek( 4d, 4f, 4d, 7f) frac - ------------------------------------- ----- - ------------------------------------- ----- 0 0.01171706 ryd = 1285.7991 cm-1 0.296 1 0.00001399 ryd = 1.5352 cm-1 0.999 2 0.00052873 ryd = 58.0211 cm-1 0.818 3 0.00000777 ryd = 0.8532 cm-1 1.000 4 0.00004724 ryd = 5.1838 cm-1 0.979 5 0.00000527 ryd = 0.5778 cm-1 1.000 - ------------------------------------- ----- - ------------------------------------- ----- 0 0.01171706 ryd = 1285.7991 cm-1 0.296 1 0.00001399 ryd = 1.5353 cm-1 0.999 2 0.00052873 ryd = 58.0212 cm-1 0.818 3 0.00000777 ryd = 0.8532 cm-1 1.000 4 0.00004724 ryd = 5.1838 cm-1 0.979 5 0.00000527 ryd = 0.5778 cm-1 1.000 - ------------------------------------- ----- - ------------------------------------- ----- 0 0.01171706 ryd = 1285.7991 cm-1 0.296 1 0.00001399 ryd = 1.5352 cm-1 0.999 2 0.00052873 ryd = 58.0210 cm-1 0.818 3 0.00000777 ryd = 0.8531 cm-1 1.000 4 0.00004724 ryd = 5.1837 cm-1 0.979 5 0.00000526 ryd = 0.5778 cm-1 1.000 - ------------------------------------- ----- - ------------------------------------- ----- 0 0.01171706 ryd = 1285.7991 cm-1 0.296 1 0.00001399 ryd = 1.5352 cm-1 0.999 2 0.00052873 ryd = 58.0211 cm-1 0.818 3 0.00000777 ryd = 0.8532 cm-1 1.000 4 0.00004724 ryd = 5.1838 cm-1 0.979 5 0.00000527 ryd = 0.5778 cm-1 1.000 9.00000 0.00013 2.00000 1.00000 3.00000 0.00000 -0.04202 0.00000 9.00000 0.00007 2.00000 3.00000 3.00000 0.00000 -0.04202 0.00000 9.00000 0.00005 2.00000 5.00000 3.00000 0.00000 -0.04202 0.00000 ag i d9 5s4f -d9 5s7f 6 0.0000 5 0.0580 5 0.0052 5 0.0015 5 0.0009 5 0.0006 5 59 62 21 0.750 0.227 769.352 sec rcn mod 32 ee,eee= -0.06339 -0.03169 ee,eee= -0.02066 -0.04202 slater integrals for ag i d9 5s4f nconf=59 z= 47 ion= 0 exf=0.650 irel= 1 ag i d9 5s7f nconf=62 kut=-1 corrf=0.000 class 11 k rdk( 5s, 4f, 5s, 7f) frac k rek( 5s, 4f, 5s, 7f) frac - ------------------------------------- ----- - ------------------------------------- ----- 0 0.01170715 ryd = 1284.7110 cm-1 0.296 3 0.00015272 ryd = 16.7589 cm-1 0.999 - ------------------------------------- ----- - ------------------------------------- ----- 0 0.01170714 ryd = 1284.7104 cm-1 0.296 3 0.00015282 ryd = 16.7697 cm-1 0.999 - ------------------------------------- ----- - ------------------------------------- ----- 0 0.01170715 ryd = 1284.7117 cm-1 0.296 3 0.00015263 ryd = 16.7491 cm-1 0.999 - ------------------------------------- ----- - ------------------------------------- ----- 0 0.01170715 ryd = 1284.7110 cm-1 0.296 3 0.00015272 ryd = 16.7594 cm-1 0.999 1.00000 0.00015 0.00000 3.00000 3.00000 0.00000 -0.04202 0.00000 ag i d9 5s4f -d9 5s7f 2 0.0000 5 0.0168 5 59 62 21 0.828 0.055 770.234 sec sqrtdel= 1.0000 1.0000 0.0000 0.0580 0.0052 0.0015 0.0009 0.0006 0.0000 0.0168 rcn mod 32 ee,eee= -0.06339 -0.03169 ee,eee= -0.01580 -0.03959 slater integrals for ag i d9 5s4f nconf=59 z= 47 ion= 0 exf=0.650 irel= 1 ag i d9 5s8f nconf=63 kut=-1 corrf=0.000 class 11 k rdk( 4d, 4f, 4d, 8f) frac k rek( 4d, 4f, 4d, 8f) frac - ------------------------------------- ----- - ------------------------------------- ----- 0 0.00878666 ryd = 964.2244 cm-1 0.277 1 0.00001209 ryd = 1.3272 cm-1 0.999 2 0.00042406 ryd = 46.5351 cm-1 0.804 3 0.00000672 ryd = 0.7376 cm-1 1.000 4 0.00003950 ryd = 4.3342 cm-1 0.976 5 0.00000455 ryd = 0.4996 cm-1 1.000 - ------------------------------------- ----- - ------------------------------------- ----- 0 0.00878666 ryd = 964.2244 cm-1 0.277 1 0.00001210 ryd = 1.3273 cm-1 0.999 2 0.00042406 ryd = 46.5352 cm-1 0.804 3 0.00000672 ryd = 0.7377 cm-1 1.000 4 0.00003950 ryd = 4.3343 cm-1 0.976 5 0.00000455 ryd = 0.4996 cm-1 1.000 - ------------------------------------- ----- - ------------------------------------- ----- 0 0.00878666 ryd = 964.2244 cm-1 0.277 1 0.00001209 ryd = 1.3272 cm-1 0.999 2 0.00042406 ryd = 46.5350 cm-1 0.804 3 0.00000672 ryd = 0.7376 cm-1 1.000 4 0.00003950 ryd = 4.3342 cm-1 0.976 5 0.00000455 ryd = 0.4995 cm-1 1.000 - ------------------------------------- ----- - ------------------------------------- ----- 0 0.00878666 ryd = 964.2244 cm-1 0.277 1 0.00001209 ryd = 1.3272 cm-1 0.999 2 0.00042406 ryd = 46.5351 cm-1 0.804 3 0.00000672 ryd = 0.7376 cm-1 1.000 4 0.00003950 ryd = 4.3342 cm-1 0.976 5 0.00000455 ryd = 0.4996 cm-1 1.000 9.00000 0.00011 2.00000 1.00000 3.00000 0.00000 -0.03959 0.00000 9.00000 0.00006 2.00000 3.00000 3.00000 0.00000 -0.03959 0.00000 9.00000 0.00004 2.00000 5.00000 3.00000 0.00000 -0.03959 0.00000 ag i d9 5s4f -d9 5s8f 6 0.0000 5 0.0465 5 0.0043 5 0.0013 5 0.0007 5 0.0005 5 59 63 22 1.016 0.125 771.375 sec rcn mod 32 ee,eee= -0.06339 -0.03169 ee,eee= -0.01580 -0.03959 slater integrals for ag i d9 5s4f nconf=59 z= 47 ion= 0 exf=0.650 irel= 1 ag i d9 5s8f nconf=63 kut=-1 corrf=0.000 class 11 k rdk( 5s, 4f, 5s, 8f) frac k rek( 5s, 4f, 5s, 8f) frac - ------------------------------------- ----- - ------------------------------------- ----- 0 0.00877811 ryd = 963.2862 cm-1 0.277 3 0.00013064 ryd = 14.3361 cm-1 0.999 - ------------------------------------- ----- - ------------------------------------- ----- 0 0.00877810 ryd = 963.2856 cm-1 0.277 3 0.00013073 ryd = 14.3464 cm-1 0.999 - ------------------------------------- ----- - ------------------------------------- ----- 0 0.00877812 ryd = 963.2869 cm-1 0.277 3 0.00013056 ryd = 14.3269 cm-1 0.999 - ------------------------------------- ----- - ------------------------------------- ----- 0 0.00877811 ryd = 963.2863 cm-1 0.277 3 0.00013065 ryd = 14.3366 cm-1 0.999 1.00000 0.00013 0.00000 3.00000 3.00000 0.00000 -0.03959 0.00000 ag i d9 5s4f -d9 5s8f 2 0.0000 5 0.0143 5 59 63 22 0.586 0.063 772.023 sec sqrtdel= 1.0000 1.0000 0.0000 0.0465 0.0043 0.0013 0.0007 0.0005 0.0000 0.0143 rcn mod 32 ee,eee= -0.06339 -0.03169 ee,eee= -0.01247 -0.03793 slater integrals for ag i d9 5s4f nconf=59 z= 47 ion= 0 exf=0.650 irel= 1 ag i d9 5s9f nconf=64 kut=-1 corrf=0.000 class 11 k rdk( 4d, 4f, 4d, 9f) frac k rek( 4d, 4f, 4d, 9f) frac - ------------------------------------- ----- - ------------------------------------- ----- 0 0.00695352 ryd = 763.0604 cm-1 0.265 1 0.00001054 ryd = 1.1562 cm-1 0.999 2 0.00035087 ryd = 38.5039 cm-1 0.795 3 0.00000586 ryd = 0.6427 cm-1 1.000 4 0.00003362 ryd = 3.6889 cm-1 0.974 5 0.00000397 ryd = 0.4352 cm-1 1.000 - ------------------------------------- ----- - ------------------------------------- ----- 0 0.00695352 ryd = 763.0604 cm-1 0.265 1 0.00001054 ryd = 1.1563 cm-1 0.999 2 0.00035087 ryd = 38.5040 cm-1 0.795 3 0.00000586 ryd = 0.6427 cm-1 1.000 4 0.00003362 ryd = 3.6889 cm-1 0.974 5 0.00000397 ryd = 0.4353 cm-1 1.000 - ------------------------------------- ----- - ------------------------------------- ----- 0 0.00695352 ryd = 763.0604 cm-1 0.265 1 0.00001054 ryd = 1.1562 cm-1 0.999 2 0.00035087 ryd = 38.5039 cm-1 0.795 3 0.00000586 ryd = 0.6426 cm-1 1.000 4 0.00003362 ryd = 3.6888 cm-1 0.974 5 0.00000397 ryd = 0.4352 cm-1 1.000 - ------------------------------------- ----- - ------------------------------------- ----- 0 0.00695352 ryd = 763.0604 cm-1 0.265 1 0.00001054 ryd = 1.1562 cm-1 0.999 2 0.00035087 ryd = 38.5039 cm-1 0.795 3 0.00000586 ryd = 0.6427 cm-1 1.000 4 0.00003362 ryd = 3.6889 cm-1 0.974 5 0.00000397 ryd = 0.4352 cm-1 1.000 9.00000 0.00009 2.00000 1.00000 3.00000 0.00000 -0.03793 0.00000 9.00000 0.00005 2.00000 3.00000 3.00000 0.00000 -0.03793 0.00000 9.00000 0.00004 2.00000 5.00000 3.00000 0.00000 -0.03793 0.00000 ag i d9 5s4f -d9 5s9f 6 0.0000 5 0.0385 5 0.0037 5 0.0012 5 0.0006 5 0.0004 5 59 64 23 0.703 0.500 773.227 sec rcn mod 32 ee,eee= -0.06339 -0.03169 ee,eee= -0.01247 -0.03793 slater integrals for ag i d9 5s4f nconf=59 z= 47 ion= 0 exf=0.650 irel= 1 ag i d9 5s9f nconf=64 kut=-1 corrf=0.000 class 11 k rdk( 5s, 4f, 5s, 9f) frac k rek( 5s, 4f, 5s, 9f) frac - ------------------------------------- ----- - ------------------------------------- ----- 0 0.00694608 ryd = 762.2446 cm-1 0.265 3 0.00011295 ryd = 12.3953 cm-1 0.999 - ------------------------------------- ----- - ------------------------------------- ----- 0 0.00694608 ryd = 762.2440 cm-1 0.265 3 0.00011304 ryd = 12.4048 cm-1 0.999 - ------------------------------------- ----- - ------------------------------------- ----- 0 0.00694609 ryd = 762.2452 cm-1 0.265 3 0.00011288 ryd = 12.3869 cm-1 0.999 - ------------------------------------- ----- - ------------------------------------- ----- 0 0.00694608 ryd = 762.2446 cm-1 0.265 3 0.00011296 ryd = 12.3958 cm-1 0.999 1.00000 0.00011 0.00000 3.00000 3.00000 0.00000 -0.03793 0.00000 ag i d9 5s4f -d9 5s9f 2 0.0000 5 0.0124 5 59 64 23 0.773 0.070 774.070 sec sqrtdel= 1.0000 1.0000 0.0000 0.0385 0.0037 0.0012 0.0006 0.0004 0.0000 0.0124 rcn mod 32 ee,eee= -1.97791 -0.98896 ee,eee= -1.16254 -1.57023 slater integrals for ag i d9 5s4f nconf=59 z= 47 ion= 0 exf=0.650 irel= 1 ag i d8 5s2 4f nconf=65 kut=-1 corrf=0.000 class 0 k rdk( 4d, 4d, 4d, 5s) frac k rek( 4d, 4d, 4d, 5s) frac - ------------------------------------- ----- - ------------------------------------- ----- 2 -0.13223049 ryd = -14510.6182 cm-1 -0.438 2 -0.13223077 ryd = -14510.6495 cm-1 -0.438 ag i d9 5s4f -d8 5s2 4f 1 -14.5106 5 59 65 24 1.203 0.117 775.414 sec rcn mod 32 ee,eee= -0.06339 -0.03169 ee,eee= -0.06347 -0.06343 slater integrals for ag i d9 5s4f nconf=59 z= 47 ion= 0 exf=0.650 irel= 1 ag i d8 5s2 4f nconf=65 kut=-1 corrf=0.000 class 0 k rdk( 4d, 4f, 5s, 4f) frac k rek( 4d, 4f, 5s, 4f) frac - ------------------------------------- ----- - ------------------------------------- ----- 2 -0.00212190 ryd = -232.8519 cm-1 -0.954 3 -0.00004003 ryd = -4.3926 cm-1 -0.997 ag i d9 5s4f -d8 5s2 4f 2 -0.2329 5 -0.0044 5 59 65 24 0.641 0.047 776.102 sec sqrtdel= 1.0000 1.0000 -14.5106 -0.2329 -0.0044 rcn mod 32 ee,eee= -0.06339 -0.03169 ee,eee= -0.02778 -0.04558 slater integrals for ag i d9 5s4f nconf=59 z= 47 ion= 0 exf=0.650 irel= 1 ag i d10 6h nconf=66 kut=-1 corrf=0.000 class 0 k rdk( 5s, 4f, 4d, 6h) frac k rek( 5s, 4f, 4d, 6h) frac - ------------------------------------- ----- - ------------------------------------- ----- 2 -0.00027957 ryd = -30.6796 cm-1 -0.961 5 -0.00000015 ryd = -0.0165 cm-1 -1.000 ag i d9 5s4f -d10 6h 2 -0.0307 5 0.0000 5 59 66 25 0.789 0.016 776.922 sec sqrtdel= 1.0000 1.0000 -0.0307 0.0000 rcn mod 32 ee,eee= -0.02041 -0.04190 slater integrals for ag i d9 5s4f nconf=59 z= 47 ion= 0 exf=0.650 irel= 1 ag i d10 7h nconf=67 kut=-1 corrf=0.000 class 0 k rdk( 5s, 4f, 4d, 7h) frac k rek( 5s, 4f, 4d, 7h) frac - ------------------------------------- ----- - ------------------------------------- ----- 2 -0.00027167 ryd = -29.8119 cm-1 -0.959 5 -0.00000018 ryd = -0.0193 cm-1 -1.000 ag i d9 5s4f -d10 7h 2 -0.0298 5 0.0000 5 59 67 1 0.023 0.023 776.977 sec sqrtdel= 1.0000 1.0000 -0.0298 0.0000 rcn mod 32 ee,eee= -0.01563 -0.03951 slater integrals for ag i d9 5s4f nconf=59 z= 47 ion= 0 exf=0.650 irel= 1 ag i d10 8h nconf=68 kut=-1 corrf=0.000 class 0 k rdk( 5s, 4f, 4d, 8h) frac k rek( 5s, 4f, 4d, 8h) frac - ------------------------------------- ----- - ------------------------------------- ----- 2 -0.00024232 ryd = -26.5912 cm-1 -0.955 5 -0.00000018 ryd = -0.0193 cm-1 -1.000 ag i d9 5s4f -d10 8h 2 -0.0266 5 0.0000 5 59 68 1 0.016 0.070 777.070 sec sqrtdel= 1.0000 1.0000 -0.0266 0.0000 rcn mod 32 ee,eee= -0.01234 -0.03787 slater integrals for ag i d9 5s4f nconf=59 z= 47 ion= 0 exf=0.650 irel= 1 ag i d10 9h nconf=69 kut=-1 corrf=0.000 class 0 k rdk( 5s, 4f, 4d, 9h) frac k rek( 5s, 4f, 4d, 9h) frac - ------------------------------------- ----- - ------------------------------------- ----- 2 -0.00021280 ryd = -23.3525 cm-1 -0.951 5 -0.00000017 ryd = -0.0182 cm-1 -1.000 ag i d9 5s4f -d10 9h 2 -0.0234 5 0.0000 5 59 69 1 0.031 0.031 777.133 sec sqrtdel= 1.0000 1.0000 -0.0234 0.0000 rcn mod 32 ee,eee= -0.06339 -0.03169 ee,eee= -0.02778 -0.04558 slater integrals for ag i d9 5s4f nconf=59 z= 47 ion= 0 exf=0.650 irel= 1 ag i d9 5s6h nconf=70 kut=-1 corrf=0.000 class 0 k rdk( 4d, 4f, 4d, 6h) frac k rek( 4d, 4f, 4d, 6h) frac - ------------------------------------- ----- - ------------------------------------- ----- 2 0.00019168 ryd = 21.0346 cm-1 1.000 3 0.00000002 ryd = 0.0025 cm-1 1.000 4 0.00000335 ryd = 0.3672 cm-1 1.000 5 0.00000002 ryd = 0.0017 cm-1 1.000 ag i d9 5s4f -d9 5s6h 4 0.0210 5 0.0004 5 0.0000 5 0.0000 5 59 70 29 1.195 0.031 778.367 sec sqrtdel= 1.0000 1.0000 0.0210 0.0004 0.0000 0.0000 rcn mod 32 ee,eee= -0.02041 -0.04190 slater integrals for ag i d9 5s4f nconf=59 z= 47 ion= 0 exf=0.650 irel= 1 ag i d9 5s7h nconf=71 kut=-1 corrf=0.000 class 0 k rdk( 4d, 4f, 4d, 7h) frac k rek( 4d, 4f, 4d, 7h) frac - ------------------------------------- ----- - ------------------------------------- ----- 2 0.00018627 ryd = 20.4408 cm-1 0.997 3 0.00000003 ryd = 0.0029 cm-1 1.000 4 0.00000357 ryd = 0.3920 cm-1 1.000 5 0.00000002 ryd = 0.0020 cm-1 1.000 ag i d9 5s4f -d9 5s7h 4 0.0204 5 0.0004 5 0.0000 5 0.0000 5 59 71 1 0.023 0.023 778.430 sec sqrtdel= 1.0000 1.0000 0.0204 0.0004 0.0000 0.0000 rcn mod 32 ee,eee= -0.01563 -0.03951 slater integrals for ag i d9 5s4f nconf=59 z= 47 ion= 0 exf=0.650 irel= 1 ag i d9 5s8h nconf=72 kut=-1 corrf=0.000 class 0 k rdk( 4d, 4f, 4d, 8h) frac k rek( 4d, 4f, 4d, 8h) frac - ------------------------------------- ----- - ------------------------------------- ----- 2 0.00016615 ryd = 18.2334 cm-1 0.993 3 0.00000003 ryd = 0.0030 cm-1 1.000 4 0.00000337 ryd = 0.3695 cm-1 0.999 5 0.00000002 ryd = 0.0020 cm-1 1.000 ag i d9 5s4f -d9 5s8h 4 0.0182 5 0.0004 5 0.0000 5 0.0000 5 59 72 1 0.031 0.023 778.500 sec sqrtdel= 1.0000 1.0000 0.0182 0.0004 0.0000 0.0000 rcn mod 32 ee,eee= -0.01235 -0.03787 slater integrals for ag i d9 5s4f nconf=59 z= 47 ion= 0 exf=0.650 irel= 1 ag i d9 5s9h nconf=73 kut=-1 corrf=0.000 class 0 k rdk( 4d, 4f, 4d, 9h) frac k rek( 4d, 4f, 4d, 9h) frac - ------------------------------------- ----- - ------------------------------------- ----- 2 0.00014592 ryd = 16.0133 cm-1 0.989 3 0.00000003 ryd = 0.0028 cm-1 1.000 4 0.00000306 ryd = 0.3363 cm-1 0.999 5 0.00000002 ryd = 0.0019 cm-1 1.000 ag i d9 5s4f -d9 5s9h 4 0.0160 5 0.0003 5 0.0000 5 0.0000 5 59 73 1 0.023 0.023 778.570 sec sqrtdel= 1.0000 1.0000 0.0160 0.0003 0.0000 0.0000 rcn mod 32 ee,eee= -0.01562 -0.03951 slater integrals for ag i d9 5s4f nconf=59 z= 47 ion= 0 exf=0.650 irel= 1 ag i d9 5s8k nconf=76 kut=-1 corrf=0.000 class 0 k rdk( 4d, 4f, 4d, 8k) frac k rek( 4d, 4f, 4d, 8k) frac - ------------------------------------- ----- - ------------------------------------- ----- 4 0.00000009 ryd = 0.0095 cm-1 1.000 5 0.00000000 ryd = 0.0000 cm-1 1.000 ag i d9 5s4f -d9 5s8k 2 0.0000 5 0.0000 5 59 76 3 0.406 0.031 779.031 sec sqrtdel= 1.0000 1.0000 0.0000 0.0000 rcn mod 32 ee,eee= -0.01235 -0.03787 slater integrals for ag i d9 5s4f nconf=59 z= 47 ion= 0 exf=0.650 irel= 1 ag i d9 5s9k nconf=77 kut=-1 corrf=0.000 class 0 k rdk( 4d, 4f, 4d, 9k) frac k rek( 4d, 4f, 4d, 9k) frac - ------------------------------------- ----- - ------------------------------------- ----- 4 0.00000011 ryd = 0.0123 cm-1 1.000 5 0.00000000 ryd = 0.0000 cm-1 1.000 ag i d9 5s4f -d9 5s9k 2 0.0000 5 0.0000 5 59 77 1 0.164 0.031 779.227 sec sqrtdel= 1.0000 1.0000 0.0000 0.0000 rcn mod 32 ee,eee= -0.04058 -0.02029 ee,eee= -0.02815 -0.03437 slater integrals for ag i d9 5s5f nconf=60 z= 47 ion= 0 exf=0.650 irel= 1 ag i d9 5s6f nconf=61 kut=-1 corrf=0.000 class 11 k rdk( 4d, 5f, 4d, 6f) frac k rek( 4d, 5f, 4d, 6f) frac - ------------------------------------- ----- - ------------------------------------- ----- 0 0.02410852 ryd = 2645.6042 cm-1 0.459 1 0.00001572 ryd = 1.7249 cm-1 0.999 2 0.00061080 ryd = 67.0280 cm-1 0.954 3 0.00000874 ryd = 0.9590 cm-1 1.000 4 0.00005025 ryd = 5.5145 cm-1 0.999 5 0.00000592 ryd = 0.6496 cm-1 1.000 - ------------------------------------- ----- - ------------------------------------- ----- 0 0.02410852 ryd = 2645.6042 cm-1 0.459 1 0.00001572 ryd = 1.7249 cm-1 0.999 2 0.00061080 ryd = 67.0281 cm-1 0.954 3 0.00000874 ryd = 0.9590 cm-1 1.000 4 0.00005025 ryd = 5.5145 cm-1 0.999 5 0.00000592 ryd = 0.6496 cm-1 1.000 - ------------------------------------- ----- - ------------------------------------- ----- 0 0.02410852 ryd = 2645.6042 cm-1 0.459 1 0.00001572 ryd = 1.7249 cm-1 0.999 2 0.00061080 ryd = 67.0280 cm-1 0.954 3 0.00000874 ryd = 0.9590 cm-1 1.000 4 0.00005025 ryd = 5.5144 cm-1 0.999 5 0.00000592 ryd = 0.6495 cm-1 1.000 - ------------------------------------- ----- - ------------------------------------- ----- 0 0.02410852 ryd = 2645.6042 cm-1 0.459 1 0.00001572 ryd = 1.7249 cm-1 0.999 2 0.00061080 ryd = 67.0280 cm-1 0.954 3 0.00000874 ryd = 0.9590 cm-1 1.000 4 0.00005025 ryd = 5.5145 cm-1 0.999 5 0.00000592 ryd = 0.6496 cm-1 1.000 9.00000 0.00014 2.00000 1.00000 3.00000 0.00000 -0.03437 0.00000 9.00000 0.00008 2.00000 3.00000 3.00000 0.00000 -0.03437 0.00000 9.00000 0.00005 2.00000 5.00000 3.00000 0.00000 -0.03437 0.00000 ag i d9 5s5f -d9 5s6f 6 0.0000 5 0.0670 5 0.0055 5 0.0017 5 0.0010 5 0.0006 5 60 61 20 1.039 0.195 780.461 sec rcn mod 32 ee,eee= -0.04058 -0.02029 ee,eee= -0.02815 -0.03437 slater integrals for ag i d9 5s5f nconf=60 z= 47 ion= 0 exf=0.650 irel= 1 ag i d9 5s6f nconf=61 kut=-1 corrf=0.000 class 11 k rdk( 5s, 5f, 5s, 6f) frac k rek( 5s, 5f, 5s, 6f) frac - ------------------------------------- ----- - ------------------------------------- ----- 0 0.02409747 ryd = 2644.3910 cm-1 0.459 3 0.00016637 ryd = 18.2574 cm-1 0.999 - ------------------------------------- ----- - ------------------------------------- ----- 0 0.02409746 ryd = 2644.3908 cm-1 0.459 3 0.00016641 ryd = 18.2614 cm-1 0.999 - ------------------------------------- ----- - ------------------------------------- ----- 0 0.02409747 ryd = 2644.3913 cm-1 0.459 3 0.00016634 ryd = 18.2535 cm-1 0.999 - ------------------------------------- ----- - ------------------------------------- ----- 0 0.02409747 ryd = 2644.3910 cm-1 0.459 3 0.00016637 ryd = 18.2575 cm-1 0.999 1.00000 0.00017 0.00000 3.00000 3.00000 0.00000 -0.03437 0.00000 ag i d9 5s5f -d9 5s6f 2 0.0000 5 0.0183 5 60 61 20 0.586 0.047 781.094 sec sqrtdel= 1.0000 1.0000 0.0000 0.0670 0.0055 0.0017 0.0010 0.0006 0.0000 0.0183 rcn mod 32 ee,eee= -0.04058 -0.02029 ee,eee= -0.02066 -0.03062 slater integrals for ag i d9 5s5f nconf=60 z= 47 ion= 0 exf=0.650 irel= 1 ag i d9 5s7f nconf=62 kut=-1 corrf=0.000 class 11 k rdk( 4d, 5f, 4d, 7f) frac k rek( 4d, 5f, 4d, 7f) frac - ------------------------------------- ----- - ------------------------------------- ----- 0 0.01497271 ryd = 1643.0647 cm-1 0.393 1 0.00001356 ryd = 1.4877 cm-1 0.999 2 0.00047002 ryd = 51.5787 cm-1 0.935 3 0.00000754 ryd = 0.8273 cm-1 1.000 4 0.00004148 ryd = 4.5521 cm-1 0.997 5 0.00000511 ryd = 0.5604 cm-1 1.000 - ------------------------------------- ----- - ------------------------------------- ----- 0 0.01497271 ryd = 1643.0647 cm-1 0.393 1 0.00001356 ryd = 1.4878 cm-1 0.999 2 0.00047002 ryd = 51.5788 cm-1 0.935 3 0.00000754 ryd = 0.8274 cm-1 1.000 4 0.00004148 ryd = 4.5521 cm-1 0.997 5 0.00000511 ryd = 0.5604 cm-1 1.000 - ------------------------------------- ----- - ------------------------------------- ----- 0 0.01497271 ryd = 1643.0647 cm-1 0.393 1 0.00001356 ryd = 1.4877 cm-1 0.999 2 0.00047002 ryd = 51.5787 cm-1 0.935 3 0.00000754 ryd = 0.8273 cm-1 1.000 4 0.00004148 ryd = 4.5520 cm-1 0.997 5 0.00000511 ryd = 0.5604 cm-1 1.000 - ------------------------------------- ----- - ------------------------------------- ----- 0 0.01497271 ryd = 1643.0647 cm-1 0.393 1 0.00001356 ryd = 1.4877 cm-1 0.999 2 0.00047002 ryd = 51.5787 cm-1 0.935 3 0.00000754 ryd = 0.8273 cm-1 1.000 4 0.00004148 ryd = 4.5521 cm-1 0.997 5 0.00000511 ryd = 0.5604 cm-1 1.000 9.00000 0.00012 2.00000 1.00000 3.00000 0.00000 -0.03062 0.00000 9.00000 0.00007 2.00000 3.00000 3.00000 0.00000 -0.03062 0.00000 9.00000 0.00005 2.00000 5.00000 3.00000 0.00000 -0.03062 0.00000 ag i d9 5s5f -d9 5s7f 6 0.0000 5 0.0516 5 0.0046 5 0.0015 5 0.0008 5 0.0006 5 60 62 21 0.578 0.102 781.773 sec rcn mod 32 ee,eee= -0.04058 -0.02029 ee,eee= -0.02066 -0.03062 slater integrals for ag i d9 5s5f nconf=60 z= 47 ion= 0 exf=0.650 irel= 1 ag i d9 5s7f nconf=62 kut=-1 corrf=0.000 class 11 k rdk( 5s, 5f, 5s, 7f) frac k rek( 5s, 5f, 5s, 7f) frac - ------------------------------------- ----- - ------------------------------------- ----- 0 0.01496321 ryd = 1642.0222 cm-1 0.393 3 0.00014131 ryd = 15.5073 cm-1 0.999 - ------------------------------------- ----- - ------------------------------------- ----- 0 0.01496320 ryd = 1642.0218 cm-1 0.393 3 0.00014136 ryd = 15.5127 cm-1 0.999 - ------------------------------------- ----- - ------------------------------------- ----- 0 0.01496321 ryd = 1642.0225 cm-1 0.393 3 0.00014127 ryd = 15.5022 cm-1 0.999 - ------------------------------------- ----- - ------------------------------------- ----- 0 0.01496321 ryd = 1642.0222 cm-1 0.393 3 0.00014131 ryd = 15.5074 cm-1 0.999 1.00000 0.00014 0.00000 3.00000 3.00000 0.00000 -0.03062 0.00000 ag i d9 5s5f -d9 5s7f 2 0.0000 5 0.0155 5 60 62 21 1.367 0.063 783.203 sec sqrtdel= 1.0000 1.0000 0.0000 0.0516 0.0046 0.0015 0.0008 0.0006 0.0000 0.0155 rcn mod 32 ee,eee= -0.04058 -0.02029 ee,eee= -0.01580 -0.02819 slater integrals for ag i d9 5s5f nconf=60 z= 47 ion= 0 exf=0.650 irel= 1 ag i d9 5s8f nconf=63 kut=-1 corrf=0.000 class 11 k rdk( 4d, 5f, 4d, 8f) frac k rek( 4d, 5f, 4d, 8f) frac - ------------------------------------- ----- - ------------------------------------- ----- 0 0.01077729 ryd = 1182.6712 cm-1 0.361 1 0.00001172 ryd = 1.2863 cm-1 0.999 2 0.00037811 ryd = 41.4926 cm-1 0.923 3 0.00000652 ryd = 0.7154 cm-1 1.000 4 0.00003484 ryd = 3.8231 cm-1 0.996 5 0.00000442 ryd = 0.4846 cm-1 1.000 - ------------------------------------- ----- - ------------------------------------- ----- 0 0.01077729 ryd = 1182.6712 cm-1 0.361 1 0.00001172 ryd = 1.2863 cm-1 0.999 2 0.00037811 ryd = 41.4927 cm-1 0.923 3 0.00000652 ryd = 0.7154 cm-1 1.000 4 0.00003484 ryd = 3.8232 cm-1 0.996 5 0.00000442 ryd = 0.4846 cm-1 1.000 - ------------------------------------- ----- - ------------------------------------- ----- 0 0.01077729 ryd = 1182.6712 cm-1 0.361 1 0.00001172 ryd = 1.2862 cm-1 0.999 2 0.00037811 ryd = 41.4926 cm-1 0.923 3 0.00000652 ryd = 0.7154 cm-1 1.000 4 0.00003484 ryd = 3.8231 cm-1 0.996 5 0.00000442 ryd = 0.4846 cm-1 1.000 - ------------------------------------- ----- - ------------------------------------- ----- 0 0.01077729 ryd = 1182.6712 cm-1 0.361 1 0.00001172 ryd = 1.2863 cm-1 0.999 2 0.00037811 ryd = 41.4926 cm-1 0.923 3 0.00000652 ryd = 0.7154 cm-1 1.000 4 0.00003484 ryd = 3.8231 cm-1 0.996 5 0.00000442 ryd = 0.4846 cm-1 1.000 9.00000 0.00011 2.00000 1.00000 3.00000 0.00000 -0.02819 0.00000 9.00000 0.00006 2.00000 3.00000 3.00000 0.00000 -0.02819 0.00000 9.00000 0.00004 2.00000 5.00000 3.00000 0.00000 -0.02819 0.00000 ag i d9 5s5f -d9 5s8f 6 0.0000 5 0.0415 5 0.0038 5 0.0013 5 0.0007 5 0.0005 5 60 63 22 0.617 0.188 784.031 sec rcn mod 32 ee,eee= -0.04058 -0.02029 ee,eee= -0.01580 -0.02819 slater integrals for ag i d9 5s5f nconf=60 z= 47 ion= 0 exf=0.650 irel= 1 ag i d9 5s8f nconf=63 kut=-1 corrf=0.000 class 11 k rdk( 5s, 5f, 5s, 8f) frac k rek( 5s, 5f, 5s, 8f) frac - ------------------------------------- ----- - ------------------------------------- ----- 0 0.01076910 ryd = 1181.7721 cm-1 0.360 3 0.00012092 ryd = 13.2694 cm-1 0.999 - ------------------------------------- ----- - ------------------------------------- ----- 0 0.01076910 ryd = 1181.7717 cm-1 0.360 3 0.00012097 ryd = 13.2749 cm-1 0.999 - ------------------------------------- ----- - ------------------------------------- ----- 0 0.01076910 ryd = 1181.7725 cm-1 0.360 3 0.00012087 ryd = 13.2641 cm-1 0.999 - ------------------------------------- ----- - ------------------------------------- ----- 0 0.01076910 ryd = 1181.7721 cm-1 0.360 3 0.00012092 ryd = 13.2695 cm-1 0.999 1.00000 0.00012 0.00000 3.00000 3.00000 0.00000 -0.02819 0.00000 ag i d9 5s5f -d9 5s8f 2 0.0000 5 0.0133 5 60 63 22 0.984 0.047 785.063 sec sqrtdel= 1.0000 1.0000 0.0000 0.0415 0.0038 0.0013 0.0007 0.0005 0.0000 0.0133 rcn mod 32 ee,eee= -0.04058 -0.02029 ee,eee= -0.01247 -0.02653 slater integrals for ag i d9 5s5f nconf=60 z= 47 ion= 0 exf=0.650 irel= 1 ag i d9 5s9f nconf=64 kut=-1 corrf=0.000 class 11 k rdk( 4d, 5f, 4d, 9f) frac k rek( 4d, 5f, 4d, 9f) frac - ------------------------------------- ----- - ------------------------------------- ----- 0 0.00834320 ryd = 915.5599 cm-1 0.341 1 0.00001021 ryd = 1.1206 cm-1 0.999 2 0.00031352 ryd = 34.4044 cm-1 0.915 3 0.00000568 ryd = 0.6234 cm-1 1.000 4 0.00002974 ryd = 3.2634 cm-1 0.995 5 0.00000385 ryd = 0.4223 cm-1 1.000 - ------------------------------------- ----- - ------------------------------------- ----- 0 0.00834320 ryd = 915.5599 cm-1 0.341 1 0.00001021 ryd = 1.1207 cm-1 0.999 2 0.00031352 ryd = 34.4044 cm-1 0.915 3 0.00000568 ryd = 0.6234 cm-1 1.000 4 0.00002974 ryd = 3.2634 cm-1 0.995 5 0.00000385 ryd = 0.4223 cm-1 1.000 - ------------------------------------- ----- - ------------------------------------- ----- 0 0.00834320 ryd = 915.5599 cm-1 0.341 1 0.00001021 ryd = 1.1206 cm-1 0.999 2 0.00031352 ryd = 34.4043 cm-1 0.915 3 0.00000568 ryd = 0.6233 cm-1 1.000 4 0.00002974 ryd = 3.2634 cm-1 0.995 5 0.00000385 ryd = 0.4223 cm-1 1.000 - ------------------------------------- ----- - ------------------------------------- ----- 0 0.00834320 ryd = 915.5599 cm-1 0.341 1 0.00001021 ryd = 1.1206 cm-1 0.999 2 0.00031352 ryd = 34.4044 cm-1 0.915 3 0.00000568 ryd = 0.6234 cm-1 1.000 4 0.00002974 ryd = 3.2634 cm-1 0.995 5 0.00000385 ryd = 0.4223 cm-1 1.000 9.00000 0.00009 2.00000 1.00000 3.00000 0.00000 -0.02653 0.00000 9.00000 0.00005 2.00000 3.00000 3.00000 0.00000 -0.02653 0.00000 9.00000 0.00003 2.00000 5.00000 3.00000 0.00000 -0.02653 0.00000 ag i d9 5s5f -d9 5s9f 6 0.0000 5 0.0344 5 0.0033 5 0.0011 5 0.0006 5 0.0004 5 60 64 23 0.617 0.141 785.820 sec rcn mod 32 ee,eee= -0.04058 -0.02029 ee,eee= -0.01247 -0.02653 slater integrals for ag i d9 5s5f nconf=60 z= 47 ion= 0 exf=0.650 irel= 1 ag i d9 5s9f nconf=64 kut=-1 corrf=0.000 class 11 k rdk( 5s, 5f, 5s, 9f) frac k rek( 5s, 5f, 5s, 9f) frac - ------------------------------------- ----- - ------------------------------------- ----- 0 0.00833607 ryd = 914.7778 cm-1 0.341 3 0.00010457 ryd = 11.4754 cm-1 0.999 - ------------------------------------- ----- - ------------------------------------- ----- 0 0.00833607 ryd = 914.7775 cm-1 0.341 3 0.00010462 ryd = 11.4807 cm-1 0.999 - ------------------------------------- ----- - ------------------------------------- ----- 0 0.00833607 ryd = 914.7782 cm-1 0.341 3 0.00010453 ryd = 11.4704 cm-1 0.999 - ------------------------------------- ----- - ------------------------------------- ----- 0 0.00833607 ryd = 914.7778 cm-1 0.341 3 0.00010457 ryd = 11.4756 cm-1 0.999 1.00000 0.00010 0.00000 3.00000 3.00000 0.00000 -0.02653 0.00000 ag i d9 5s5f -d9 5s9f 2 0.0000 5 0.0115 5 60 64 23 0.813 0.102 786.734 sec sqrtdel= 1.0000 1.0000 0.0000 0.0344 0.0033 0.0011 0.0006 0.0004 0.0000 0.0115 rcn mod 32 ee,eee= -2.02283 -1.01142 ee,eee= -1.16254 -1.59269 slater integrals for ag i d9 5s5f nconf=60 z= 47 ion= 0 exf=0.650 irel= 1 ag i d8 5s2 4f nconf=65 kut=-1 corrf=0.000 class 0 k rdk( 4d, 4d, 4d, 5s) frac k rek( 4d, 4d, 4d, 5s) frac - ------------------------------------- ----- - ------------------------------------- ----- 2 0.00000000 ryd = 0.0000 cm-1 0.000 2 0.00000000 ryd = 0.0000 cm-1 0.000 ag i d9 5s5f -d8 5s2 4f 1 0.0000 5 60 65 24 1.211 0.078 788.023 sec rcn mod 32 ee,eee= -0.04058 -0.02029 ee,eee= -0.06347 -0.05203 slater integrals for ag i d9 5s5f nconf=60 z= 47 ion= 0 exf=0.650 irel= 1 ag i d8 5s2 4f nconf=65 kut=-1 corrf=0.000 class 0 k rdk( 4d, 5f, 5s, 4f) frac k rek( 4d, 5f, 5s, 4f) frac - ------------------------------------- ----- - ------------------------------------- ----- 2 -0.00125175 ryd = -137.3638 cm-1 -0.844 3 -0.00003778 ryd = -4.1460 cm-1 -0.996 ag i d9 5s5f -d8 5s2 4f 2 -0.1374 5 -0.0041 5 60 65 24 0.656 0.023 788.703 sec sqrtdel= 1.0000 1.0000 0.0000 -0.1374 -0.0041 rcn mod 32 ee,eee= -0.04058 -0.02029 ee,eee= -0.02778 -0.03418 slater integrals for ag i d9 5s5f nconf=60 z= 47 ion= 0 exf=0.650 irel= 1 ag i d10 6h nconf=66 kut=-1 corrf=0.000 class 0 k rdk( 5s, 5f, 4d, 6h) frac k rek( 5s, 5f, 4d, 6h) frac - ------------------------------------- ----- - ------------------------------------- ----- 2 0.00006639 ryd = 7.2860 cm-1 0.290 5 -0.00000014 ryd = -0.0152 cm-1 -1.000 ag i d9 5s5f -d10 6h 2 0.0073 5 0.0000 5 60 66 25 0.945 0.031 789.711 sec sqrtdel= 1.0000 1.0000 0.0073 0.0000 rcn mod 32 ee,eee= -0.02041 -0.03050 slater integrals for ag i d9 5s5f nconf=60 z= 47 ion= 0 exf=0.650 irel= 1 ag i d10 7h nconf=67 kut=-1 corrf=0.000 class 0 k rdk( 5s, 5f, 4d, 7h) frac k rek( 5s, 5f, 4d, 7h) frac - ------------------------------------- ----- - ------------------------------------- ----- 2 -0.00000912 ryd = -1.0005 cm-1 -0.051 5 -0.00000016 ryd = -0.0178 cm-1 -1.000 ag i d9 5s5f -d10 7h 2 -0.0010 5 0.0000 5 60 67 1 0.031 0.031 789.773 sec sqrtdel= 1.0000 1.0000 -0.0010 0.0000 rcn mod 32 ee,eee= -0.01563 -0.02811 slater integrals for ag i d9 5s5f nconf=60 z= 47 ion= 0 exf=0.650 irel= 1 ag i d10 8h nconf=68 kut=-1 corrf=0.000 class 0 k rdk( 5s, 5f, 4d, 8h) frac k rek( 5s, 5f, 4d, 8h) frac - ------------------------------------- ----- - ------------------------------------- ----- 2 -0.00003632 ryd = -3.9857 cm-1 -0.241 5 -0.00000016 ryd = -0.0178 cm-1 -1.000 ag i d9 5s5f -d10 8h 2 -0.0040 5 0.0000 5 60 68 1 0.031 0.008 789.813 sec sqrtdel= 1.0000 1.0000 -0.0040 0.0000 rcn mod 32 ee,eee= -0.01234 -0.02646 slater integrals for ag i d9 5s5f nconf=60 z= 47 ion= 0 exf=0.650 irel= 1 ag i d10 9h nconf=69 kut=-1 corrf=0.000 class 0 k rdk( 5s, 5f, 4d, 9h) frac k rek( 5s, 5f, 4d, 9h) frac - ------------------------------------- ----- - ------------------------------------- ----- 2 -0.00004541 ryd = -4.9833 cm-1 -0.351 5 -0.00000015 ryd = -0.0168 cm-1 -1.000 ag i d9 5s5f -d10 9h 2 -0.0050 5 0.0000 5 60 69 1 0.031 0.023 789.875 sec sqrtdel= 1.0000 1.0000 -0.0050 0.0000 rcn mod 32 ee,eee= -0.04058 -0.02029 ee,eee= -0.02778 -0.03418 slater integrals for ag i d9 5s5f nconf=60 z= 47 ion= 0 exf=0.650 irel= 1 ag i d9 5s6h nconf=70 kut=-1 corrf=0.000 class 0 k rdk( 4d, 5f, 4d, 6h) frac k rek( 4d, 5f, 4d, 6h) frac - ------------------------------------- ----- - ------------------------------------- ----- 2 -0.00004549 ryd = -4.9921 cm-1 -0.302 3 0.00000002 ryd = 0.0024 cm-1 1.000 4 0.00000122 ryd = 0.1338 cm-1 0.571 5 0.00000001 ryd = 0.0016 cm-1 1.000 ag i d9 5s5f -d9 5s6h 4 -0.0050 5 0.0001 5 0.0000 5 0.0000 5 60 70 29 1.320 0.031 791.227 sec sqrtdel= 1.0000 1.0000 -0.0050 0.0001 0.0000 0.0000 rcn mod 32 ee,eee= -0.02041 -0.03050 slater integrals for ag i d9 5s5f nconf=60 z= 47 ion= 0 exf=0.650 irel= 1 ag i d9 5s7h nconf=71 kut=-1 corrf=0.000 class 0 k rdk( 4d, 5f, 4d, 7h) frac k rek( 4d, 5f, 4d, 7h) frac - ------------------------------------- ----- - ------------------------------------- ----- 2 0.00000628 ryd = 0.6895 cm-1 0.053 3 0.00000003 ryd = 0.0028 cm-1 1.000 4 0.00000158 ryd = 0.1734 cm-1 0.717 5 0.00000002 ryd = 0.0019 cm-1 1.000 ag i d9 5s5f -d9 5s7h 4 0.0007 5 0.0002 5 0.0000 5 0.0000 5 60 71 1 0.031 0.031 791.297 sec sqrtdel= 1.0000 1.0000 0.0007 0.0002 0.0000 0.0000 rcn mod 32 ee,eee= -0.01563 -0.02811 slater integrals for ag i d9 5s5f nconf=60 z= 47 ion= 0 exf=0.650 irel= 1 ag i d9 5s8h nconf=72 kut=-1 corrf=0.000 class 0 k rdk( 4d, 5f, 4d, 8h) frac k rek( 4d, 5f, 4d, 8h) frac - ------------------------------------- ----- - ------------------------------------- ----- 2 0.00002493 ryd = 2.7363 cm-1 0.251 3 0.00000003 ryd = 0.0028 cm-1 1.000 4 0.00000162 ryd = 0.1779 cm-1 0.785 5 0.00000002 ryd = 0.0019 cm-1 1.000 ag i d9 5s5f -d9 5s8h 4 0.0027 5 0.0002 5 0.0000 5 0.0000 5 60 72 1 0.023 0.047 791.367 sec sqrtdel= 1.0000 1.0000 0.0027 0.0002 0.0000 0.0000 rcn mod 32 ee,eee= -0.01235 -0.02646 slater integrals for ag i d9 5s5f nconf=60 z= 47 ion= 0 exf=0.650 irel= 1 ag i d9 5s9h nconf=73 kut=-1 corrf=0.000 class 0 k rdk( 4d, 5f, 4d, 9h) frac k rek( 4d, 5f, 4d, 9h) frac - ------------------------------------- ----- - ------------------------------------- ----- 2 0.00003117 ryd = 3.4203 cm-1 0.366 3 0.00000002 ryd = 0.0027 cm-1 1.000 4 0.00000155 ryd = 0.1697 cm-1 0.822 5 0.00000002 ryd = 0.0018 cm-1 1.000 ag i d9 5s5f -d9 5s9h 4 0.0034 5 0.0002 5 0.0000 5 0.0000 5 60 73 1 0.039 0.289 791.695 sec sqrtdel= 1.0000 1.0000 0.0034 0.0002 0.0000 0.0000 rcn mod 32 ee,eee= -0.01562 -0.02810 slater integrals for ag i d9 5s5f nconf=60 z= 47 ion= 0 exf=0.650 irel= 1 ag i d9 5s8k nconf=76 kut=-1 corrf=0.000 class 0 k rdk( 4d, 5f, 4d, 8k) frac k rek( 4d, 5f, 4d, 8k) frac - ------------------------------------- ----- - ------------------------------------- ----- 4 -0.00000006 ryd = -0.0064 cm-1 -0.622 5 0.00000000 ryd = 0.0000 cm-1 1.000 ag i d9 5s5f -d9 5s8k 2 0.0000 5 0.0000 5 60 76 3 0.094 0.008 791.805 sec sqrtdel= 1.0000 1.0000 0.0000 0.0000 rcn mod 32 ee,eee= -0.01235 -0.02647 slater integrals for ag i d9 5s5f nconf=60 z= 47 ion= 0 exf=0.650 irel= 1 ag i d9 5s9k nconf=77 kut=-1 corrf=0.000 class 0 k rdk( 4d, 5f, 4d, 9k) frac k rek( 4d, 5f, 4d, 9k) frac - ------------------------------------- ----- - ------------------------------------- ----- 4 -0.00000006 ryd = -0.0069 cm-1 -0.566 5 0.00000000 ryd = 0.0000 cm-1 1.000 ag i d9 5s5f -d9 5s9k 2 0.0000 5 0.0000 5 60 77 1 0.031 0.023 791.867 sec sqrtdel= 1.0000 1.0000 0.0000 0.0000 rcn mod 32 ee,eee= -0.02815 -0.01408 ee,eee= -0.02066 -0.02441 slater integrals for ag i d9 5s6f nconf=61 z= 47 ion= 0 exf=0.650 irel= 1 ag i d9 5s7f nconf=62 kut=-1 corrf=0.000 class 11 k rdk( 4d, 6f, 4d, 7f) frac k rek( 4d, 6f, 4d, 7f) frac - ------------------------------------- ----- - ------------------------------------- ----- 0 0.01857240 ryd = 2038.0855 cm-1 0.480 1 0.00001189 ryd = 1.3050 cm-1 0.998 2 0.00039034 ryd = 42.8350 cm-1 0.976 3 0.00000662 ryd = 0.7260 cm-1 1.000 4 0.00003441 ryd = 3.7763 cm-1 1.000 5 0.00000448 ryd = 0.4919 cm-1 1.000 - ------------------------------------- ----- - ------------------------------------- ----- 0 0.01857240 ryd = 2038.0855 cm-1 0.480 1 0.00001189 ryd = 1.3051 cm-1 0.998 2 0.00039034 ryd = 42.8350 cm-1 0.976 3 0.00000662 ryd = 0.7260 cm-1 1.000 4 0.00003441 ryd = 3.7763 cm-1 1.000 5 0.00000448 ryd = 0.4919 cm-1 1.000 - ------------------------------------- ----- - ------------------------------------- ----- 0 0.01857240 ryd = 2038.0855 cm-1 0.480 1 0.00001189 ryd = 1.3050 cm-1 0.998 2 0.00039034 ryd = 42.8349 cm-1 0.976 3 0.00000662 ryd = 0.7260 cm-1 1.000 4 0.00003441 ryd = 3.7763 cm-1 1.000 5 0.00000448 ryd = 0.4919 cm-1 1.000 - ------------------------------------- ----- - ------------------------------------- ----- 0 0.01857240 ryd = 2038.0855 cm-1 0.480 1 0.00001189 ryd = 1.3050 cm-1 0.998 2 0.00039034 ryd = 42.8350 cm-1 0.976 3 0.00000662 ryd = 0.7260 cm-1 1.000 4 0.00003441 ryd = 3.7763 cm-1 1.000 5 0.00000448 ryd = 0.4919 cm-1 1.000 9.00000 0.00011 2.00000 1.00000 3.00000 0.00000 -0.02441 0.00000 9.00000 0.00006 2.00000 3.00000 3.00000 0.00000 -0.02441 0.00000 9.00000 0.00004 2.00000 5.00000 3.00000 0.00000 -0.02441 0.00000 ag i d9 5s6f -d9 5s7f 6 0.0000 5 0.0428 5 0.0038 5 0.0013 5 0.0007 5 0.0005 5 61 62 21 0.602 0.117 792.594 sec rcn mod 32 ee,eee= -0.02815 -0.01408 ee,eee= -0.02066 -0.02441 slater integrals for ag i d9 5s6f nconf=61 z= 47 ion= 0 exf=0.650 irel= 1 ag i d9 5s7f nconf=62 kut=-1 corrf=0.000 class 11 k rdk( 5s, 6f, 5s, 7f) frac k rek( 5s, 6f, 5s, 7f) frac - ------------------------------------- ----- - ------------------------------------- ----- 0 0.01856412 ryd = 2037.1762 cm-1 0.480 3 0.00012096 ryd = 13.2743 cm-1 0.999 - ------------------------------------- ----- - ------------------------------------- ----- 0 0.01856412 ryd = 2037.1761 cm-1 0.480 3 0.00012098 ryd = 13.2760 cm-1 0.999 - ------------------------------------- ----- - ------------------------------------- ----- 0 0.01856412 ryd = 2037.1764 cm-1 0.480 3 0.00012095 ryd = 13.2727 cm-1 0.999 - ------------------------------------- ----- - ------------------------------------- ----- 0 0.01856412 ryd = 2037.1762 cm-1 0.480 3 0.00012096 ryd = 13.2744 cm-1 0.999 1.00000 0.00012 0.00000 3.00000 3.00000 0.00000 -0.02441 0.00000 ag i d9 5s6f -d9 5s7f 2 0.0000 5 0.0133 5 61 62 21 0.688 0.063 793.344 sec sqrtdel= 1.0000 1.0000 0.0000 0.0428 0.0038 0.0013 0.0007 0.0005 0.0000 0.0133 rcn mod 32 ee,eee= -0.02815 -0.01408 ee,eee= -0.01580 -0.02198 slater integrals for ag i d9 5s6f nconf=61 z= 47 ion= 0 exf=0.650 irel= 1 ag i d9 5s8f nconf=63 kut=-1 corrf=0.000 class 11 k rdk( 4d, 6f, 4d, 8f) frac k rek( 4d, 6f, 4d, 8f) frac - ------------------------------------- ----- - ------------------------------------- ----- 0 0.01214938 ryd = 1333.2407 cm-1 0.420 1 0.00001028 ryd = 1.1284 cm-1 0.998 2 0.00031456 ryd = 34.5194 cm-1 0.966 3 0.00000572 ryd = 0.6278 cm-1 1.000 4 0.00002898 ryd = 3.1802 cm-1 0.999 5 0.00000388 ryd = 0.4254 cm-1 1.000 - ------------------------------------- ----- - ------------------------------------- ----- 0 0.01214938 ryd = 1333.2407 cm-1 0.420 1 0.00001028 ryd = 1.1284 cm-1 0.998 2 0.00031456 ryd = 34.5194 cm-1 0.966 3 0.00000572 ryd = 0.6279 cm-1 1.000 4 0.00002898 ryd = 3.1802 cm-1 0.999 5 0.00000388 ryd = 0.4254 cm-1 1.000 - ------------------------------------- ----- - ------------------------------------- ----- 0 0.01214938 ryd = 1333.2407 cm-1 0.420 1 0.00001028 ryd = 1.1283 cm-1 0.998 2 0.00031456 ryd = 34.5194 cm-1 0.966 3 0.00000572 ryd = 0.6278 cm-1 1.000 4 0.00002898 ryd = 3.1802 cm-1 0.999 5 0.00000388 ryd = 0.4254 cm-1 1.000 - ------------------------------------- ----- - ------------------------------------- ----- 0 0.01214938 ryd = 1333.2407 cm-1 0.420 1 0.00001028 ryd = 1.1284 cm-1 0.998 2 0.00031456 ryd = 34.5194 cm-1 0.966 3 0.00000572 ryd = 0.6278 cm-1 1.000 4 0.00002898 ryd = 3.1802 cm-1 0.999 5 0.00000388 ryd = 0.4254 cm-1 1.000 9.00000 0.00009 2.00000 1.00000 3.00000 0.00000 -0.02198 0.00000 9.00000 0.00005 2.00000 3.00000 3.00000 0.00000 -0.02198 0.00000 9.00000 0.00003 2.00000 5.00000 3.00000 0.00000 -0.02198 0.00000 ag i d9 5s6f -d9 5s8f 6 0.0000 5 0.0345 5 0.0032 5 0.0011 5 0.0006 5 0.0004 5 61 63 22 1.164 0.195 794.711 sec rcn mod 32 ee,eee= -0.02815 -0.01408 ee,eee= -0.01580 -0.02198 slater integrals for ag i d9 5s6f nconf=61 z= 47 ion= 0 exf=0.650 irel= 1 ag i d9 5s8f nconf=63 kut=-1 corrf=0.000 class 11 k rdk( 5s, 6f, 5s, 8f) frac k rek( 5s, 6f, 5s, 8f) frac - ------------------------------------- ----- - ------------------------------------- ----- 0 0.01214224 ryd = 1332.4564 cm-1 0.420 3 0.00010352 ryd = 11.3605 cm-1 0.999 - ------------------------------------- ----- - ------------------------------------- ----- 0 0.01214223 ryd = 1332.4562 cm-1 0.420 3 0.00010355 ryd = 11.3628 cm-1 0.999 - ------------------------------------- ----- - ------------------------------------- ----- 0 0.01214224 ryd = 1332.4565 cm-1 0.420 3 0.00010350 ryd = 11.3584 cm-1 0.999 - ------------------------------------- ----- - ------------------------------------- ----- 0 0.01214224 ryd = 1332.4564 cm-1 0.420 3 0.00010353 ryd = 11.3606 cm-1 0.999 1.00000 0.00010 0.00000 3.00000 3.00000 0.00000 -0.02198 0.00000 ag i d9 5s6f -d9 5s8f 2 0.0000 5 0.0114 5 61 63 22 0.594 0.047 795.352 sec sqrtdel= 1.0000 1.0000 0.0000 0.0345 0.0032 0.0011 0.0006 0.0004 0.0000 0.0114 rcn mod 32 ee,eee= -0.02815 -0.01408 ee,eee= -0.01247 -0.02031 slater integrals for ag i d9 5s6f nconf=61 z= 47 ion= 0 exf=0.650 irel= 1 ag i d9 5s9f nconf=64 kut=-1 corrf=0.000 class 11 k rdk( 4d, 6f, 4d, 9f) frac k rek( 4d, 6f, 4d, 9f) frac - ------------------------------------- ----- - ------------------------------------- ----- 0 0.00903380 ryd = 991.3449 cm-1 0.389 1 0.00000896 ryd = 0.9831 cm-1 0.998 2 0.00026122 ryd = 28.6652 cm-1 0.959 3 0.00000499 ryd = 0.5471 cm-1 1.000 4 0.00002478 ryd = 2.7193 cm-1 0.999 5 0.00000338 ryd = 0.3707 cm-1 1.000 - ------------------------------------- ----- - ------------------------------------- ----- 0 0.00903380 ryd = 991.3449 cm-1 0.389 1 0.00000896 ryd = 0.9831 cm-1 0.998 2 0.00026122 ryd = 28.6653 cm-1 0.959 3 0.00000499 ryd = 0.5471 cm-1 1.000 4 0.00002478 ryd = 2.7194 cm-1 0.999 5 0.00000338 ryd = 0.3707 cm-1 1.000 - ------------------------------------- ----- - ------------------------------------- ----- 0 0.00903380 ryd = 991.3449 cm-1 0.389 1 0.00000896 ryd = 0.9831 cm-1 0.998 2 0.00026122 ryd = 28.6652 cm-1 0.959 3 0.00000499 ryd = 0.5471 cm-1 1.000 4 0.00002478 ryd = 2.7193 cm-1 0.999 5 0.00000338 ryd = 0.3707 cm-1 1.000 - ------------------------------------- ----- - ------------------------------------- ----- 0 0.00903380 ryd = 991.3449 cm-1 0.389 1 0.00000896 ryd = 0.9831 cm-1 0.998 2 0.00026122 ryd = 28.6652 cm-1 0.959 3 0.00000499 ryd = 0.5471 cm-1 1.000 4 0.00002478 ryd = 2.7193 cm-1 0.999 5 0.00000338 ryd = 0.3707 cm-1 1.000 9.00000 0.00008 2.00000 1.00000 3.00000 0.00000 -0.02031 0.00000 9.00000 0.00004 2.00000 3.00000 3.00000 0.00000 -0.02031 0.00000 9.00000 0.00003 2.00000 5.00000 3.00000 0.00000 -0.02031 0.00000 ag i d9 5s6f -d9 5s9f 6 0.0000 5 0.0287 5 0.0027 5 0.0010 5 0.0005 5 0.0004 5 61 64 23 0.742 0.367 796.531 sec rcn mod 32 ee,eee= -0.02815 -0.01408 ee,eee= -0.01247 -0.02031 slater integrals for ag i d9 5s6f nconf=61 z= 47 ion= 0 exf=0.650 irel= 1 ag i d9 5s9f nconf=64 kut=-1 corrf=0.000 class 11 k rdk( 5s, 6f, 5s, 9f) frac k rek( 5s, 6f, 5s, 9f) frac - ------------------------------------- ----- - ------------------------------------- ----- 0 0.00902758 ryd = 990.6627 cm-1 0.389 3 0.00008954 ryd = 9.8258 cm-1 0.999 - ------------------------------------- ----- - ------------------------------------- ----- 0 0.00902758 ryd = 990.6625 cm-1 0.389 3 0.00008956 ryd = 9.8281 cm-1 0.999 - ------------------------------------- ----- - ------------------------------------- ----- 0 0.00902758 ryd = 990.6629 cm-1 0.389 3 0.00008952 ryd = 9.8235 cm-1 0.999 - ------------------------------------- ----- - ------------------------------------- ----- 0 0.00902758 ryd = 990.6627 cm-1 0.389 3 0.00008954 ryd = 9.8258 cm-1 0.999 1.00000 0.00009 0.00000 3.00000 3.00000 0.00000 -0.02031 0.00000 ag i d9 5s6f -d9 5s9f 2 0.0000 5 0.0098 5 61 64 23 0.633 0.047 797.211 sec sqrtdel= 1.0000 1.0000 0.0000 0.0287 0.0027 0.0010 0.0005 0.0004 0.0000 0.0098 rcn mod 32 ee,eee= -2.04733 -1.02366 ee,eee= -1.16254 -1.60494 slater integrals for ag i d9 5s6f nconf=61 z= 47 ion= 0 exf=0.650 irel= 1 ag i d8 5s2 4f nconf=65 kut=-1 corrf=0.000 class 0 k rdk( 4d, 4d, 4d, 5s) frac k rek( 4d, 4d, 4d, 5s) frac - ------------------------------------- ----- - ------------------------------------- ----- 2 0.00000000 ryd = 0.0000 cm-1 0.000 2 0.00000000 ryd = 0.0000 cm-1 0.000 ag i d9 5s6f -d8 5s2 4f 1 0.0000 5 61 65 24 0.680 0.039 797.945 sec rcn mod 32 ee,eee= -0.02815 -0.01408 ee,eee= -0.06347 -0.04581 slater integrals for ag i d9 5s6f nconf=61 z= 47 ion= 0 exf=0.650 irel= 1 ag i d8 5s2 4f nconf=65 kut=-1 corrf=0.000 class 0 k rdk( 4d, 6f, 5s, 4f) frac k rek( 4d, 6f, 5s, 4f) frac - ------------------------------------- ----- - ------------------------------------- ----- 2 -0.00088865 ryd = -97.5179 cm-1 -0.803 3 -0.00003270 ryd = -3.5879 cm-1 -0.996 ag i d9 5s6f -d8 5s2 4f 2 -0.0975 5 -0.0036 5 61 65 24 1.320 0.078 799.344 sec sqrtdel= 1.0000 1.0000 0.0000 -0.0975 -0.0036 rcn mod 32 ee,eee= -0.02815 -0.01408 ee,eee= -0.02778 -0.02797 slater integrals for ag i d9 5s6f nconf=61 z= 47 ion= 0 exf=0.650 irel= 1 ag i d10 6h nconf=66 kut=-1 corrf=0.000 class 0 k rdk( 5s, 6f, 4d, 6h) frac k rek( 5s, 6f, 4d, 6h) frac - ------------------------------------- ----- - ------------------------------------- ----- 2 0.00000019 ryd = 0.0203 cm-1 0.001 5 -0.00000012 ryd = -0.0130 cm-1 -1.000 ag i d9 5s6f -d10 6h 2 0.0000 5 0.0000 5 61 66 25 0.781 0.031 800.203 sec sqrtdel= 1.0000 1.0000 0.0000 0.0000 rcn mod 32 ee,eee= -0.02041 -0.02428 slater integrals for ag i d9 5s6f nconf=61 z= 47 ion= 0 exf=0.650 irel= 1 ag i d10 7h nconf=67 kut=-1 corrf=0.000 class 0 k rdk( 5s, 6f, 4d, 7h) frac k rek( 5s, 6f, 4d, 7h) frac - ------------------------------------- ----- - ------------------------------------- ----- 2 0.00002996 ryd = 3.2882 cm-1 0.217 5 -0.00000014 ryd = -0.0152 cm-1 -1.000 ag i d9 5s6f -d10 7h 2 0.0033 5 0.0000 5 61 67 1 0.023 0.031 800.266 sec sqrtdel= 1.0000 1.0000 0.0033 0.0000 rcn mod 32 ee,eee= -0.01563 -0.02189 slater integrals for ag i d9 5s6f nconf=61 z= 47 ion= 0 exf=0.650 irel= 1 ag i d10 8h nconf=68 kut=-1 corrf=0.000 class 0 k rdk( 5s, 6f, 4d, 8h) frac k rek( 5s, 6f, 4d, 8h) frac - ------------------------------------- ----- - ------------------------------------- ----- 2 0.00001278 ryd = 1.4029 cm-1 0.109 5 -0.00000014 ryd = -0.0152 cm-1 -1.000 ag i d9 5s6f -d10 8h 2 0.0014 5 0.0000 5 61 68 1 0.016 0.039 800.320 sec sqrtdel= 1.0000 1.0000 0.0014 0.0000 rcn mod 32 ee,eee= -0.01234 -0.02025 slater integrals for ag i d9 5s6f nconf=61 z= 47 ion= 0 exf=0.650 irel= 1 ag i d10 9h nconf=69 kut=-1 corrf=0.000 class 0 k rdk( 5s, 6f, 4d, 9h) frac k rek( 5s, 6f, 4d, 9h) frac - ------------------------------------- ----- - ------------------------------------- ----- 2 0.00000175 ryd = 0.1924 cm-1 0.017 5 -0.00000013 ryd = -0.0143 cm-1 -1.000 ag i d9 5s6f -d10 9h 2 0.0002 5 0.0000 5 61 69 1 0.031 0.016 800.383 sec sqrtdel= 1.0000 1.0000 0.0002 0.0000 rcn mod 32 ee,eee= -0.02815 -0.01408 ee,eee= -0.02778 -0.02797 slater integrals for ag i d9 5s6f nconf=61 z= 47 ion= 0 exf=0.650 irel= 1 ag i d9 5s6h nconf=70 kut=-1 corrf=0.000 class 0 k rdk( 4d, 6f, 4d, 6h) frac k rek( 4d, 6f, 4d, 6h) frac - ------------------------------------- ----- - ------------------------------------- ----- 2 -0.00000011 ryd = -0.0117 cm-1 -0.001 3 0.00000002 ryd = 0.0020 cm-1 1.000 4 0.00000085 ryd = 0.0929 cm-1 0.554 5 0.00000001 ryd = 0.0014 cm-1 1.000 ag i d9 5s6f -d9 5s6h 4 0.0000 5 0.0001 5 0.0000 5 0.0000 5 61 70 29 1.266 0.023 801.680 sec sqrtdel= 1.0000 1.0000 0.0000 0.0001 0.0000 0.0000 rcn mod 32 ee,eee= -0.02041 -0.02428 slater integrals for ag i d9 5s6f nconf=61 z= 47 ion= 0 exf=0.650 irel= 1 ag i d9 5s7h nconf=71 kut=-1 corrf=0.000 class 0 k rdk( 4d, 6f, 4d, 7h) frac k rek( 4d, 6f, 4d, 7h) frac - ------------------------------------- ----- - ------------------------------------- ----- 2 -0.00002051 ryd = -2.2512 cm-1 -0.226 3 0.00000002 ryd = 0.0024 cm-1 1.000 4 0.00000099 ryd = 0.1089 cm-1 0.615 5 0.00000001 ryd = 0.0016 cm-1 1.000 ag i d9 5s6f -d9 5s7h 4 -0.0023 5 0.0001 5 0.0000 5 0.0000 5 61 71 1 0.039 0.047 801.781 sec sqrtdel= 1.0000 1.0000 -0.0023 0.0001 0.0000 0.0000 rcn mod 32 ee,eee= -0.01563 -0.02189 slater integrals for ag i d9 5s6f nconf=61 z= 47 ion= 0 exf=0.650 irel= 1 ag i d9 5s8h nconf=72 kut=-1 corrf=0.000 class 0 k rdk( 4d, 6f, 4d, 8h) frac k rek( 4d, 6f, 4d, 8h) frac - ------------------------------------- ----- - ------------------------------------- ----- 2 -0.00000873 ryd = -0.9584 cm-1 -0.113 3 0.00000002 ryd = 0.0024 cm-1 1.000 4 0.00000102 ryd = 0.1116 cm-1 0.667 5 0.00000001 ryd = 0.0016 cm-1 1.000 ag i d9 5s6f -d9 5s8h 4 -0.0010 5 0.0001 5 0.0000 5 0.0000 5 61 72 1 0.047 0.023 801.891 sec sqrtdel= 1.0000 1.0000 -0.0010 0.0001 0.0000 0.0000 rcn mod 32 ee,eee= -0.01235 -0.02025 slater integrals for ag i d9 5s6f nconf=61 z= 47 ion= 0 exf=0.650 irel= 1 ag i d9 5s9h nconf=73 kut=-1 corrf=0.000 class 0 k rdk( 4d, 6f, 4d, 9h) frac k rek( 4d, 6f, 4d, 9h) frac - ------------------------------------- ----- - ------------------------------------- ----- 2 -0.00000117 ryd = -0.1285 cm-1 -0.018 3 0.00000002 ryd = 0.0023 cm-1 1.000 4 0.00000098 ryd = 0.1073 cm-1 0.703 5 0.00000001 ryd = 0.0015 cm-1 1.000 ag i d9 5s6f -d9 5s9h 4 -0.0001 5 0.0001 5 0.0000 5 0.0000 5 61 73 1 0.016 0.039 801.961 sec sqrtdel= 1.0000 1.0000 -0.0001 0.0001 0.0000 0.0000 rcn mod 32 ee,eee= -0.01562 -0.02189 slater integrals for ag i d9 5s6f nconf=61 z= 47 ion= 0 exf=0.650 irel= 1 ag i d9 5s8k nconf=76 kut=-1 corrf=0.000 class 0 k rdk( 4d, 6f, 4d, 8k) frac k rek( 4d, 6f, 4d, 8k) frac - ------------------------------------- ----- - ------------------------------------- ----- 4 0.00000001 ryd = 0.0012 cm-1 0.152 5 0.00000000 ryd = 0.0000 cm-1 1.000 ag i d9 5s6f -d9 5s8k 2 0.0000 5 0.0000 5 61 76 3 0.070 0.047 802.094 sec sqrtdel= 1.0000 1.0000 0.0000 0.0000 rcn mod 32 ee,eee= -0.01235 -0.02025 slater integrals for ag i d9 5s6f nconf=61 z= 47 ion= 0 exf=0.650 irel= 1 ag i d9 5s9k nconf=77 kut=-1 corrf=0.000 class 0 k rdk( 4d, 6f, 4d, 9k) frac k rek( 4d, 6f, 4d, 9k) frac - ------------------------------------- ----- - ------------------------------------- ----- 4 0.00000000 ryd = 0.0000 cm-1 0.002 5 0.00000000 ryd = 0.0000 cm-1 1.000 ag i d9 5s6f -d9 5s9k 2 0.0000 5 0.0000 5 61 77 1 0.031 0.016 802.172 sec sqrtdel= 1.0000 1.0000 0.0000 0.0000 rcn mod 32 ee,eee= -0.02066 -0.01033 ee,eee= -0.01580 -0.01823 slater integrals for ag i d9 5s7f nconf=62 z= 47 ion= 0 exf=0.650 irel= 1 ag i d9 5s8f nconf=63 kut=-1 corrf=0.000 class 11 k rdk( 4d, 7f, 4d, 8f) frac k rek( 4d, 7f, 4d, 8f) frac - ------------------------------------- ----- - ------------------------------------- ----- 0 0.01449819 ryd = 1590.9920 cm-1 0.491 1 0.00000887 ryd = 0.9733 cm-1 0.998 2 0.00026153 ryd = 28.6996 cm-1 0.986 3 0.00000494 ryd = 0.5417 cm-1 1.000 4 0.00002417 ryd = 2.6522 cm-1 1.000 5 0.00000334 ryd = 0.3671 cm-1 1.000 - ------------------------------------- ----- - ------------------------------------- ----- 0 0.01449819 ryd = 1590.9920 cm-1 0.491 1 0.00000887 ryd = 0.9733 cm-1 0.998 2 0.00026153 ryd = 28.6996 cm-1 0.986 3 0.00000494 ryd = 0.5417 cm-1 1.000 4 0.00002417 ryd = 2.6522 cm-1 1.000 5 0.00000334 ryd = 0.3671 cm-1 1.000 - ------------------------------------- ----- - ------------------------------------- ----- 0 0.01449819 ryd = 1590.9920 cm-1 0.491 1 0.00000887 ryd = 0.9733 cm-1 0.998 2 0.00026153 ryd = 28.6996 cm-1 0.986 3 0.00000494 ryd = 0.5417 cm-1 1.000 4 0.00002417 ryd = 2.6522 cm-1 1.000 5 0.00000334 ryd = 0.3671 cm-1 1.000 - ------------------------------------- ----- - ------------------------------------- ----- 0 0.01449819 ryd = 1590.9920 cm-1 0.491 1 0.00000887 ryd = 0.9733 cm-1 0.998 2 0.00026153 ryd = 28.6996 cm-1 0.986 3 0.00000494 ryd = 0.5417 cm-1 1.000 4 0.00002417 ryd = 2.6522 cm-1 1.000 5 0.00000334 ryd = 0.3671 cm-1 1.000 9.00000 0.00008 2.00000 1.00000 3.00000 0.00000 -0.01823 0.00000 9.00000 0.00004 2.00000 3.00000 3.00000 0.00000 -0.01823 0.00000 9.00000 0.00003 2.00000 5.00000 3.00000 0.00000 -0.01823 0.00000 ag i d9 5s7f -d9 5s8f 6 0.0000 5 0.0287 5 0.0027 5 0.0010 5 0.0005 5 0.0004 5 62 63 22 0.750 0.133 803.055 sec rcn mod 32 ee,eee= -0.02066 -0.01033 ee,eee= -0.01580 -0.01823 slater integrals for ag i d9 5s7f nconf=62 z= 47 ion= 0 exf=0.650 irel= 1 ag i d9 5s8f nconf=63 kut=-1 corrf=0.000 class 11 k rdk( 5s, 7f, 5s, 8f) frac k rek( 5s, 7f, 5s, 8f) frac - ------------------------------------- ----- - ------------------------------------- ----- 0 0.01449204 ryd = 1590.3177 cm-1 0.491 3 0.00008797 ryd = 9.6541 cm-1 0.999 - ------------------------------------- ----- - ------------------------------------- ----- 0 0.01449204 ryd = 1590.3176 cm-1 0.491 3 0.00008798 ryd = 9.6548 cm-1 0.999 - ------------------------------------- ----- - ------------------------------------- ----- 0 0.01449204 ryd = 1590.3177 cm-1 0.491 3 0.00008797 ryd = 9.6534 cm-1 0.999 - ------------------------------------- ----- - ------------------------------------- ----- 0 0.01449204 ryd = 1590.3177 cm-1 0.491 3 0.00008797 ryd = 9.6541 cm-1 0.999 1.00000 0.00009 0.00000 3.00000 3.00000 0.00000 -0.01823 0.00000 ag i d9 5s7f -d9 5s8f 2 0.0000 5 0.0097 5 62 63 22 0.930 0.063 804.047 sec sqrtdel= 1.0000 1.0000 0.0000 0.0287 0.0027 0.0010 0.0005 0.0004 0.0000 0.0097 rcn mod 32 ee,eee= -0.02066 -0.01033 ee,eee= -0.01247 -0.01656 slater integrals for ag i d9 5s7f nconf=62 z= 47 ion= 0 exf=0.650 irel= 1 ag i d9 5s9f nconf=64 kut=-1 corrf=0.000 class 11 k rdk( 4d, 7f, 4d, 9f) frac k rek( 4d, 7f, 4d, 9f) frac - ------------------------------------- ----- - ------------------------------------- ----- 0 0.00981488 ryd = 1077.0590 cm-1 0.434 1 0.00000773 ryd = 0.8480 cm-1 0.998 2 0.00021734 ryd = 23.8508 cm-1 0.980 3 0.00000430 ryd = 0.4721 cm-1 1.000 4 0.00002069 ryd = 2.2705 cm-1 1.000 5 0.00000291 ryd = 0.3199 cm-1 1.000 - ------------------------------------- ----- - ------------------------------------- ----- 0 0.00981488 ryd = 1077.0590 cm-1 0.434 1 0.00000773 ryd = 0.8480 cm-1 0.998 2 0.00021734 ryd = 23.8508 cm-1 0.980 3 0.00000430 ryd = 0.4721 cm-1 1.000 4 0.00002069 ryd = 2.2705 cm-1 1.000 5 0.00000291 ryd = 0.3199 cm-1 1.000 - ------------------------------------- ----- - ------------------------------------- ----- 0 0.00981488 ryd = 1077.0590 cm-1 0.434 1 0.00000773 ryd = 0.8480 cm-1 0.998 2 0.00021734 ryd = 23.8507 cm-1 0.980 3 0.00000430 ryd = 0.4721 cm-1 1.000 4 0.00002069 ryd = 2.2705 cm-1 1.000 5 0.00000291 ryd = 0.3199 cm-1 1.000 - ------------------------------------- ----- - ------------------------------------- ----- 0 0.00981488 ryd = 1077.0590 cm-1 0.434 1 0.00000773 ryd = 0.8480 cm-1 0.998 2 0.00021734 ryd = 23.8508 cm-1 0.980 3 0.00000430 ryd = 0.4721 cm-1 1.000 4 0.00002069 ryd = 2.2705 cm-1 1.000 5 0.00000291 ryd = 0.3199 cm-1 1.000 9.00000 0.00007 2.00000 1.00000 3.00000 0.00000 -0.01656 0.00000 9.00000 0.00004 2.00000 3.00000 3.00000 0.00000 -0.01656 0.00000 9.00000 0.00003 2.00000 5.00000 3.00000 0.00000 -0.01656 0.00000 ag i d9 5s7f -d9 5s9f 6 0.0000 5 0.0239 5 0.0023 5 0.0008 5 0.0005 5 0.0003 5 62 64 23 0.664 0.234 804.945 sec rcn mod 32 ee,eee= -0.02066 -0.01033 ee,eee= -0.01247 -0.01656 slater integrals for ag i d9 5s7f nconf=62 z= 47 ion= 0 exf=0.650 irel= 1 ag i d9 5s9f nconf=64 kut=-1 corrf=0.000 class 11 k rdk( 5s, 7f, 5s, 9f) frac k rek( 5s, 7f, 5s, 9f) frac - ------------------------------------- ----- - ------------------------------------- ----- 0 0.00980954 ryd = 1076.4725 cm-1 0.434 3 0.00007610 ryd = 8.3505 cm-1 0.999 - ------------------------------------- ----- - ------------------------------------- ----- 0 0.00980954 ryd = 1076.4724 cm-1 0.434 3 0.00007610 ryd = 8.3514 cm-1 0.999 - ------------------------------------- ----- - ------------------------------------- ----- 0 0.00980954 ryd = 1076.4725 cm-1 0.434 3 0.00007609 ryd = 8.3496 cm-1 0.999 - ------------------------------------- ----- - ------------------------------------- ----- 0 0.00980954 ryd = 1076.4725 cm-1 0.434 3 0.00007610 ryd = 8.3505 cm-1 0.999 1.00000 0.00008 0.00000 3.00000 3.00000 0.00000 -0.01656 0.00000 ag i d9 5s7f -d9 5s9f 2 0.0000 5 0.0084 5 62 64 23 0.867 0.070 805.883 sec sqrtdel= 1.0000 1.0000 0.0000 0.0239 0.0023 0.0008 0.0005 0.0003 0.0000 0.0084 rcn mod 32 ee,eee= -2.06214 -1.03107 ee,eee= -1.16254 -1.61234 slater integrals for ag i d9 5s7f nconf=62 z= 47 ion= 0 exf=0.650 irel= 1 ag i d8 5s2 4f nconf=65 kut=-1 corrf=0.000 class 0 k rdk( 4d, 4d, 4d, 5s) frac k rek( 4d, 4d, 4d, 5s) frac - ------------------------------------- ----- - ------------------------------------- ----- 2 0.00000000 ryd = 0.0000 cm-1 0.000 2 0.00000000 ryd = 0.0000 cm-1 0.000 ag i d9 5s7f -d8 5s2 4f 1 0.0000 5 62 65 24 0.680 0.016 806.602 sec rcn mod 32 ee,eee= -0.02066 -0.01033 ee,eee= -0.06347 -0.04206 slater integrals for ag i d9 5s7f nconf=62 z= 47 ion= 0 exf=0.650 irel= 1 ag i d8 5s2 4f nconf=65 kut=-1 corrf=0.000 class 0 k rdk( 4d, 7f, 5s, 4f) frac k rek( 4d, 7f, 5s, 4f) frac - ------------------------------------- ----- - ------------------------------------- ----- 2 -0.00068082 ryd = -74.7109 cm-1 -0.780 3 -0.00002797 ryd = -3.0695 cm-1 -0.996 ag i d9 5s7f -d8 5s2 4f 2 -0.0747 5 -0.0031 5 62 65 24 1.203 0.070 807.875 sec sqrtdel= 1.0000 1.0000 0.0000 -0.0747 -0.0031 rcn mod 32 ee,eee= -0.02066 -0.01033 ee,eee= -0.02778 -0.02422 slater integrals for ag i d9 5s7f nconf=62 z= 47 ion= 0 exf=0.650 irel= 1 ag i d10 6h nconf=66 kut=-1 corrf=0.000 class 0 k rdk( 5s, 7f, 4d, 6h) frac k rek( 5s, 7f, 4d, 6h) frac - ------------------------------------- ----- - ------------------------------------- ----- 2 -0.00000072 ryd = -0.0790 cm-1 -0.006 5 -0.00000010 ryd = -0.0110 cm-1 -1.000 ag i d9 5s7f -d10 6h 2 -0.0001 5 0.0000 5 62 66 25 1.039 0.031 808.945 sec sqrtdel= 1.0000 1.0000 -0.0001 0.0000 rcn mod 32 ee,eee= -0.02041 -0.02053 slater integrals for ag i d9 5s7f nconf=62 z= 47 ion= 0 exf=0.650 irel= 1 ag i d10 7h nconf=67 kut=-1 corrf=0.000 class 0 k rdk( 5s, 7f, 4d, 7h) frac k rek( 5s, 7f, 4d, 7h) frac - ------------------------------------- ----- - ------------------------------------- ----- 2 0.00000021 ryd = 0.0232 cm-1 0.002 5 -0.00000012 ryd = -0.0129 cm-1 -1.000 ag i d9 5s7f -d10 7h 2 0.0000 5 0.0000 5 62 67 1 0.031 0.016 808.992 sec sqrtdel= 1.0000 1.0000 0.0000 0.0000 rcn mod 32 ee,eee= -0.01563 -0.01814 slater integrals for ag i d9 5s7f nconf=62 z= 47 ion= 0 exf=0.650 irel= 1 ag i d10 8h nconf=68 kut=-1 corrf=0.000 class 0 k rdk( 5s, 7f, 4d, 8h) frac k rek( 5s, 7f, 4d, 8h) frac - ------------------------------------- ----- - ------------------------------------- ----- 2 0.00001401 ryd = 1.5374 cm-1 0.158 5 -0.00000012 ryd = -0.0129 cm-1 -1.000 ag i d9 5s7f -d10 8h 2 0.0015 5 0.0000 5 62 68 1 0.031 0.023 809.055 sec sqrtdel= 1.0000 1.0000 0.0015 0.0000 rcn mod 32 ee,eee= -0.01234 -0.01650 slater integrals for ag i d9 5s7f nconf=62 z= 47 ion= 0 exf=0.650 irel= 1 ag i d10 9h nconf=69 kut=-1 corrf=0.000 class 0 k rdk( 5s, 7f, 4d, 9h) frac k rek( 5s, 7f, 4d, 9h) frac - ------------------------------------- ----- - ------------------------------------- ----- 2 0.00001001 ryd = 1.0980 cm-1 0.128 5 -0.00000011 ryd = -0.0122 cm-1 -1.000 ag i d9 5s7f -d10 9h 2 0.0011 5 0.0000 5 62 69 1 0.031 0.016 809.102 sec sqrtdel= 1.0000 1.0000 0.0011 0.0000 rcn mod 32 ee,eee= -0.02066 -0.01033 ee,eee= -0.02778 -0.02422 slater integrals for ag i d9 5s7f nconf=62 z= 47 ion= 0 exf=0.650 irel= 1 ag i d9 5s6h nconf=70 kut=-1 corrf=0.000 class 0 k rdk( 4d, 7f, 4d, 6h) frac k rek( 4d, 7f, 4d, 6h) frac - ------------------------------------- ----- - ------------------------------------- ----- 2 0.00000051 ryd = 0.0561 cm-1 0.007 3 0.00000002 ryd = 0.0018 cm-1 1.000 4 0.00000063 ryd = 0.0695 cm-1 0.535 5 0.00000001 ryd = 0.0012 cm-1 1.000 ag i d9 5s7f -d9 5s6h 4 0.0001 5 0.0001 5 0.0000 5 0.0000 5 62 70 29 0.789 0.023 809.930 sec sqrtdel= 1.0000 1.0000 0.0001 0.0001 0.0000 0.0000 rcn mod 32 ee,eee= -0.02041 -0.02053 slater integrals for ag i d9 5s7f nconf=62 z= 47 ion= 0 exf=0.650 irel= 1 ag i d9 5s7h nconf=71 kut=-1 corrf=0.000 class 0 k rdk( 4d, 7f, 4d, 7h) frac k rek( 4d, 7f, 4d, 7h) frac - ------------------------------------- ----- - ------------------------------------- ----- 2 -0.00000012 ryd = -0.0133 cm-1 -0.002 3 0.00000002 ryd = 0.0021 cm-1 1.000 4 0.00000075 ryd = 0.0819 cm-1 0.597 5 0.00000001 ryd = 0.0014 cm-1 1.000 ag i d9 5s7f -d9 5s7h 4 0.0000 5 0.0001 5 0.0000 5 0.0000 5 62 71 1 0.031 0.094 810.070 sec sqrtdel= 1.0000 1.0000 0.0000 0.0001 0.0000 0.0000 rcn mod 32 ee,eee= -0.01563 -0.01814 slater integrals for ag i d9 5s7f nconf=62 z= 47 ion= 0 exf=0.650 irel= 1 ag i d9 5s8h nconf=72 kut=-1 corrf=0.000 class 0 k rdk( 4d, 7f, 4d, 8h) frac k rek( 4d, 7f, 4d, 8h) frac - ------------------------------------- ----- - ------------------------------------- ----- 2 -0.00000958 ryd = -1.0511 cm-1 -0.163 3 0.00000002 ryd = 0.0021 cm-1 1.000 4 0.00000075 ryd = 0.0819 cm-1 0.630 5 0.00000001 ryd = 0.0014 cm-1 1.000 ag i d9 5s7f -d9 5s8h 4 -0.0011 5 0.0001 5 0.0000 5 0.0000 5 62 72 1 0.031 0.031 810.133 sec sqrtdel= 1.0000 1.0000 -0.0011 0.0001 0.0000 0.0000 rcn mod 32 ee,eee= -0.01235 -0.01650 slater integrals for ag i d9 5s7f nconf=62 z= 47 ion= 0 exf=0.650 irel= 1 ag i d9 5s9h nconf=73 kut=-1 corrf=0.000 class 0 k rdk( 4d, 7f, 4d, 9h) frac k rek( 4d, 7f, 4d, 9h) frac - ------------------------------------- ----- - ------------------------------------- ----- 2 -0.00000683 ryd = -0.7498 cm-1 -0.133 3 0.00000002 ryd = 0.0020 cm-1 1.000 4 0.00000071 ryd = 0.0781 cm-1 0.657 5 0.00000001 ryd = 0.0013 cm-1 1.000 ag i d9 5s7f -d9 5s9h 4 -0.0007 5 0.0001 5 0.0000 5 0.0000 5 62 73 1 0.039 0.031 810.242 sec sqrtdel= 1.0000 1.0000 -0.0007 0.0001 0.0000 0.0000 rcn mod 32 ee,eee= -0.01562 -0.01814 slater integrals for ag i d9 5s7f nconf=62 z= 47 ion= 0 exf=0.650 irel= 1 ag i d9 5s8k nconf=76 kut=-1 corrf=0.000 class 0 k rdk( 4d, 7f, 4d, 8k) frac k rek( 4d, 7f, 4d, 8k) frac - ------------------------------------- ----- - ------------------------------------- ----- 4 0.00000000 ryd = 0.0000 cm-1 -0.006 5 0.00000000 ryd = 0.0000 cm-1 1.000 ag i d9 5s7f -d9 5s8k 2 0.0000 5 0.0000 5 62 76 3 0.313 0.258 810.820 sec sqrtdel= 1.0000 1.0000 0.0000 0.0000 rcn mod 32 ee,eee= -0.01235 -0.01650 slater integrals for ag i d9 5s7f nconf=62 z= 47 ion= 0 exf=0.650 irel= 1 ag i d9 5s9k nconf=77 kut=-1 corrf=0.000 class 0 k rdk( 4d, 7f, 4d, 9k) frac k rek( 4d, 7f, 4d, 9k) frac - ------------------------------------- ----- - ------------------------------------- ----- 4 0.00000000 ryd = 0.0004 cm-1 0.059 5 0.00000000 ryd = 0.0000 cm-1 1.000 ag i d9 5s7f -d9 5s9k 2 0.0000 5 0.0000 5 62 77 1 0.031 0.016 810.883 sec sqrtdel= 1.0000 1.0000 0.0000 0.0000 rcn mod 32 ee,eee= -0.01580 -0.00790 ee,eee= -0.01247 -0.01413 slater integrals for ag i d9 5s8f nconf=63 z= 47 ion= 0 exf=0.650 irel= 1 ag i d9 5s9f nconf=64 kut=-1 corrf=0.000 class 11 k rdk( 4d, 8f, 4d, 9f) frac k rek( 4d, 8f, 4d, 9f) frac - ------------------------------------- ----- - ------------------------------------- ----- 0 0.01155070 ryd = 1267.5428 cm-1 0.497 1 0.00000668 ryd = 0.7333 cm-1 0.998 2 0.00018302 ryd = 20.0843 cm-1 0.991 3 0.00000372 ryd = 0.4083 cm-1 1.000 4 0.00001749 ryd = 1.9198 cm-1 1.000 5 0.00000252 ryd = 0.2767 cm-1 1.000 - ------------------------------------- ----- - ------------------------------------- ----- 0 0.01155070 ryd = 1267.5428 cm-1 0.497 1 0.00000668 ryd = 0.7333 cm-1 0.998 2 0.00018302 ryd = 20.0843 cm-1 0.991 3 0.00000372 ryd = 0.4083 cm-1 1.000 4 0.00001749 ryd = 1.9198 cm-1 1.000 5 0.00000252 ryd = 0.2767 cm-1 1.000 - ------------------------------------- ----- - ------------------------------------- ----- 0 0.01155070 ryd = 1267.5428 cm-1 0.497 1 0.00000668 ryd = 0.7333 cm-1 0.998 2 0.00018302 ryd = 20.0843 cm-1 0.991 3 0.00000372 ryd = 0.4083 cm-1 1.000 4 0.00001749 ryd = 1.9198 cm-1 1.000 5 0.00000252 ryd = 0.2767 cm-1 1.000 - ------------------------------------- ----- - ------------------------------------- ----- 0 0.01155070 ryd = 1267.5428 cm-1 0.497 1 0.00000668 ryd = 0.7333 cm-1 0.998 2 0.00018302 ryd = 20.0843 cm-1 0.991 3 0.00000372 ryd = 0.4083 cm-1 1.000 4 0.00001749 ryd = 1.9198 cm-1 1.000 5 0.00000252 ryd = 0.2767 cm-1 1.000 9.00000 0.00006 2.00000 1.00000 3.00000 0.00000 -0.01413 0.00000 9.00000 0.00003 2.00000 3.00000 3.00000 0.00000 -0.01413 0.00000 9.00000 0.00002 2.00000 5.00000 3.00000 0.00000 -0.01413 0.00000 ag i d9 5s8f -d9 5s9f 6 0.0000 5 0.0201 5 0.0019 5 0.0007 5 0.0004 5 0.0003 5 63 64 23 0.609 0.133 811.633 sec rcn mod 32 ee,eee= -0.01580 -0.00790 ee,eee= -0.01247 -0.01413 slater integrals for ag i d9 5s8f nconf=63 z= 47 ion= 0 exf=0.650 irel= 1 ag i d9 5s9f nconf=64 kut=-1 corrf=0.000 class 11 k rdk( 5s, 8f, 5s, 9f) frac k rek( 5s, 8f, 5s, 9f) frac - ------------------------------------- ----- - ------------------------------------- ----- 0 0.01154609 ryd = 1267.0368 cm-1 0.497 3 0.00006514 ryd = 7.1482 cm-1 0.999 - ------------------------------------- ----- - ------------------------------------- ----- 0 0.01154609 ryd = 1267.0367 cm-1 0.497 3 0.00006514 ryd = 7.1485 cm-1 0.999 - ------------------------------------- ----- - ------------------------------------- ----- 0 0.01154609 ryd = 1267.0368 cm-1 0.497 3 0.00006514 ryd = 7.1479 cm-1 0.999 - ------------------------------------- ----- - ------------------------------------- ----- 0 0.01154609 ryd = 1267.0368 cm-1 0.497 3 0.00006514 ryd = 7.1482 cm-1 0.999 1.00000 0.00007 0.00000 3.00000 3.00000 0.00000 -0.01413 0.00000 ag i d9 5s8f -d9 5s9f 2 0.0000 5 0.0071 5 63 64 23 0.711 0.102 812.445 sec sqrtdel= 1.0000 1.0000 0.0000 0.0201 0.0019 0.0007 0.0004 0.0003 0.0000 0.0071 rcn mod 32 ee,eee= -2.07176 -1.03588 ee,eee= -1.16254 -1.61715 slater integrals for ag i d9 5s8f nconf=63 z= 47 ion= 0 exf=0.650 irel= 1 ag i d8 5s2 4f nconf=65 kut=-1 corrf=0.000 class 0 k rdk( 4d, 4d, 4d, 5s) frac k rek( 4d, 4d, 4d, 5s) frac - ------------------------------------- ----- - ------------------------------------- ----- 2 0.00000000 ryd = 0.0000 cm-1 0.000 2 0.00000000 ryd = 0.0000 cm-1 0.000 ag i d9 5s8f -d8 5s2 4f 1 0.0000 5 63 65 24 1.031 0.008 813.500 sec rcn mod 32 ee,eee= -0.01580 -0.00790 ee,eee= -0.06347 -0.03963 slater integrals for ag i d9 5s8f nconf=63 z= 47 ion= 0 exf=0.650 irel= 1 ag i d8 5s2 4f nconf=65 kut=-1 corrf=0.000 class 0 k rdk( 4d, 8f, 5s, 4f) frac k rek( 4d, 8f, 5s, 4f) frac - ------------------------------------- ----- - ------------------------------------- ----- 2 -0.00054593 ryd = -59.9086 cm-1 -0.767 3 -0.00002405 ryd = -2.6395 cm-1 -0.996 ag i d9 5s8f -d8 5s2 4f 2 -0.0599 5 -0.0026 5 63 65 24 0.641 0.055 814.195 sec sqrtdel= 1.0000 1.0000 0.0000 -0.0599 -0.0026 rcn mod 32 ee,eee= -0.01580 -0.00790 ee,eee= -0.02778 -0.02179 slater integrals for ag i d9 5s8f nconf=63 z= 47 ion= 0 exf=0.650 irel= 1 ag i d10 6h nconf=66 kut=-1 corrf=0.000 class 0 k rdk( 5s, 8f, 4d, 6h) frac k rek( 5s, 8f, 4d, 6h) frac - ------------------------------------- ----- - ------------------------------------- ----- 2 -0.00000097 ryd = -0.1063 cm-1 -0.011 5 -0.00000009 ryd = -0.0094 cm-1 -1.000 ag i d9 5s8f -d10 6h 2 -0.0001 5 0.0000 5 63 66 25 0.836 0.070 815.102 sec sqrtdel= 1.0000 1.0000 -0.0001 0.0000 rcn mod 32 ee,eee= -0.02041 -0.01810 slater integrals for ag i d9 5s8f nconf=63 z= 47 ion= 0 exf=0.650 irel= 1 ag i d10 7h nconf=67 kut=-1 corrf=0.000 class 0 k rdk( 5s, 8f, 4d, 7h) frac k rek( 5s, 8f, 4d, 7h) frac - ------------------------------------- ----- - ------------------------------------- ----- 2 -0.00000045 ryd = -0.0493 cm-1 -0.006 5 -0.00000010 ryd = -0.0110 cm-1 -1.000 ag i d9 5s8f -d10 7h 2 0.0000 5 0.0000 5 63 67 1 0.031 0.023 815.195 sec sqrtdel= 1.0000 1.0000 0.0000 0.0000 rcn mod 32 ee,eee= -0.01563 -0.01571 slater integrals for ag i d9 5s8f nconf=63 z= 47 ion= 0 exf=0.650 irel= 1 ag i d10 8h nconf=68 kut=-1 corrf=0.000 class 0 k rdk( 5s, 8f, 4d, 8h) frac k rek( 5s, 8f, 4d, 8h) frac - ------------------------------------- ----- - ------------------------------------- ----- 2 0.00000020 ryd = 0.0220 cm-1 0.003 5 -0.00000010 ryd = -0.0110 cm-1 -1.000 ag i d9 5s8f -d10 8h 2 0.0000 5 0.0000 5 63 68 1 0.500 0.031 815.734 sec sqrtdel= 1.0000 1.0000 0.0000 0.0000 rcn mod 32 ee,eee= -0.01234 -0.01407 slater integrals for ag i d9 5s8f nconf=63 z= 47 ion= 0 exf=0.650 irel= 1 ag i d10 9h nconf=69 kut=-1 corrf=0.000 class 0 k rdk( 5s, 8f, 4d, 9h) frac k rek( 5s, 8f, 4d, 9h) frac - ------------------------------------- ----- - ------------------------------------- ----- 2 0.00000705 ryd = 0.7738 cm-1 0.116 5 -0.00000009 ryd = -0.0104 cm-1 -1.000 ag i d9 5s8f -d10 9h 2 0.0008 5 0.0000 5 63 69 1 0.031 0.023 815.797 sec sqrtdel= 1.0000 1.0000 0.0008 0.0000 rcn mod 32 ee,eee= -0.01580 -0.00790 ee,eee= -0.02778 -0.02179 slater integrals for ag i d9 5s8f nconf=63 z= 47 ion= 0 exf=0.650 irel= 1 ag i d9 5s6h nconf=70 kut=-1 corrf=0.000 class 0 k rdk( 4d, 8f, 4d, 6h) frac k rek( 4d, 8f, 4d, 6h) frac - ------------------------------------- ----- - ------------------------------------- ----- 2 0.00000068 ryd = 0.0745 cm-1 0.011 3 0.00000001 ryd = 0.0015 cm-1 1.000 4 0.00000050 ryd = 0.0548 cm-1 0.523 5 0.00000001 ryd = 0.0010 cm-1 1.000 ag i d9 5s8f -d9 5s6h 4 0.0001 5 0.0001 5 0.0000 5 0.0000 5 63 70 29 1.000 0.031 816.836 sec sqrtdel= 1.0000 1.0000 0.0001 0.0001 0.0000 0.0000 rcn mod 32 ee,eee= -0.02041 -0.01810 slater integrals for ag i d9 5s8f nconf=63 z= 47 ion= 0 exf=0.650 irel= 1 ag i d9 5s7h nconf=71 kut=-1 corrf=0.000 class 0 k rdk( 4d, 8f, 4d, 7h) frac k rek( 4d, 8f, 4d, 7h) frac - ------------------------------------- ----- - ------------------------------------- ----- 2 0.00000033 ryd = 0.0360 cm-1 0.006 3 0.00000002 ryd = 0.0018 cm-1 1.000 4 0.00000059 ryd = 0.0646 cm-1 0.583 5 0.00000001 ryd = 0.0012 cm-1 1.000 ag i d9 5s8f -d9 5s7h 4 0.0000 5 0.0001 5 0.0000 5 0.0000 5 63 71 1 0.031 0.031 816.906 sec sqrtdel= 1.0000 1.0000 0.0000 0.0001 0.0000 0.0000 rcn mod 32 ee,eee= -0.01563 -0.01571 slater integrals for ag i d9 5s8f nconf=63 z= 47 ion= 0 exf=0.650 irel= 1 ag i d9 5s8h nconf=72 kut=-1 corrf=0.000 class 0 k rdk( 4d, 8f, 4d, 8h) frac k rek( 4d, 8f, 4d, 8h) frac - ------------------------------------- ----- - ------------------------------------- ----- 2 -0.00000012 ryd = -0.0126 cm-1 -0.002 3 0.00000002 ryd = 0.0018 cm-1 1.000 4 0.00000059 ryd = 0.0648 cm-1 0.617 5 0.00000001 ryd = 0.0012 cm-1 1.000 ag i d9 5s8f -d9 5s8h 4 0.0000 5 0.0001 5 0.0000 5 0.0000 5 63 72 1 0.031 0.016 816.961 sec sqrtdel= 1.0000 1.0000 0.0000 0.0001 0.0000 0.0000 rcn mod 32 ee,eee= -0.01235 -0.01407 slater integrals for ag i d9 5s8f nconf=63 z= 47 ion= 0 exf=0.650 irel= 1 ag i d9 5s9h nconf=73 kut=-1 corrf=0.000 class 0 k rdk( 4d, 8f, 4d, 9h) frac k rek( 4d, 8f, 4d, 9h) frac - ------------------------------------- ----- - ------------------------------------- ----- 2 -0.00000481 ryd = -0.5280 cm-1 -0.120 3 0.00000002 ryd = 0.0017 cm-1 1.000 4 0.00000056 ryd = 0.0613 cm-1 0.638 5 0.00000001 ryd = 0.0011 cm-1 1.000 ag i d9 5s8f -d9 5s9h 4 -0.0005 5 0.0001 5 0.0000 5 0.0000 5 63 73 1 0.023 0.047 817.102 sec sqrtdel= 1.0000 1.0000 -0.0005 0.0001 0.0000 0.0000 rcn mod 32 ee,eee= -0.01562 -0.01571 slater integrals for ag i d9 5s8f nconf=63 z= 47 ion= 0 exf=0.650 irel= 1 ag i d9 5s8k nconf=76 kut=-1 corrf=0.000 class 0 k rdk( 4d, 8f, 4d, 8k) frac k rek( 4d, 8f, 4d, 8k) frac - ------------------------------------- ----- - ------------------------------------- ----- 4 0.00000000 ryd = 0.0000 cm-1 0.000 5 0.00000000 ryd = 0.0000 cm-1 1.000 ag i d9 5s8f -d9 5s8k 2 0.0000 5 0.0000 5 63 76 3 0.063 0.023 817.203 sec sqrtdel= 1.0000 1.0000 0.0000 0.0000 rcn mod 32 ee,eee= -0.01235 -0.01407 slater integrals for ag i d9 5s8f nconf=63 z= 47 ion= 0 exf=0.650 irel= 1 ag i d9 5s9k nconf=77 kut=-1 corrf=0.000 class 0 k rdk( 4d, 8f, 4d, 9k) frac k rek( 4d, 8f, 4d, 9k) frac - ------------------------------------- ----- - ------------------------------------- ----- 4 0.00000000 ryd = 0.0000 cm-1 -0.003 5 0.00000000 ryd = 0.0000 cm-1 1.000 ag i d9 5s8f -d9 5s9k 2 0.0000 5 0.0000 5 63 77 1 0.039 0.008 817.250 sec sqrtdel= 1.0000 1.0000 0.0000 0.0000 rcn mod 32 ee,eee= -2.07837 -1.03918 ee,eee= -1.16254 -1.62046 slater integrals for ag i d9 5s9f nconf=64 z= 47 ion= 0 exf=0.650 irel= 1 ag i d8 5s2 4f nconf=65 kut=-1 corrf=0.000 class 0 k rdk( 4d, 4d, 4d, 5s) frac k rek( 4d, 4d, 4d, 5s) frac - ------------------------------------- ----- - ------------------------------------- ----- 2 0.00000000 ryd = 0.0000 cm-1 0.000 2 0.00000000 ryd = 0.0000 cm-1 0.000 ag i d9 5s9f -d8 5s2 4f 1 0.0000 5 64 65 24 0.938 0.031 818.234 sec rcn mod 32 ee,eee= -0.01247 -0.00623 ee,eee= -0.06347 -0.03797 slater integrals for ag i d9 5s9f nconf=64 z= 47 ion= 0 exf=0.650 irel= 1 ag i d8 5s2 4f nconf=65 kut=-1 corrf=0.000 class 0 k rdk( 4d, 9f, 5s, 4f) frac k rek( 4d, 9f, 5s, 4f) frac - ------------------------------------- ----- - ------------------------------------- ----- 2 -0.00045164 ryd = -49.5613 cm-1 -0.758 3 -0.00002087 ryd = -2.2907 cm-1 -0.996 ag i d9 5s9f -d8 5s2 4f 2 -0.0496 5 -0.0023 5 64 65 24 0.648 0.023 818.906 sec sqrtdel= 1.0000 1.0000 0.0000 -0.0496 -0.0023 rcn mod 32 ee,eee= -0.01247 -0.00623 ee,eee= -0.02778 -0.02012 slater integrals for ag i d9 5s9f nconf=64 z= 47 ion= 0 exf=0.650 irel= 1 ag i d10 6h nconf=66 kut=-1 corrf=0.000 class 0 k rdk( 5s, 9f, 4d, 6h) frac k rek( 5s, 9f, 4d, 6h) frac - ------------------------------------- ----- - ------------------------------------- ----- 2 -0.00000096 ryd = -0.1051 cm-1 -0.013 5 -0.00000007 ryd = -0.0081 cm-1 -1.000 ag i d9 5s9f -d10 6h 2 -0.0001 5 0.0000 5 64 66 25 0.922 0.016 819.883 sec sqrtdel= 1.0000 1.0000 -0.0001 0.0000 rcn mod 32 ee,eee= -0.02041 -0.01644 slater integrals for ag i d9 5s9f nconf=64 z= 47 ion= 0 exf=0.650 irel= 1 ag i d10 7h nconf=67 kut=-1 corrf=0.000 class 0 k rdk( 5s, 9f, 4d, 7h) frac k rek( 5s, 9f, 4d, 7h) frac - ------------------------------------- ----- - ------------------------------------- ----- 2 -0.00000071 ryd = -0.0779 cm-1 -0.011 5 -0.00000009 ryd = -0.0095 cm-1 -1.000 ag i d9 5s9f -d10 7h 2 -0.0001 5 0.0000 5 64 67 1 0.281 0.031 820.195 sec sqrtdel= 1.0000 1.0000 -0.0001 0.0000 rcn mod 32 ee,eee= -0.01563 -0.01405 slater integrals for ag i d9 5s9f nconf=64 z= 47 ion= 0 exf=0.650 irel= 1 ag i d10 8h nconf=68 kut=-1 corrf=0.000 class 0 k rdk( 5s, 9f, 4d, 8h) frac k rek( 5s, 9f, 4d, 8h) frac - ------------------------------------- ----- - ------------------------------------- ----- 2 -0.00000023 ryd = -0.0253 cm-1 -0.004 5 -0.00000009 ryd = -0.0095 cm-1 -1.000 ag i d9 5s9f -d10 8h 2 0.0000 5 0.0000 5 64 68 1 0.016 0.031 820.242 sec sqrtdel= 1.0000 1.0000 0.0000 0.0000 rcn mod 32 ee,eee= -0.01234 -0.01241 slater integrals for ag i d9 5s9f nconf=64 z= 47 ion= 0 exf=0.650 irel= 1 ag i d10 9h nconf=69 kut=-1 corrf=0.000 class 0 k rdk( 5s, 9f, 4d, 9h) frac k rek( 5s, 9f, 4d, 9h) frac - ------------------------------------- ----- - ------------------------------------- ----- 2 0.00000018 ryd = 0.0195 cm-1 0.004 5 -0.00000008 ryd = -0.0090 cm-1 -1.000 ag i d9 5s9f -d10 9h 2 0.0000 5 0.0000 5 64 69 1 0.086 0.016 820.352 sec sqrtdel= 1.0000 1.0000 0.0000 0.0000 rcn mod 32 ee,eee= -0.01247 -0.00623 ee,eee= -0.02778 -0.02012 slater integrals for ag i d9 5s9f nconf=64 z= 47 ion= 0 exf=0.650 irel= 1 ag i d9 5s6h nconf=70 kut=-1 corrf=0.000 class 0 k rdk( 4d, 9f, 4d, 6h) frac k rek( 4d, 9f, 4d, 6h) frac - ------------------------------------- ----- - ------------------------------------- ----- 2 0.00000067 ryd = 0.0735 cm-1 0.014 3 0.00000001 ryd = 0.0013 cm-1 1.000 4 0.00000041 ryd = 0.0449 cm-1 0.516 5 0.00000001 ryd = 0.0009 cm-1 1.000 ag i d9 5s9f -d9 5s6h 4 0.0001 5 0.0000 5 0.0000 5 0.0000 5 64 70 29 0.789 0.078 821.234 sec sqrtdel= 1.0000 1.0000 0.0001 0.0000 0.0000 0.0000 rcn mod 32 ee,eee= -0.02041 -0.01644 slater integrals for ag i d9 5s9f nconf=64 z= 47 ion= 0 exf=0.650 irel= 1 ag i d9 5s7h nconf=71 kut=-1 corrf=0.000 class 0 k rdk( 4d, 9f, 4d, 7h) frac k rek( 4d, 9f, 4d, 7h) frac - ------------------------------------- ----- - ------------------------------------- ----- 2 0.00000050 ryd = 0.0553 cm-1 0.011 3 0.00000001 ryd = 0.0016 cm-1 1.000 4 0.00000048 ryd = 0.0529 cm-1 0.574 5 0.00000001 ryd = 0.0010 cm-1 1.000 ag i d9 5s9f -d9 5s7h 4 0.0001 5 0.0001 5 0.0000 5 0.0000 5 64 71 1 0.031 0.047 821.320 sec sqrtdel= 1.0000 1.0000 0.0001 0.0001 0.0000 0.0000 rcn mod 32 ee,eee= -0.01563 -0.01405 slater integrals for ag i d9 5s9f nconf=64 z= 47 ion= 0 exf=0.650 irel= 1 ag i d9 5s8h nconf=72 kut=-1 corrf=0.000 class 0 k rdk( 4d, 9f, 4d, 8h) frac k rek( 4d, 9f, 4d, 8h) frac - ------------------------------------- ----- - ------------------------------------- ----- 2 0.00000018 ryd = 0.0195 cm-1 0.005 3 0.00000001 ryd = 0.0016 cm-1 1.000 4 0.00000048 ryd = 0.0530 cm-1 0.607 5 0.00000001 ryd = 0.0010 cm-1 1.000 ag i d9 5s9f -d9 5s8h 4 0.0000 5 0.0001 5 0.0000 5 0.0000 5 64 72 1 0.031 0.031 821.383 sec sqrtdel= 1.0000 1.0000 0.0000 0.0001 0.0000 0.0000 rcn mod 32 ee,eee= -0.01235 -0.01241 slater integrals for ag i d9 5s9f nconf=64 z= 47 ion= 0 exf=0.650 irel= 1 ag i d9 5s9h nconf=73 kut=-1 corrf=0.000 class 0 k rdk( 4d, 9f, 4d, 9h) frac k rek( 4d, 9f, 4d, 9h) frac - ------------------------------------- ----- - ------------------------------------- ----- 2 -0.00000010 ryd = -0.0113 cm-1 -0.003 3 0.00000001 ryd = 0.0015 cm-1 1.000 4 0.00000046 ryd = 0.0502 cm-1 0.628 5 0.00000001 ryd = 0.0010 cm-1 1.000 ag i d9 5s9f -d9 5s9h 4 0.0000 5 0.0001 5 0.0000 5 0.0000 5 64 73 1 0.031 0.031 821.453 sec sqrtdel= 1.0000 1.0000 0.0000 0.0001 0.0000 0.0000 rcn mod 32 ee,eee= -0.01562 -0.01405 slater integrals for ag i d9 5s9f nconf=64 z= 47 ion= 0 exf=0.650 irel= 1 ag i d9 5s8k nconf=76 kut=-1 corrf=0.000 class 0 k rdk( 4d, 9f, 4d, 8k) frac k rek( 4d, 9f, 4d, 8k) frac - ------------------------------------- ----- - ------------------------------------- ----- 4 0.00000000 ryd = 0.0000 cm-1 0.000 5 0.00000000 ryd = 0.0000 cm-1 1.000 ag i d9 5s9f -d9 5s8k 2 0.0000 5 0.0000 5 64 76 3 0.070 0.031 821.563 sec sqrtdel= 1.0000 1.0000 0.0000 0.0000 rcn mod 32 ee,eee= -0.01235 -0.01241 slater integrals for ag i d9 5s9f nconf=64 z= 47 ion= 0 exf=0.650 irel= 1 ag i d9 5s9k nconf=77 kut=-1 corrf=0.000 class 0 k rdk( 4d, 9f, 4d, 9k) frac k rek( 4d, 9f, 4d, 9k) frac - ------------------------------------- ----- - ------------------------------------- ----- 4 0.00000000 ryd = 0.0000 cm-1 -0.001 5 0.00000000 ryd = 0.0000 cm-1 1.000 ag i d9 5s9f -d9 5s9k 2 0.0000 5 0.0000 5 64 77 1 0.031 0.023 821.617 sec sqrtdel= 1.0000 1.0000 0.0000 0.0000 rcn mod 32 ee,eee= -0.06347 -0.03173 ee,eee= -0.02778 -0.04562 slater integrals for ag i d8 5s2 4f nconf=65 z= 47 ion= 0 exf=0.650 irel= 1 ag i d9 5s6h nconf=70 kut=-1 corrf=0.000 class 0 k rdk( 5s, 4f, 4d, 6h) frac k rek( 5s, 4f, 4d, 6h) frac - ------------------------------------- ----- - ------------------------------------- ----- 2 -0.00024673 ryd = -27.0750 cm-1 -0.954 5 -0.00000010 ryd = -0.0112 cm-1 -1.000 ag i d8 5s2 4f -d9 5s6h 2 -0.0271 5 0.0000 5 65 70 29 1.313 0.016 822.961 sec sqrtdel= 1.0000 1.0000 -0.0271 0.0000 rcn mod 32 ee,eee= -0.02041 -0.04194 slater integrals for ag i d8 5s2 4f nconf=65 z= 47 ion= 0 exf=0.650 irel= 1 ag i d9 5s7h nconf=71 kut=-1 corrf=0.000 class 0 k rdk( 5s, 4f, 4d, 7h) frac k rek( 5s, 4f, 4d, 7h) frac - ------------------------------------- ----- - ------------------------------------- ----- 2 -0.00023982 ryd = -26.3169 cm-1 -0.952 5 -0.00000012 ryd = -0.0131 cm-1 -1.000 ag i d8 5s2 4f -d9 5s7h 2 -0.0263 5 0.0000 5 65 71 1 0.023 0.023 823.023 sec sqrtdel= 1.0000 1.0000 -0.0263 0.0000 rcn mod 32 ee,eee= -0.01563 -0.03955 slater integrals for ag i d8 5s2 4f nconf=65 z= 47 ion= 0 exf=0.650 irel= 1 ag i d9 5s8h nconf=72 kut=-1 corrf=0.000 class 0 k rdk( 5s, 4f, 4d, 8h) frac k rek( 5s, 4f, 4d, 8h) frac - ------------------------------------- ----- - ------------------------------------- ----- 2 -0.00021395 ryd = -23.4781 cm-1 -0.948 5 -0.00000012 ryd = -0.0132 cm-1 -1.000 ag i d8 5s2 4f -d9 5s8h 2 -0.0235 5 0.0000 5 65 72 1 0.031 0.031 823.086 sec sqrtdel= 1.0000 1.0000 -0.0235 0.0000 rcn mod 32 ee,eee= -0.01235 -0.03791 slater integrals for ag i d8 5s2 4f nconf=65 z= 47 ion= 0 exf=0.650 irel= 1 ag i d9 5s9h nconf=73 kut=-1 corrf=0.000 class 0 k rdk( 5s, 4f, 4d, 9h) frac k rek( 5s, 4f, 4d, 9h) frac - ------------------------------------- ----- - ------------------------------------- ----- 2 -0.00018791 ryd = -20.6213 cm-1 -0.944 5 -0.00000011 ryd = -0.0125 cm-1 -1.000 ag i d8 5s2 4f -d9 5s9h 2 -0.0206 5 0.0000 5 65 73 1 0.031 0.016 823.133 sec sqrtdel= 1.0000 1.0000 -0.0206 0.0000 rcn mod 32 ee,eee= -1.75379 -0.87690 ee,eee= -1.15547 -1.45463 slater integrals for ag i d10 6h nconf=66 z= 47 ion= 0 exf=0.650 irel= 1 ag i d9 5s6h nconf=70 kut=-1 corrf=0.000 class 0 k rdk( 4d, 4d, 4d, 5s) frac k rek( 4d, 4d, 4d, 5s) frac - ------------------------------------- ----- - ------------------------------------- ----- 2 -0.13771314 ryd = -15112.2691 cm-1 -0.475 2 -0.13771340 ryd = -15112.2982 cm-1 -0.475 ag i d10 6h -d9 5s6h 1 -15.1123 5 66 70 29 1.289 0.031 824.477 sec rcn mod 32 ee,eee= -0.02778 -0.01389 ee,eee= -0.02778 -0.02778 slater integrals for ag i d10 6h nconf=66 z= 47 ion= 0 exf=0.650 irel= 1 ag i d9 5s6h nconf=70 kut=-1 corrf=0.000 class 0 k rdk( 4d, 6h, 5s, 6h) frac k rek( 4d, 6h, 5s, 6h) frac - ------------------------------------- ----- - ------------------------------------- ----- 2 -0.00017762 ryd = -19.4919 cm-1 -0.961 5 0.00000000 ryd = -0.0001 cm-1 -1.000 ag i d10 6h -d9 5s6h 2 -0.0195 5 0.0000 5 66 70 29 1.125 0.031 825.633 sec sqrtdel= 1.0000 1.0000 -15.1123 -0.0195 0.0000 rcn mod 32 ee,eee= -1.75379 -0.87690 ee,eee= -1.17021 -1.46200 slater integrals for ag i d10 6h nconf=66 z= 47 ion= 0 exf=0.650 irel= 1 ag i d9 5s7h nconf=71 kut=-1 corrf=0.000 class 0 k rdk( 4d, 4d, 4d, 5s) frac k rek( 4d, 4d, 4d, 5s) frac - ------------------------------------- ----- - ------------------------------------- ----- 2 0.00000000 ryd = 0.0000 cm-1 0.000 2 0.00000000 ryd = 0.0000 cm-1 0.000 ag i d10 6h -d9 5s7h 1 0.0000 5 66 71 30 0.828 0.023 826.484 sec rcn mod 32 ee,eee= -0.02778 -0.01389 ee,eee= -0.02041 -0.02409 slater integrals for ag i d10 6h nconf=66 z= 47 ion= 0 exf=0.650 irel= 1 ag i d9 5s7h nconf=71 kut=-1 corrf=0.000 class 0 k rdk( 4d, 6h, 5s, 7h) frac k rek( 4d, 6h, 5s, 7h) frac - ------------------------------------- ----- - ------------------------------------- ----- 2 -0.00010127 ryd = -11.1133 cm-1 -0.775 5 0.00000000 ryd = -0.0001 cm-1 -1.000 ag i d10 6h -d9 5s7h 2 -0.0111 5 0.0000 5 66 71 30 1.258 0.023 827.773 sec sqrtdel= 1.0000 1.0000 0.0000 -0.0111 0.0000 rcn mod 32 ee,eee= -1.75379 -0.87690 ee,eee= -1.17977 -1.46678 slater integrals for ag i d10 6h nconf=66 z= 47 ion= 0 exf=0.650 irel= 1 ag i d9 5s8h nconf=72 kut=-1 corrf=0.000 class 0 k rdk( 4d, 4d, 4d, 5s) frac k rek( 4d, 4d, 4d, 5s) frac - ------------------------------------- ----- - ------------------------------------- ----- 2 0.00000000 ryd = 0.0000 cm-1 0.000 2 0.00000000 ryd = 0.0000 cm-1 0.000 ag i d10 6h -d9 5s8h 1 0.0000 5 66 72 31 0.938 0.023 828.734 sec rcn mod 32 ee,eee= -0.02778 -0.01389 ee,eee= -0.01563 -0.02170 slater integrals for ag i d10 6h nconf=66 z= 47 ion= 0 exf=0.650 irel= 1 ag i d9 5s8h nconf=72 kut=-1 corrf=0.000 class 0 k rdk( 4d, 6h, 5s, 8h) frac k rek( 4d, 6h, 5s, 8h) frac - ------------------------------------- ----- - ------------------------------------- ----- 2 -0.00007123 ryd = -7.8161 cm-1 -0.696 5 0.00000000 ryd = -0.0001 cm-1 -1.000 ag i d10 6h -d9 5s8h 2 -0.0078 5 0.0000 5 66 72 31 1.273 0.016 830.031 sec sqrtdel= 1.0000 1.0000 0.0000 -0.0078 0.0000 rcn mod 32 ee,eee= -1.75379 -0.87690 ee,eee= -1.18633 -1.47006 slater integrals for ag i d10 6h nconf=66 z= 47 ion= 0 exf=0.650 irel= 1 ag i d9 5s9h nconf=73 kut=-1 corrf=0.000 class 0 k rdk( 4d, 4d, 4d, 5s) frac k rek( 4d, 4d, 4d, 5s) frac - ------------------------------------- ----- - ------------------------------------- ----- 2 0.00000000 ryd = 0.0000 cm-1 0.000 2 0.00000000 ryd = 0.0000 cm-1 0.000 ag i d10 6h -d9 5s9h 1 0.0000 5 66 73 32 0.961 0.008 831.063 sec rcn mod 32 ee,eee= -0.02778 -0.01389 ee,eee= -0.01235 -0.02006 slater integrals for ag i d10 6h nconf=66 z= 47 ion= 0 exf=0.650 irel= 1 ag i d9 5s9h nconf=73 kut=-1 corrf=0.000 class 0 k rdk( 4d, 6h, 5s, 9h) frac k rek( 4d, 6h, 5s, 9h) frac - ------------------------------------- ----- - ------------------------------------- ----- 2 -0.00005452 ryd = -5.9831 cm-1 -0.652 5 0.00000000 ryd = -0.0001 cm-1 -1.000 ag i d10 6h -d9 5s9h 2 -0.0060 5 0.0000 5 66 73 32 1.555 0.023 832.641 sec sqrtdel= 1.0000 1.0000 0.0000 -0.0060 0.0000 rcn mod 32 ee,eee= -0.01562 -0.02170 slater integrals for ag i d10 6h nconf=66 z= 47 ion= 0 exf=0.650 irel= 1 ag i d9 5s8k nconf=76 kut=-1 corrf=0.000 class 0 k rdk( 4d, 6h, 5s, 8k) frac k rek( 4d, 6h, 5s, 8k) frac - ------------------------------------- ----- - ------------------------------------- ----- 2 -0.00004024 ryd = -4.4160 cm-1 -0.961 5 0.00000000 ryd = 0.0000 cm-1 -1.000 ag i d10 6h -d9 5s8k 2 -0.0044 5 0.0000 5 66 76 3 0.070 0.016 832.742 sec sqrtdel= 1.0000 1.0000 -0.0044 0.0000 rcn mod 32 ee,eee= -0.01235 -0.02006 slater integrals for ag i d10 6h nconf=66 z= 47 ion= 0 exf=0.650 irel= 1 ag i d9 5s9k nconf=77 kut=-1 corrf=0.000 class 0 k rdk( 4d, 6h, 5s, 9k) frac k rek( 4d, 6h, 5s, 9k) frac - ------------------------------------- ----- - ------------------------------------- ----- 2 -0.00004006 ryd = -4.3959 cm-1 -0.952 5 0.00000000 ryd = 0.0000 cm-1 -1.000 ag i d10 6h -d9 5s9k 2 -0.0044 5 0.0000 5 66 77 1 0.016 0.023 832.805 sec sqrtdel= 1.0000 1.0000 -0.0044 0.0000 rcn mod 32 ee,eee= -1.76853 -0.88427 ee,eee= -1.15547 -1.46200 slater integrals for ag i d10 7h nconf=67 z= 47 ion= 0 exf=0.650 irel= 1 ag i d9 5s6h nconf=70 kut=-1 corrf=0.000 class 0 k rdk( 4d, 4d, 4d, 5s) frac k rek( 4d, 4d, 4d, 5s) frac - ------------------------------------- ----- - ------------------------------------- ----- 2 0.00000000 ryd = 0.0000 cm-1 0.000 2 0.00000000 ryd = 0.0000 cm-1 0.000 ag i d10 7h -d9 5s6h 1 0.0000 5 67 70 29 0.883 0.070 833.766 sec rcn mod 32 ee,eee= -0.02041 -0.01020 ee,eee= -0.02778 -0.02409 slater integrals for ag i d10 7h nconf=67 z= 47 ion= 0 exf=0.650 irel= 1 ag i d9 5s6h nconf=70 kut=-1 corrf=0.000 class 0 k rdk( 4d, 7h, 5s, 6h) frac k rek( 4d, 7h, 5s, 6h) frac - ------------------------------------- ----- - ------------------------------------- ----- 2 -0.00010127 ryd = -11.1133 cm-1 -0.775 5 0.00000000 ryd = -0.0001 cm-1 -1.000 ag i d10 7h -d9 5s6h 2 -0.0111 5 0.0000 5 67 70 29 1.008 0.023 834.797 sec sqrtdel= 1.0000 1.0000 0.0000 -0.0111 0.0000 rcn mod 32 ee,eee= -1.76853 -0.88427 ee,eee= -1.17021 -1.46937 slater integrals for ag i d10 7h nconf=67 z= 47 ion= 0 exf=0.650 irel= 1 ag i d9 5s7h nconf=71 kut=-1 corrf=0.000 class 0 k rdk( 4d, 4d, 4d, 5s) frac k rek( 4d, 4d, 4d, 5s) frac - ------------------------------------- ----- - ------------------------------------- ----- 2 -0.13771312 ryd = -15112.2676 cm-1 -0.475 2 -0.13771339 ryd = -15112.2967 cm-1 -0.475 ag i d10 7h -d9 5s7h 1 -15.1123 5 67 71 30 0.969 0.023 835.805 sec rcn mod 32 ee,eee= -0.02041 -0.01020 ee,eee= -0.02041 -0.02041 slater integrals for ag i d10 7h nconf=67 z= 47 ion= 0 exf=0.650 irel= 1 ag i d9 5s7h nconf=71 kut=-1 corrf=0.000 class 0 k rdk( 4d, 7h, 5s, 7h) frac k rek( 4d, 7h, 5s, 7h) frac - ------------------------------------- ----- - ------------------------------------- ----- 2 -0.00011186 ryd = -12.2748 cm-1 -0.961 5 0.00000000 ryd = -0.0001 cm-1 -1.000 ag i d10 7h -d9 5s7h 2 -0.0123 5 0.0000 5 67 71 30 1.391 0.031 837.227 sec sqrtdel= 1.0000 1.0000 -15.1123 -0.0123 0.0000 rcn mod 32 ee,eee= -1.76853 -0.88427 ee,eee= -1.17977 -1.47415 slater integrals for ag i d10 7h nconf=67 z= 47 ion= 0 exf=0.650 irel= 1 ag i d9 5s8h nconf=72 kut=-1 corrf=0.000 class 0 k rdk( 4d, 4d, 4d, 5s) frac k rek( 4d, 4d, 4d, 5s) frac - ------------------------------------- ----- - ------------------------------------- ----- 2 0.00000000 ryd = 0.0000 cm-1 0.000 2 0.00000000 ryd = 0.0000 cm-1 0.000 ag i d10 7h -d9 5s8h 1 0.0000 5 67 72 31 0.836 0.016 838.086 sec rcn mod 32 ee,eee= -0.02041 -0.01020 ee,eee= -0.01563 -0.01802 slater integrals for ag i d10 7h nconf=67 z= 47 ion= 0 exf=0.650 irel= 1 ag i d9 5s8h nconf=72 kut=-1 corrf=0.000 class 0 k rdk( 4d, 7h, 5s, 8h) frac k rek( 4d, 7h, 5s, 8h) frac - ------------------------------------- ----- - ------------------------------------- ----- 2 -0.00007818 ryd = -8.5787 cm-1 -0.872 5 0.00000000 ryd = -0.0001 cm-1 -1.000 ag i d10 7h -d9 5s8h 2 -0.0086 5 0.0000 5 67 72 31 1.117 0.023 839.227 sec sqrtdel= 1.0000 1.0000 0.0000 -0.0086 0.0000 rcn mod 32 ee,eee= -1.76853 -0.88427 ee,eee= -1.18633 -1.47743 slater integrals for ag i d10 7h nconf=67 z= 47 ion= 0 exf=0.650 irel= 1 ag i d9 5s9h nconf=73 kut=-1 corrf=0.000 class 0 k rdk( 4d, 4d, 4d, 5s) frac k rek( 4d, 4d, 4d, 5s) frac - ------------------------------------- ----- - ------------------------------------- ----- 2 0.00000000 ryd = 0.0000 cm-1 0.000 2 0.00000000 ryd = 0.0000 cm-1 0.000 ag i d10 7h -d9 5s9h 1 0.0000 5 67 73 32 1.344 0.023 840.594 sec rcn mod 32 ee,eee= -0.02041 -0.01020 ee,eee= -0.01235 -0.01638 slater integrals for ag i d10 7h nconf=67 z= 47 ion= 0 exf=0.650 irel= 1 ag i d9 5s9h nconf=73 kut=-1 corrf=0.000 class 0 k rdk( 4d, 7h, 5s, 9h) frac k rek( 4d, 7h, 5s, 9h) frac - ------------------------------------- ----- - ------------------------------------- ----- 2 -0.00006017 ryd = -6.6026 cm-1 -0.829 5 0.00000000 ryd = -0.0001 cm-1 -1.000 ag i d10 7h -d9 5s9h 2 -0.0066 5 0.0000 5 67 73 32 1.117 0.023 841.734 sec sqrtdel= 1.0000 1.0000 0.0000 -0.0066 0.0000 rcn mod 32 ee,eee= -0.01562 -0.01802 slater integrals for ag i d10 7h nconf=67 z= 47 ion= 0 exf=0.650 irel= 1 ag i d9 5s8k nconf=76 kut=-1 corrf=0.000 class 0 k rdk( 4d, 7h, 5s, 8k) frac k rek( 4d, 7h, 5s, 8k) frac - ------------------------------------- ----- - ------------------------------------- ----- 2 0.00000878 ryd = 0.9632 cm-1 0.262 5 0.00000000 ryd = 0.0000 cm-1 -1.000 ag i d10 7h -d9 5s8k 2 0.0010 5 0.0000 5 67 76 3 0.070 0.031 841.844 sec sqrtdel= 1.0000 1.0000 0.0010 0.0000 rcn mod 32 ee,eee= -0.01235 -0.01638 slater integrals for ag i d10 7h nconf=67 z= 47 ion= 0 exf=0.650 irel= 1 ag i d9 5s9k nconf=77 kut=-1 corrf=0.000 class 0 k rdk( 4d, 7h, 5s, 9k) frac k rek( 4d, 7h, 5s, 9k) frac - ------------------------------------- ----- - ------------------------------------- ----- 2 -0.00000641 ryd = -0.7038 cm-1 -0.236 5 0.00000000 ryd = 0.0000 cm-1 -1.000 ag i d10 7h -d9 5s9k 2 -0.0007 5 0.0000 5 67 77 1 0.039 0.023 841.930 sec sqrtdel= 1.0000 1.0000 -0.0007 0.0000 rcn mod 32 ee,eee= -1.77810 -0.88905 ee,eee= -1.15547 -1.46678 slater integrals for ag i d10 8h nconf=68 z= 47 ion= 0 exf=0.650 irel= 1 ag i d9 5s6h nconf=70 kut=-1 corrf=0.000 class 0 k rdk( 4d, 4d, 4d, 5s) frac k rek( 4d, 4d, 4d, 5s) frac - ------------------------------------- ----- - ------------------------------------- ----- 2 0.00000000 ryd = 0.0000 cm-1 0.000 2 0.00000000 ryd = 0.0000 cm-1 0.000 ag i d10 8h -d9 5s6h 1 0.0000 5 68 70 29 0.844 0.047 842.820 sec rcn mod 32 ee,eee= -0.01563 -0.00781 ee,eee= -0.02778 -0.02170 slater integrals for ag i d10 8h nconf=68 z= 47 ion= 0 exf=0.650 irel= 1 ag i d9 5s6h nconf=70 kut=-1 corrf=0.000 class 0 k rdk( 4d, 8h, 5s, 6h) frac k rek( 4d, 8h, 5s, 6h) frac - ------------------------------------- ----- - ------------------------------------- ----- 2 -0.00007122 ryd = -7.8160 cm-1 -0.696 5 0.00000000 ryd = -0.0001 cm-1 -1.000 ag i d10 8h -d9 5s6h 2 -0.0078 5 0.0000 5 68 70 29 1.383 0.023 844.227 sec sqrtdel= 1.0000 1.0000 0.0000 -0.0078 0.0000 rcn mod 32 ee,eee= -1.77810 -0.88905 ee,eee= -1.17021 -1.47415 slater integrals for ag i d10 8h nconf=68 z= 47 ion= 0 exf=0.650 irel= 1 ag i d9 5s7h nconf=71 kut=-1 corrf=0.000 class 0 k rdk( 4d, 4d, 4d, 5s) frac k rek( 4d, 4d, 4d, 5s) frac - ------------------------------------- ----- - ------------------------------------- ----- 2 0.00000000 ryd = 0.0000 cm-1 0.000 2 0.00000000 ryd = 0.0000 cm-1 0.000 ag i d10 8h -d9 5s7h 1 0.0000 5 68 71 30 0.969 0.031 845.227 sec rcn mod 32 ee,eee= -0.01563 -0.00781 ee,eee= -0.02041 -0.01802 slater integrals for ag i d10 8h nconf=68 z= 47 ion= 0 exf=0.650 irel= 1 ag i d9 5s7h nconf=71 kut=-1 corrf=0.000 class 0 k rdk( 4d, 8h, 5s, 7h) frac k rek( 4d, 8h, 5s, 7h) frac - ------------------------------------- ----- - ------------------------------------- ----- 2 -0.00007817 ryd = -8.5787 cm-1 -0.872 5 0.00000000 ryd = -0.0001 cm-1 -1.000 ag i d10 8h -d9 5s7h 2 -0.0086 5 0.0000 5 68 71 30 0.773 0.195 846.195 sec sqrtdel= 1.0000 1.0000 0.0000 -0.0086 0.0000 rcn mod 32 ee,eee= -1.77810 -0.88905 ee,eee= -1.17977 -1.47894 slater integrals for ag i d10 8h nconf=68 z= 47 ion= 0 exf=0.650 irel= 1 ag i d9 5s8h nconf=72 kut=-1 corrf=0.000 class 0 k rdk( 4d, 4d, 4d, 5s) frac k rek( 4d, 4d, 4d, 5s) frac - ------------------------------------- ----- - ------------------------------------- ----- 2 -0.13771312 ryd = -15112.2675 cm-1 -0.475 2 -0.13771339 ryd = -15112.2966 cm-1 -0.475 ag i d10 8h -d9 5s8h 1 -15.1123 5 68 72 31 0.914 0.016 847.141 sec rcn mod 32 ee,eee= -0.01563 -0.00781 ee,eee= -0.01563 -0.01563 slater integrals for ag i d10 8h nconf=68 z= 47 ion= 0 exf=0.650 irel= 1 ag i d9 5s8h nconf=72 kut=-1 corrf=0.000 class 0 k rdk( 4d, 8h, 5s, 8h) frac k rek( 4d, 8h, 5s, 8h) frac - ------------------------------------- ----- - ------------------------------------- ----- 2 -0.00007494 ryd = -8.2232 cm-1 -0.961 5 0.00000000 ryd = -0.0001 cm-1 -1.000 ag i d10 8h -d9 5s8h 2 -0.0082 5 0.0000 5 68 72 31 1.641 0.031 848.813 sec sqrtdel= 1.0000 1.0000 -15.1123 -0.0082 0.0000 rcn mod 32 ee,eee= -1.77810 -0.88905 ee,eee= -1.18633 -1.48221 slater integrals for ag i d10 8h nconf=68 z= 47 ion= 0 exf=0.650 irel= 1 ag i d9 5s9h nconf=73 kut=-1 corrf=0.000 class 0 k rdk( 4d, 4d, 4d, 5s) frac k rek( 4d, 4d, 4d, 5s) frac - ------------------------------------- ----- - ------------------------------------- ----- 2 0.00000000 ryd = 0.0000 cm-1 0.000 2 0.00000000 ryd = 0.0000 cm-1 0.000 ag i d10 8h -d9 5s9h 1 0.0000 5 68 73 32 0.859 0.016 849.695 sec rcn mod 32 ee,eee= -0.01563 -0.00781 ee,eee= -0.01235 -0.01399 slater integrals for ag i d10 8h nconf=68 z= 47 ion= 0 exf=0.650 irel= 1 ag i d9 5s9h nconf=73 kut=-1 corrf=0.000 class 0 k rdk( 4d, 8h, 5s, 9h) frac k rek( 4d, 8h, 5s, 9h) frac - ------------------------------------- ----- - ------------------------------------- ----- 2 -0.00005730 ryd = -6.2883 cm-1 -0.909 5 0.00000000 ryd = -0.0001 cm-1 -1.000 ag i d10 8h -d9 5s9h 2 -0.0063 5 0.0000 5 68 73 32 1.297 0.117 851.117 sec sqrtdel= 1.0000 1.0000 0.0000 -0.0063 0.0000 rcn mod 32 ee,eee= -0.01562 -0.01563 slater integrals for ag i d10 8h nconf=68 z= 47 ion= 0 exf=0.650 irel= 1 ag i d9 5s8k nconf=76 kut=-1 corrf=0.000 class 0 k rdk( 4d, 8h, 5s, 8k) frac k rek( 4d, 8h, 5s, 8k) frac - ------------------------------------- ----- - ------------------------------------- ----- 2 0.00000000 ryd = 0.0000 cm-1 0.000 5 0.00000000 ryd = 0.0000 cm-1 -1.000 ag i d10 8h -d9 5s8k 2 0.0000 5 0.0000 5 68 76 3 0.070 0.031 851.227 sec sqrtdel= 1.0000 1.0000 0.0000 0.0000 rcn mod 32 ee,eee= -0.01235 -0.01399 slater integrals for ag i d10 8h nconf=68 z= 47 ion= 0 exf=0.650 irel= 1 ag i d9 5s9k nconf=77 kut=-1 corrf=0.000 class 0 k rdk( 4d, 8h, 5s, 9k) frac k rek( 4d, 8h, 5s, 9k) frac - ------------------------------------- ----- - ------------------------------------- ----- 2 0.00000524 ryd = 0.5747 cm-1 0.224 5 0.00000000 ryd = 0.0000 cm-1 -1.000 ag i d10 8h -d9 5s9k 2 0.0006 5 0.0000 5 68 77 1 0.016 0.023 851.273 sec sqrtdel= 1.0000 1.0000 0.0006 0.0000 rcn mod 32 ee,eee= -1.78466 -0.89233 ee,eee= -1.15547 -1.47006 slater integrals for ag i d10 9h nconf=69 z= 47 ion= 0 exf=0.650 irel= 1 ag i d9 5s6h nconf=70 kut=-1 corrf=0.000 class 0 k rdk( 4d, 4d, 4d, 5s) frac k rek( 4d, 4d, 4d, 5s) frac - ------------------------------------- ----- - ------------------------------------- ----- 2 0.00000000 ryd = 0.0000 cm-1 0.000 2 0.00000000 ryd = 0.0000 cm-1 0.000 ag i d10 9h -d9 5s6h 1 0.0000 5 69 70 29 0.953 0.047 852.281 sec rcn mod 32 ee,eee= -0.01234 -0.00617 ee,eee= -0.02778 -0.02006 slater integrals for ag i d10 9h nconf=69 z= 47 ion= 0 exf=0.650 irel= 1 ag i d9 5s6h nconf=70 kut=-1 corrf=0.000 class 0 k rdk( 4d, 9h, 5s, 6h) frac k rek( 4d, 9h, 5s, 6h) frac - ------------------------------------- ----- - ------------------------------------- ----- 2 -0.00005452 ryd = -5.9830 cm-1 -0.652 5 0.00000000 ryd = -0.0001 cm-1 -1.000 ag i d10 9h -d9 5s6h 2 -0.0060 5 0.0000 5 69 70 29 1.195 0.039 853.516 sec sqrtdel= 1.0000 1.0000 0.0000 -0.0060 0.0000 rcn mod 32 ee,eee= -1.78466 -0.89233 ee,eee= -1.17021 -1.47743 slater integrals for ag i d10 9h nconf=69 z= 47 ion= 0 exf=0.650 irel= 1 ag i d9 5s7h nconf=71 kut=-1 corrf=0.000 class 0 k rdk( 4d, 4d, 4d, 5s) frac k rek( 4d, 4d, 4d, 5s) frac - ------------------------------------- ----- - ------------------------------------- ----- 2 0.00000000 ryd = 0.0000 cm-1 0.000 2 0.00000000 ryd = 0.0000 cm-1 0.000 ag i d10 9h -d9 5s7h 1 0.0000 5 69 71 30 0.789 0.008 854.313 sec rcn mod 32 ee,eee= -0.01234 -0.00617 ee,eee= -0.02041 -0.01638 slater integrals for ag i d10 9h nconf=69 z= 47 ion= 0 exf=0.650 irel= 1 ag i d9 5s7h nconf=71 kut=-1 corrf=0.000 class 0 k rdk( 4d, 9h, 5s, 7h) frac k rek( 4d, 9h, 5s, 7h) frac - ------------------------------------- ----- - ------------------------------------- ----- 2 -0.00006017 ryd = -6.6025 cm-1 -0.829 5 0.00000000 ryd = -0.0001 cm-1 -1.000 ag i d10 9h -d9 5s7h 2 -0.0066 5 0.0000 5 69 71 30 0.813 0.031 855.164 sec sqrtdel= 1.0000 1.0000 0.0000 -0.0066 0.0000 rcn mod 32 ee,eee= -1.78466 -0.89233 ee,eee= -1.17977 -1.48221 slater integrals for ag i d10 9h nconf=69 z= 47 ion= 0 exf=0.650 irel= 1 ag i d9 5s8h nconf=72 kut=-1 corrf=0.000 class 0 k rdk( 4d, 4d, 4d, 5s) frac k rek( 4d, 4d, 4d, 5s) frac - ------------------------------------- ----- - ------------------------------------- ----- 2 0.00000000 ryd = 0.0000 cm-1 0.000 2 0.00000000 ryd = 0.0000 cm-1 0.000 ag i d10 9h -d9 5s8h 1 0.0000 5 69 72 31 1.609 0.031 856.805 sec rcn mod 32 ee,eee= -0.01234 -0.00617 ee,eee= -0.01563 -0.01399 slater integrals for ag i d10 9h nconf=69 z= 47 ion= 0 exf=0.650 irel= 1 ag i d9 5s8h nconf=72 kut=-1 corrf=0.000 class 0 k rdk( 4d, 9h, 5s, 8h) frac k rek( 4d, 9h, 5s, 8h) frac - ------------------------------------- ----- - ------------------------------------- ----- 2 -0.00005730 ryd = -6.2883 cm-1 -0.909 5 0.00000000 ryd = -0.0001 cm-1 -1.000 ag i d10 9h -d9 5s8h 2 -0.0063 5 0.0000 5 69 72 31 0.859 0.031 857.695 sec sqrtdel= 1.0000 1.0000 0.0000 -0.0063 0.0000 rcn mod 32 ee,eee= -1.78466 -0.89233 ee,eee= -1.18633 -1.48549 slater integrals for ag i d10 9h nconf=69 z= 47 ion= 0 exf=0.650 irel= 1 ag i d9 5s9h nconf=73 kut=-1 corrf=0.000 class 0 k rdk( 4d, 4d, 4d, 5s) frac k rek( 4d, 4d, 4d, 5s) frac - ------------------------------------- ----- - ------------------------------------- ----- 2 -0.13771312 ryd = -15112.2675 cm-1 -0.475 2 -0.13771339 ryd = -15112.2966 cm-1 -0.475 ag i d10 9h -d9 5s9h 1 -15.1123 5 69 73 32 1.289 0.016 859.000 sec rcn mod 32 ee,eee= -0.01234 -0.00617 ee,eee= -0.01235 -0.01234 slater integrals for ag i d10 9h nconf=69 z= 47 ion= 0 exf=0.650 irel= 1 ag i d9 5s9h nconf=73 kut=-1 corrf=0.000 class 0 k rdk( 4d, 9h, 5s, 9h) frac k rek( 4d, 9h, 5s, 9h) frac - ------------------------------------- ----- - ------------------------------------- ----- 2 -0.00005263 ryd = -5.7755 cm-1 -0.961 5 0.00000000 ryd = -0.0001 cm-1 -1.000 ag i d10 9h -d9 5s9h 2 -0.0058 5 0.0000 5 69 73 32 1.063 0.031 860.094 sec sqrtdel= 1.0000 1.0000 -15.1123 -0.0058 0.0000 rcn mod 32 ee,eee= -0.01562 -0.01398 slater integrals for ag i d10 9h nconf=69 z= 47 ion= 0 exf=0.650 irel= 1 ag i d9 5s8k nconf=76 kut=-1 corrf=0.000 class 0 k rdk( 4d, 9h, 5s, 8k) frac k rek( 4d, 9h, 5s, 8k) frac - ------------------------------------- ----- - ------------------------------------- ----- 2 -0.00000012 ryd = -0.0127 cm-1 -0.006 5 0.00000000 ryd = 0.0000 cm-1 -1.000 ag i d10 9h -d9 5s8k 2 0.0000 5 0.0000 5 69 76 3 0.328 0.016 860.445 sec sqrtdel= 1.0000 1.0000 0.0000 0.0000 rcn mod 32 ee,eee= -0.01235 -0.01235 slater integrals for ag i d10 9h nconf=69 z= 47 ion= 0 exf=0.650 irel= 1 ag i d9 5s9k nconf=77 kut=-1 corrf=0.000 class 0 k rdk( 4d, 9h, 5s, 9k) frac k rek( 4d, 9h, 5s, 9k) frac - ------------------------------------- ----- - ------------------------------------- ----- 2 0.00000000 ryd = 0.0000 cm-1 0.000 5 0.00000000 ryd = 0.0000 cm-1 -1.000 ag i d10 9h -d9 5s9k 2 0.0000 5 0.0000 5 69 77 1 0.031 0.016 860.500 sec sqrtdel= 1.0000 1.0000 0.0000 0.0000 rcn mod 32 ee,eee= -0.02778 -0.01389 ee,eee= -0.02041 -0.02409 slater integrals for ag i d9 5s6h nconf=70 z= 47 ion= 0 exf=0.650 irel= 1 ag i d9 5s7h nconf=71 kut=-1 corrf=0.000 class 11 k rdk( 4d, 6h, 4d, 7h) frac k rek( 4d, 6h, 4d, 7h) frac - ------------------------------------- ----- - ------------------------------------- ----- 0 0.01224515 ryd = 1343.7497 cm-1 0.341 3 0.00000000 ryd = 0.0000 cm-1 1.000 2 0.00006943 ryd = 7.6186 cm-1 0.806 5 0.00000000 ryd = 0.0000 cm-1 1.000 4 0.00000065 ryd = 0.0711 cm-1 0.963 7 0.00000000 ryd = 0.0000 cm-1 1.000 - ------------------------------------- ----- - ------------------------------------- ----- 0 0.01224515 ryd = 1343.7497 cm-1 0.341 3 0.00000000 ryd = 0.0000 cm-1 1.000 2 0.00006943 ryd = 7.6186 cm-1 0.806 5 0.00000000 ryd = 0.0000 cm-1 1.000 4 0.00000065 ryd = 0.0711 cm-1 0.963 7 0.00000000 ryd = 0.0000 cm-1 1.000 - ------------------------------------- ----- - ------------------------------------- ----- 0 0.01224515 ryd = 1343.7497 cm-1 0.341 3 0.00000000 ryd = 0.0000 cm-1 1.000 2 0.00006943 ryd = 7.6186 cm-1 0.806 5 0.00000000 ryd = 0.0000 cm-1 1.000 4 0.00000065 ryd = 0.0711 cm-1 0.963 7 0.00000000 ryd = 0.0000 cm-1 1.000 - ------------------------------------- ----- - ------------------------------------- ----- 0 0.01224515 ryd = 1343.7497 cm-1 0.341 3 0.00000000 ryd = 0.0000 cm-1 1.000 2 0.00006943 ryd = 7.6186 cm-1 0.806 5 0.00000000 ryd = 0.0000 cm-1 1.000 4 0.00000065 ryd = 0.0711 cm-1 0.963 7 0.00000000 ryd = 0.0000 cm-1 1.000 9.00000 0.00000 2.00000 3.00000 5.00000 0.00000 -0.02409 0.00000 9.00000 0.00000 2.00000 5.00000 5.00000 0.00000 -0.02409 0.00000 9.00000 0.00000 2.00000 7.00000 5.00000 0.00000 -0.02409 0.00000 ag i d9 5s6h -d9 5s7h 6 0.0000 5 0.0076 5 0.0001 5 0.0000 5 0.0000 5 0.0000 5 70 71 30 0.883 0.180 861.563 sec rcn mod 32 ee,eee= -0.02778 -0.01389 ee,eee= -0.02041 -0.02409 slater integrals for ag i d9 5s6h nconf=70 z= 47 ion= 0 exf=0.650 irel= 1 ag i d9 5s7h nconf=71 kut=-1 corrf=0.000 class 11 k rdk( 5s, 6h, 5s, 7h) frac k rek( 5s, 6h, 5s, 7h) frac - ------------------------------------- ----- - ------------------------------------- ----- 0 0.01224515 ryd = 1343.7496 cm-1 0.341 5 0.00000001 ryd = 0.0011 cm-1 1.000 - ------------------------------------- ----- - ------------------------------------- ----- 0 0.01224515 ryd = 1343.7496 cm-1 0.341 5 0.00000001 ryd = 0.0011 cm-1 1.000 - ------------------------------------- ----- - ------------------------------------- ----- 0 0.01224515 ryd = 1343.7496 cm-1 0.341 5 0.00000001 ryd = 0.0011 cm-1 1.000 - ------------------------------------- ----- - ------------------------------------- ----- 0 0.01224515 ryd = 1343.7496 cm-1 0.341 5 0.00000001 ryd = 0.0011 cm-1 1.000 1.00000 0.00000 0.00000 5.00000 5.00000 0.00000 -0.02409 0.00000 ag i d9 5s6h -d9 5s7h 2 0.0000 5 0.0000 5 70 71 30 1.148 0.086 862.797 sec sqrtdel= 1.0000 1.0000 0.0000 0.0076 0.0001 0.0000 0.0000 0.0000 0.0000 0.0000 rcn mod 32 ee,eee= -0.02778 -0.01389 ee,eee= -0.01563 -0.02170 slater integrals for ag i d9 5s6h nconf=70 z= 47 ion= 0 exf=0.650 irel= 1 ag i d9 5s8h nconf=72 kut=-1 corrf=0.000 class 11 k rdk( 4d, 6h, 4d, 8h) frac k rek( 4d, 6h, 4d, 8h) frac - ------------------------------------- ----- - ------------------------------------- ----- 0 0.00663610 ryd = 728.2272 cm-1 0.250 3 0.00000000 ryd = 0.0000 cm-1 1.000 2 0.00004883 ryd = 5.3582 cm-1 0.724 5 0.00000000 ryd = 0.0000 cm-1 1.000 4 0.00000053 ryd = 0.0584 cm-1 0.937 7 0.00000000 ryd = 0.0000 cm-1 1.000 - ------------------------------------- ----- - ------------------------------------- ----- 0 0.00663610 ryd = 728.2272 cm-1 0.250 3 0.00000000 ryd = 0.0000 cm-1 1.000 2 0.00004883 ryd = 5.3582 cm-1 0.724 5 0.00000000 ryd = 0.0000 cm-1 1.000 4 0.00000053 ryd = 0.0584 cm-1 0.937 7 0.00000000 ryd = 0.0000 cm-1 1.000 - ------------------------------------- ----- - ------------------------------------- ----- 0 0.00663610 ryd = 728.2272 cm-1 0.250 3 0.00000000 ryd = 0.0000 cm-1 1.000 2 0.00004883 ryd = 5.3582 cm-1 0.724 5 0.00000000 ryd = 0.0000 cm-1 1.000 4 0.00000053 ryd = 0.0584 cm-1 0.937 7 0.00000000 ryd = 0.0000 cm-1 1.000 - ------------------------------------- ----- - ------------------------------------- ----- 0 0.00663610 ryd = 728.2272 cm-1 0.250 3 0.00000000 ryd = 0.0000 cm-1 1.000 2 0.00004883 ryd = 5.3582 cm-1 0.724 5 0.00000000 ryd = 0.0000 cm-1 1.000 4 0.00000053 ryd = 0.0584 cm-1 0.937 7 0.00000000 ryd = 0.0000 cm-1 1.000 9.00000 0.00000 2.00000 3.00000 5.00000 0.00000 -0.02170 0.00000 9.00000 0.00000 2.00000 5.00000 5.00000 0.00000 -0.02170 0.00000 9.00000 0.00000 2.00000 7.00000 5.00000 0.00000 -0.02170 0.00000 ag i d9 5s6h -d9 5s8h 6 0.0000 5 0.0054 5 0.0001 5 0.0000 5 0.0000 5 0.0000 5 70 72 31 0.836 0.125 863.766 sec rcn mod 32 ee,eee= -0.02778 -0.01389 ee,eee= -0.01563 -0.02170 slater integrals for ag i d9 5s6h nconf=70 z= 47 ion= 0 exf=0.650 irel= 1 ag i d9 5s8h nconf=72 kut=-1 corrf=0.000 class 11 k rdk( 5s, 6h, 5s, 8h) frac k rek( 5s, 6h, 5s, 8h) frac - ------------------------------------- ----- - ------------------------------------- ----- 0 0.00663609 ryd = 728.2272 cm-1 0.250 5 0.00000001 ryd = 0.0011 cm-1 1.000 - ------------------------------------- ----- - ------------------------------------- ----- 0 0.00663609 ryd = 728.2272 cm-1 0.250 5 0.00000001 ryd = 0.0011 cm-1 1.000 - ------------------------------------- ----- - ------------------------------------- ----- 0 0.00663609 ryd = 728.2272 cm-1 0.250 5 0.00000001 ryd = 0.0011 cm-1 1.000 - ------------------------------------- ----- - ------------------------------------- ----- 0 0.00663609 ryd = 728.2272 cm-1 0.250 5 0.00000001 ryd = 0.0011 cm-1 1.000 1.00000 0.00000 0.00000 5.00000 5.00000 0.00000 -0.02170 0.00000 ag i d9 5s6h -d9 5s8h 2 0.0000 5 0.0000 5 70 72 31 1.789 0.063 865.617 sec sqrtdel= 1.0000 1.0000 0.0000 0.0054 0.0001 0.0000 0.0000 0.0000 0.0000 0.0000 rcn mod 32 ee,eee= -0.02778 -0.01389 ee,eee= -0.01235 -0.02006 slater integrals for ag i d9 5s6h nconf=70 z= 47 ion= 0 exf=0.650 irel= 1 ag i d9 5s9h nconf=73 kut=-1 corrf=0.000 class 11 k rdk( 4d, 6h, 4d, 9h) frac k rek( 4d, 6h, 4d, 9h) frac - ------------------------------------- ----- - ------------------------------------- ----- 0 0.00442495 ryd = 485.5822 cm-1 0.209 3 0.00000000 ryd = 0.0000 cm-1 1.000 2 0.00003738 ryd = 4.1016 cm-1 0.678 5 0.00000000 ryd = 0.0000 cm-1 1.000 4 0.00000045 ryd = 0.0489 cm-1 0.920 7 0.00000000 ryd = 0.0000 cm-1 1.000 - ------------------------------------- ----- - ------------------------------------- ----- 0 0.00442495 ryd = 485.5822 cm-1 0.209 3 0.00000000 ryd = 0.0000 cm-1 1.000 2 0.00003738 ryd = 4.1016 cm-1 0.678 5 0.00000000 ryd = 0.0000 cm-1 1.000 4 0.00000045 ryd = 0.0489 cm-1 0.920 7 0.00000000 ryd = 0.0000 cm-1 1.000 - ------------------------------------- ----- - ------------------------------------- ----- 0 0.00442495 ryd = 485.5822 cm-1 0.209 3 0.00000000 ryd = 0.0000 cm-1 1.000 2 0.00003738 ryd = 4.1016 cm-1 0.678 5 0.00000000 ryd = 0.0000 cm-1 1.000 4 0.00000045 ryd = 0.0489 cm-1 0.920 7 0.00000000 ryd = 0.0000 cm-1 1.000 - ------------------------------------- ----- - ------------------------------------- ----- 0 0.00442495 ryd = 485.5822 cm-1 0.209 3 0.00000000 ryd = 0.0000 cm-1 1.000 2 0.00003738 ryd = 4.1016 cm-1 0.678 5 0.00000000 ryd = 0.0000 cm-1 1.000 4 0.00000045 ryd = 0.0489 cm-1 0.920 7 0.00000000 ryd = 0.0000 cm-1 1.000 9.00000 0.00000 2.00000 3.00000 5.00000 0.00000 -0.02006 0.00000 9.00000 0.00000 2.00000 5.00000 5.00000 0.00000 -0.02006 0.00000 9.00000 0.00000 2.00000 7.00000 5.00000 0.00000 -0.02006 0.00000 ag i d9 5s6h -d9 5s9h 6 0.0000 5 0.0041 5 0.0000 5 0.0000 5 0.0000 5 0.0000 5 70 73 32 0.875 0.117 866.664 sec rcn mod 32 ee,eee= -0.02778 -0.01389 ee,eee= -0.01235 -0.02006 slater integrals for ag i d9 5s6h nconf=70 z= 47 ion= 0 exf=0.650 irel= 1 ag i d9 5s9h nconf=73 kut=-1 corrf=0.000 class 11 k rdk( 5s, 6h, 5s, 9h) frac k rek( 5s, 6h, 5s, 9h) frac - ------------------------------------- ----- - ------------------------------------- ----- 0 0.00442495 ryd = 485.5821 cm-1 0.209 5 0.00000001 ryd = 0.0010 cm-1 1.000 - ------------------------------------- ----- - ------------------------------------- ----- 0 0.00442495 ryd = 485.5821 cm-1 0.209 5 0.00000001 ryd = 0.0010 cm-1 1.000 - ------------------------------------- ----- - ------------------------------------- ----- 0 0.00442495 ryd = 485.5821 cm-1 0.209 5 0.00000001 ryd = 0.0010 cm-1 1.000 - ------------------------------------- ----- - ------------------------------------- ----- 0 0.00442495 ryd = 485.5821 cm-1 0.209 5 0.00000001 ryd = 0.0010 cm-1 1.000 1.00000 0.00000 0.00000 5.00000 5.00000 0.00000 -0.02006 0.00000 ag i d9 5s6h -d9 5s9h 2 0.0000 5 0.0000 5 70 73 32 1.359 0.063 868.094 sec sqrtdel= 1.0000 1.0000 0.0000 0.0041 0.0000 0.0000 0.0000 0.0000 0.0000 0.0000 rcn mod 32 ee,eee= -0.01562 -0.02170 slater integrals for ag i d9 5s6h nconf=70 z= 47 ion= 0 exf=0.650 irel= 1 ag i d10 8k nconf=74 kut=-1 corrf=0.000 class 0 k rdk( 5s, 6h, 4d, 8k) frac k rek( 5s, 6h, 4d, 8k) frac - ------------------------------------- ----- - ------------------------------------- ----- 2 -0.00004024 ryd = -4.4160 cm-1 -0.961 7 0.00000000 ryd = 0.0000 cm-1 -1.000 ag i d9 5s6h -d10 8k 2 -0.0044 5 0.0000 5 70 74 1 0.031 0.023 868.156 sec sqrtdel= 1.0000 1.0000 -0.0044 0.0000 rcn mod 32 ee,eee= -0.01235 -0.02006 slater integrals for ag i d9 5s6h nconf=70 z= 47 ion= 0 exf=0.650 irel= 1 ag i d10 9k nconf=75 kut=-1 corrf=0.000 class 0 k rdk( 5s, 6h, 4d, 9k) frac k rek( 5s, 6h, 4d, 9k) frac - ------------------------------------- ----- - ------------------------------------- ----- 2 -0.00004006 ryd = -4.3959 cm-1 -0.952 7 0.00000000 ryd = 0.0000 cm-1 -1.000 ag i d9 5s6h -d10 9k 2 -0.0044 5 0.0000 5 70 75 1 0.016 0.016 868.195 sec sqrtdel= 1.0000 1.0000 -0.0044 0.0000 rcn mod 32 ee,eee= -0.02778 -0.01389 ee,eee= -0.01562 -0.02170 slater integrals for ag i d9 5s6h nconf=70 z= 47 ion= 0 exf=0.650 irel= 1 ag i d9 5s8k nconf=76 kut=-1 corrf=0.000 class 0 k rdk( 4d, 6h, 4d, 8k) frac k rek( 4d, 6h, 4d, 8k) frac - ------------------------------------- ----- - ------------------------------------- ----- 2 0.00002759 ryd = 3.0273 cm-1 1.000 5 0.00000000 ryd = 0.0000 cm-1 1.000 4 0.00000009 ryd = 0.0098 cm-1 1.000 7 0.00000000 ryd = 0.0000 cm-1 1.000 ag i d9 5s6h -d9 5s8k 4 0.0030 5 0.0000 5 0.0000 5 0.0000 5 70 76 35 0.992 0.031 869.234 sec sqrtdel= 1.0000 1.0000 0.0030 0.0000 0.0000 0.0000 rcn mod 32 ee,eee= -0.01235 -0.02006 slater integrals for ag i d9 5s6h nconf=70 z= 47 ion= 0 exf=0.650 irel= 1 ag i d9 5s9k nconf=77 kut=-1 corrf=0.000 class 0 k rdk( 4d, 6h, 4d, 9k) frac k rek( 4d, 6h, 4d, 9k) frac - ------------------------------------- ----- - ------------------------------------- ----- 2 0.00002746 ryd = 3.0136 cm-1 0.990 5 0.00000000 ryd = 0.0000 cm-1 1.000 4 0.00000010 ryd = 0.0111 cm-1 0.998 7 0.00000000 ryd = 0.0000 cm-1 1.000 ag i d9 5s6h -d9 5s9k 4 0.0030 5 0.0000 5 0.0000 5 0.0000 5 70 77 1 0.031 0.023 869.305 sec sqrtdel= 1.0000 1.0000 0.0030 0.0000 0.0000 0.0000 rcn mod 32 ee,eee= -0.02041 -0.01020 ee,eee= -0.01563 -0.01802 slater integrals for ag i d9 5s7h nconf=71 z= 47 ion= 0 exf=0.650 irel= 1 ag i d9 5s8h nconf=72 kut=-1 corrf=0.000 class 11 k rdk( 4d, 7h, 4d, 8h) frac k rek( 4d, 7h, 4d, 8h) frac - ------------------------------------- ----- - ------------------------------------- ----- 0 0.01145266 ryd = 1256.7840 cm-1 0.406 3 0.00000000 ryd = 0.0000 cm-1 1.000 2 0.00005359 ryd = 5.8811 cm-1 0.907 5 0.00000000 ryd = 0.0000 cm-1 1.000 4 0.00000053 ryd = 0.0586 cm-1 0.992 7 0.00000000 ryd = 0.0000 cm-1 1.000 - ------------------------------------- ----- - ------------------------------------- ----- 0 0.01145266 ryd = 1256.7840 cm-1 0.406 3 0.00000000 ryd = 0.0000 cm-1 1.000 2 0.00005359 ryd = 5.8811 cm-1 0.907 5 0.00000000 ryd = 0.0000 cm-1 1.000 4 0.00000053 ryd = 0.0586 cm-1 0.992 7 0.00000000 ryd = 0.0000 cm-1 1.000 - ------------------------------------- ----- - ------------------------------------- ----- 0 0.01145266 ryd = 1256.7840 cm-1 0.406 3 0.00000000 ryd = 0.0000 cm-1 1.000 2 0.00005359 ryd = 5.8811 cm-1 0.907 5 0.00000000 ryd = 0.0000 cm-1 1.000 4 0.00000053 ryd = 0.0586 cm-1 0.992 7 0.00000000 ryd = 0.0000 cm-1 1.000 - ------------------------------------- ----- - ------------------------------------- ----- 0 0.01145266 ryd = 1256.7840 cm-1 0.406 3 0.00000000 ryd = 0.0000 cm-1 1.000 2 0.00005359 ryd = 5.8811 cm-1 0.907 5 0.00000000 ryd = 0.0000 cm-1 1.000 4 0.00000053 ryd = 0.0586 cm-1 0.992 7 0.00000000 ryd = 0.0000 cm-1 1.000 9.00000 0.00000 2.00000 3.00000 5.00000 0.00000 -0.01802 0.00000 9.00000 0.00000 2.00000 5.00000 5.00000 0.00000 -0.01802 0.00000 9.00000 0.00000 2.00000 7.00000 5.00000 0.00000 -0.01802 0.00000 ag i d9 5s7h -d9 5s8h 6 0.0000 5 0.0059 5 0.0001 5 0.0000 5 0.0000 5 0.0000 5 71 72 31 1.180 0.117 870.664 sec rcn mod 32 ee,eee= -0.02041 -0.01020 ee,eee= -0.01563 -0.01802 slater integrals for ag i d9 5s7h nconf=71 z= 47 ion= 0 exf=0.650 irel= 1 ag i d9 5s8h nconf=72 kut=-1 corrf=0.000 class 11 k rdk( 5s, 7h, 5s, 8h) frac k rek( 5s, 7h, 5s, 8h) frac - ------------------------------------- ----- - ------------------------------------- ----- 0 0.01145266 ryd = 1256.7840 cm-1 0.406 5 0.00000001 ryd = 0.0013 cm-1 1.000 - ------------------------------------- ----- - ------------------------------------- ----- 0 0.01145266 ryd = 1256.7840 cm-1 0.406 5 0.00000001 ryd = 0.0013 cm-1 1.000 - ------------------------------------- ----- - ------------------------------------- ----- 0 0.01145266 ryd = 1256.7840 cm-1 0.406 5 0.00000001 ryd = 0.0013 cm-1 1.000 - ------------------------------------- ----- - ------------------------------------- ----- 0 0.01145266 ryd = 1256.7840 cm-1 0.406 5 0.00000001 ryd = 0.0013 cm-1 1.000 1.00000 0.00000 0.00000 5.00000 5.00000 0.00000 -0.01802 0.00000 ag i d9 5s7h -d9 5s8h 2 0.0000 5 0.0000 5 71 72 31 0.813 0.070 871.547 sec sqrtdel= 1.0000 1.0000 0.0000 0.0059 0.0001 0.0000 0.0000 0.0000 0.0000 0.0000 rcn mod 32 ee,eee= -0.02041 -0.01020 ee,eee= -0.01235 -0.01638 slater integrals for ag i d9 5s7h nconf=71 z= 47 ion= 0 exf=0.650 irel= 1 ag i d9 5s9h nconf=73 kut=-1 corrf=0.000 class 11 k rdk( 4d, 7h, 4d, 9h) frac k rek( 4d, 7h, 4d, 9h) frac - ------------------------------------- ----- - ------------------------------------- ----- 0 0.00687431 ryd = 754.3683 cm-1 0.323 3 0.00000000 ryd = 0.0000 cm-1 1.000 2 0.00004125 ryd = 4.5263 cm-1 0.862 5 0.00000000 ryd = 0.0000 cm-1 1.000 4 0.00000046 ryd = 0.0499 cm-1 0.984 7 0.00000000 ryd = 0.0000 cm-1 1.000 - ------------------------------------- ----- - ------------------------------------- ----- 0 0.00687431 ryd = 754.3683 cm-1 0.323 3 0.00000000 ryd = 0.0000 cm-1 1.000 2 0.00004125 ryd = 4.5263 cm-1 0.862 5 0.00000000 ryd = 0.0000 cm-1 1.000 4 0.00000046 ryd = 0.0499 cm-1 0.984 7 0.00000000 ryd = 0.0000 cm-1 1.000 - ------------------------------------- ----- - ------------------------------------- ----- 0 0.00687431 ryd = 754.3683 cm-1 0.323 3 0.00000000 ryd = 0.0000 cm-1 1.000 2 0.00004125 ryd = 4.5263 cm-1 0.862 5 0.00000000 ryd = 0.0000 cm-1 1.000 4 0.00000046 ryd = 0.0499 cm-1 0.984 7 0.00000000 ryd = 0.0000 cm-1 1.000 - ------------------------------------- ----- - ------------------------------------- ----- 0 0.00687431 ryd = 754.3683 cm-1 0.323 3 0.00000000 ryd = 0.0000 cm-1 1.000 2 0.00004125 ryd = 4.5263 cm-1 0.862 5 0.00000000 ryd = 0.0000 cm-1 1.000 4 0.00000046 ryd = 0.0499 cm-1 0.984 7 0.00000000 ryd = 0.0000 cm-1 1.000 9.00000 0.00000 2.00000 3.00000 5.00000 0.00000 -0.01638 0.00000 9.00000 0.00000 2.00000 5.00000 5.00000 0.00000 -0.01638 0.00000 9.00000 0.00000 2.00000 7.00000 5.00000 0.00000 -0.01638 0.00000 ag i d9 5s7h -d9 5s9h 6 0.0000 5 0.0045 5 0.0000 5 0.0000 5 0.0000 5 0.0000 5 71 73 32 1.836 0.125 873.516 sec rcn mod 32 ee,eee= -0.02041 -0.01020 ee,eee= -0.01235 -0.01638 slater integrals for ag i d9 5s7h nconf=71 z= 47 ion= 0 exf=0.650 irel= 1 ag i d9 5s9h nconf=73 kut=-1 corrf=0.000 class 11 k rdk( 5s, 7h, 5s, 9h) frac k rek( 5s, 7h, 5s, 9h) frac - ------------------------------------- ----- - ------------------------------------- ----- 0 0.00687431 ryd = 754.3682 cm-1 0.323 5 0.00000001 ryd = 0.0012 cm-1 1.000 - ------------------------------------- ----- - ------------------------------------- ----- 0 0.00687431 ryd = 754.3682 cm-1 0.323 5 0.00000001 ryd = 0.0012 cm-1 1.000 - ------------------------------------- ----- - ------------------------------------- ----- 0 0.00687431 ryd = 754.3682 cm-1 0.323 5 0.00000001 ryd = 0.0012 cm-1 1.000 - ------------------------------------- ----- - ------------------------------------- ----- 0 0.00687431 ryd = 754.3682 cm-1 0.323 5 0.00000001 ryd = 0.0012 cm-1 1.000 1.00000 0.00000 0.00000 5.00000 5.00000 0.00000 -0.01638 0.00000 ag i d9 5s7h -d9 5s9h 2 0.0000 5 0.0000 5 71 73 32 0.828 0.367 874.711 sec sqrtdel= 1.0000 1.0000 0.0000 0.0045 0.0000 0.0000 0.0000 0.0000 0.0000 0.0000 rcn mod 32 ee,eee= -0.01562 -0.01802 slater integrals for ag i d9 5s7h nconf=71 z= 47 ion= 0 exf=0.650 irel= 1 ag i d10 8k nconf=74 kut=-1 corrf=0.000 class 0 k rdk( 5s, 7h, 4d, 8k) frac k rek( 5s, 7h, 4d, 8k) frac - ------------------------------------- ----- - ------------------------------------- ----- 2 0.00000878 ryd = 0.9632 cm-1 0.262 7 0.00000000 ryd = 0.0000 cm-1 -1.000 ag i d9 5s7h -d10 8k 2 0.0010 5 0.0000 5 71 74 1 0.031 0.031 874.773 sec sqrtdel= 1.0000 1.0000 0.0010 0.0000 rcn mod 32 ee,eee= -0.01235 -0.01638 slater integrals for ag i d9 5s7h nconf=71 z= 47 ion= 0 exf=0.650 irel= 1 ag i d10 9k nconf=75 kut=-1 corrf=0.000 class 0 k rdk( 5s, 7h, 4d, 9k) frac k rek( 5s, 7h, 4d, 9k) frac - ------------------------------------- ----- - ------------------------------------- ----- 2 -0.00000641 ryd = -0.7038 cm-1 -0.236 7 0.00000000 ryd = 0.0000 cm-1 -1.000 ag i d9 5s7h -d10 9k 2 -0.0007 5 0.0000 5 71 75 1 0.023 0.023 874.820 sec sqrtdel= 1.0000 1.0000 -0.0007 0.0000 rcn mod 32 ee,eee= -0.02041 -0.01020 ee,eee= -0.01562 -0.01802 slater integrals for ag i d9 5s7h nconf=71 z= 47 ion= 0 exf=0.650 irel= 1 ag i d9 5s8k nconf=76 kut=-1 corrf=0.000 class 0 k rdk( 4d, 7h, 4d, 8k) frac k rek( 4d, 7h, 4d, 8k) frac - ------------------------------------- ----- - ------------------------------------- ----- 2 -0.00000602 ryd = -0.6603 cm-1 -0.273 5 0.00000000 ryd = 0.0000 cm-1 1.000 4 0.00000003 ryd = 0.0030 cm-1 0.448 7 0.00000000 ryd = 0.0000 cm-1 1.000 ag i d9 5s7h -d9 5s8k 4 -0.0007 5 0.0000 5 0.0000 5 0.0000 5 71 76 35 0.961 0.023 875.820 sec sqrtdel= 1.0000 1.0000 -0.0007 0.0000 0.0000 0.0000 rcn mod 32 ee,eee= -0.01235 -0.01638 slater integrals for ag i d9 5s7h nconf=71 z= 47 ion= 0 exf=0.650 irel= 1 ag i d9 5s9k nconf=77 kut=-1 corrf=0.000 class 0 k rdk( 4d, 7h, 4d, 9k) frac k rek( 4d, 7h, 4d, 9k) frac - ------------------------------------- ----- - ------------------------------------- ----- 2 0.00000440 ryd = 0.4824 cm-1 0.245 5 0.00000000 ryd = 0.0000 cm-1 1.000 4 0.00000005 ryd = 0.0051 cm-1 0.701 7 0.00000000 ryd = 0.0000 cm-1 1.000 ag i d9 5s7h -d9 5s9k 4 0.0005 5 0.0000 5 0.0000 5 0.0000 5 71 77 1 0.070 0.031 875.953 sec sqrtdel= 1.0000 1.0000 0.0005 0.0000 0.0000 0.0000 rcn mod 32 ee,eee= -0.01563 -0.00781 ee,eee= -0.01235 -0.01399 slater integrals for ag i d9 5s8h nconf=72 z= 47 ion= 0 exf=0.650 irel= 1 ag i d9 5s9h nconf=73 kut=-1 corrf=0.000 class 11 k rdk( 4d, 8h, 4d, 9h) frac k rek( 4d, 8h, 4d, 9h) frac - ------------------------------------- ----- - ------------------------------------- ----- 0 0.00983823 ryd = 1079.6208 cm-1 0.437 3 0.00000000 ryd = 0.0000 cm-1 1.000 2 0.00003928 ryd = 4.3109 cm-1 0.946 5 0.00000000 ryd = 0.0000 cm-1 1.000 4 0.00000041 ryd = 0.0452 cm-1 0.998 7 0.00000000 ryd = 0.0000 cm-1 1.000 - ------------------------------------- ----- - ------------------------------------- ----- 0 0.00983823 ryd = 1079.6208 cm-1 0.437 3 0.00000000 ryd = 0.0000 cm-1 1.000 2 0.00003928 ryd = 4.3109 cm-1 0.946 5 0.00000000 ryd = 0.0000 cm-1 1.000 4 0.00000041 ryd = 0.0452 cm-1 0.998 7 0.00000000 ryd = 0.0000 cm-1 1.000 - ------------------------------------- ----- - ------------------------------------- ----- 0 0.00983823 ryd = 1079.6208 cm-1 0.437 3 0.00000000 ryd = 0.0000 cm-1 1.000 2 0.00003928 ryd = 4.3109 cm-1 0.946 5 0.00000000 ryd = 0.0000 cm-1 1.000 4 0.00000041 ryd = 0.0452 cm-1 0.998 7 0.00000000 ryd = 0.0000 cm-1 1.000 - ------------------------------------- ----- - ------------------------------------- ----- 0 0.00983823 ryd = 1079.6208 cm-1 0.437 3 0.00000000 ryd = 0.0000 cm-1 1.000 2 0.00003928 ryd = 4.3109 cm-1 0.946 5 0.00000000 ryd = 0.0000 cm-1 1.000 4 0.00000041 ryd = 0.0452 cm-1 0.998 7 0.00000000 ryd = 0.0000 cm-1 1.000 9.00000 0.00000 2.00000 3.00000 5.00000 0.00000 -0.01399 0.00000 9.00000 0.00000 2.00000 5.00000 5.00000 0.00000 -0.01399 0.00000 9.00000 0.00000 2.00000 7.00000 5.00000 0.00000 -0.01399 0.00000 ag i d9 5s8h -d9 5s9h 6 0.0000 5 0.0043 5 0.0000 5 0.0000 5 0.0000 5 0.0000 5 72 73 32 1.297 0.109 877.383 sec rcn mod 32 ee,eee= -0.01563 -0.00781 ee,eee= -0.01235 -0.01399 slater integrals for ag i d9 5s8h nconf=72 z= 47 ion= 0 exf=0.650 irel= 1 ag i d9 5s9h nconf=73 kut=-1 corrf=0.000 class 11 k rdk( 5s, 8h, 5s, 9h) frac k rek( 5s, 8h, 5s, 9h) frac - ------------------------------------- ----- - ------------------------------------- ----- 0 0.00983823 ryd = 1079.6208 cm-1 0.437 5 0.00000001 ryd = 0.0012 cm-1 1.000 - ------------------------------------- ----- - ------------------------------------- ----- 0 0.00983823 ryd = 1079.6208 cm-1 0.437 5 0.00000001 ryd = 0.0012 cm-1 1.000 - ------------------------------------- ----- - ------------------------------------- ----- 0 0.00983823 ryd = 1079.6208 cm-1 0.437 5 0.00000001 ryd = 0.0012 cm-1 1.000 - ------------------------------------- ----- - ------------------------------------- ----- 0 0.00983823 ryd = 1079.6208 cm-1 0.437 5 0.00000001 ryd = 0.0012 cm-1 1.000 1.00000 0.00000 0.00000 5.00000 5.00000 0.00000 -0.01399 0.00000 ag i d9 5s8h -d9 5s9h 2 0.0000 5 0.0000 5 72 73 32 0.883 0.109 878.375 sec sqrtdel= 1.0000 1.0000 0.0000 0.0043 0.0000 0.0000 0.0000 0.0000 0.0000 0.0000 rcn mod 32 ee,eee= -0.01562 -0.01563 slater integrals for ag i d9 5s8h nconf=72 z= 47 ion= 0 exf=0.650 irel= 1 ag i d10 8k nconf=74 kut=-1 corrf=0.000 class 0 k rdk( 5s, 8h, 4d, 8k) frac k rek( 5s, 8h, 4d, 8k) frac - ------------------------------------- ----- - ------------------------------------- ----- 2 0.00000000 ryd = 0.0000 cm-1 0.000 7 0.00000000 ryd = 0.0000 cm-1 -1.000 ag i d9 5s8h -d10 8k 2 0.0000 5 0.0000 5 72 74 1 0.023 0.055 878.484 sec sqrtdel= 1.0000 1.0000 0.0000 0.0000 rcn mod 32 ee,eee= -0.01235 -0.01399 slater integrals for ag i d9 5s8h nconf=72 z= 47 ion= 0 exf=0.650 irel= 1 ag i d10 9k nconf=75 kut=-1 corrf=0.000 class 0 k rdk( 5s, 8h, 4d, 9k) frac k rek( 5s, 8h, 4d, 9k) frac - ------------------------------------- ----- - ------------------------------------- ----- 2 0.00000524 ryd = 0.5747 cm-1 0.224 7 0.00000000 ryd = 0.0000 cm-1 -1.000 ag i d9 5s8h -d10 9k 2 0.0006 5 0.0000 5 72 75 1 0.023 0.023 878.547 sec sqrtdel= 1.0000 1.0000 0.0006 0.0000 rcn mod 32 ee,eee= -0.01563 -0.00781 ee,eee= -0.01562 -0.01563 slater integrals for ag i d9 5s8h nconf=72 z= 47 ion= 0 exf=0.650 irel= 1 ag i d9 5s8k nconf=76 kut=-1 corrf=0.000 class 0 k rdk( 4d, 8h, 4d, 8k) frac k rek( 4d, 8h, 4d, 8k) frac - ------------------------------------- ----- - ------------------------------------- ----- 2 0.00000000 ryd = 0.0000 cm-1 0.000 5 0.00000000 ryd = 0.0000 cm-1 1.000 4 0.00000002 ryd = 0.0021 cm-1 0.411 7 0.00000000 ryd = 0.0000 cm-1 1.000 ag i d9 5s8h -d9 5s8k 4 0.0000 5 0.0000 5 0.0000 5 0.0000 5 72 76 35 1.414 0.031 879.992 sec sqrtdel= 1.0000 1.0000 0.0000 0.0000 0.0000 0.0000 rcn mod 32 ee,eee= -0.01235 -0.01399 slater integrals for ag i d9 5s8h nconf=72 z= 47 ion= 0 exf=0.650 irel= 1 ag i d9 5s9k nconf=77 kut=-1 corrf=0.000 class 0 k rdk( 4d, 8h, 4d, 9k) frac k rek( 4d, 8h, 4d, 9k) frac - ------------------------------------- ----- - ------------------------------------- ----- 2 -0.00000359 ryd = -0.3940 cm-1 -0.233 5 0.00000000 ryd = 0.0000 cm-1 1.000 4 0.00000003 ryd = 0.0029 cm-1 0.499 7 0.00000000 ryd = 0.0000 cm-1 1.000 ag i d9 5s8h -d9 5s9k 4 -0.0004 5 0.0000 5 0.0000 5 0.0000 5 72 77 1 0.023 0.039 880.063 sec sqrtdel= 1.0000 1.0000 -0.0004 0.0000 0.0000 0.0000 rcn mod 32 ee,eee= -0.01235 -0.00617 ee,eee= -0.01562 -0.01398 slater integrals for ag i d9 5s9h nconf=73 z= 47 ion= 0 exf=0.650 irel= 1 ag i d10 8k nconf=74 kut=-1 corrf=0.000 class 0 k rdk( 5s, 9h, 4d, 8k) frac k rek( 5s, 9h, 4d, 8k) frac - ------------------------------------- ----- - ------------------------------------- ----- 2 -0.00000012 ryd = -0.0127 cm-1 -0.006 7 0.00000000 ryd = 0.0000 cm-1 -1.000 ag i d9 5s9h -d10 8k 2 0.0000 5 0.0000 5 73 74 33 1.703 0.023 881.797 sec sqrtdel= 1.0000 1.0000 0.0000 0.0000 rcn mod 32 ee,eee= -0.01235 -0.01235 slater integrals for ag i d9 5s9h nconf=73 z= 47 ion= 0 exf=0.650 irel= 1 ag i d10 9k nconf=75 kut=-1 corrf=0.000 class 0 k rdk( 5s, 9h, 4d, 9k) frac k rek( 5s, 9h, 4d, 9k) frac - ------------------------------------- ----- - ------------------------------------- ----- 2 0.00000000 ryd = 0.0000 cm-1 0.000 7 0.00000000 ryd = 0.0000 cm-1 -1.000 ag i d9 5s9h -d10 9k 2 0.0000 5 0.0000 5 73 75 1 0.016 0.023 881.844 sec sqrtdel= 1.0000 1.0000 0.0000 0.0000 rcn mod 32 ee,eee= -0.01235 -0.00617 ee,eee= -0.01562 -0.01398 slater integrals for ag i d9 5s9h nconf=73 z= 47 ion= 0 exf=0.650 irel= 1 ag i d9 5s8k nconf=76 kut=-1 corrf=0.000 class 0 k rdk( 4d, 9h, 4d, 8k) frac k rek( 4d, 9h, 4d, 8k) frac - ------------------------------------- ----- - ------------------------------------- ----- 2 0.00000008 ryd = 0.0087 cm-1 0.006 5 0.00000000 ryd = 0.0000 cm-1 1.000 4 0.00000001 ryd = 0.0015 cm-1 0.380 7 0.00000000 ryd = 0.0000 cm-1 1.000 ag i d9 5s9h -d9 5s8k 4 0.0000 5 0.0000 5 0.0000 5 0.0000 5 73 76 35 0.898 0.039 882.805 sec sqrtdel= 1.0000 1.0000 0.0000 0.0000 0.0000 0.0000 rcn mod 32 ee,eee= -0.01235 -0.01235 slater integrals for ag i d9 5s9h nconf=73 z= 47 ion= 0 exf=0.650 irel= 1 ag i d9 5s9k nconf=77 kut=-1 corrf=0.000 class 0 k rdk( 4d, 9h, 4d, 9k) frac k rek( 4d, 9h, 4d, 9k) frac - ------------------------------------- ----- - ------------------------------------- ----- 2 0.00000000 ryd = 0.0000 cm-1 0.000 5 0.00000000 ryd = 0.0000 cm-1 1.000 4 0.00000002 ryd = 0.0021 cm-1 0.468 7 0.00000000 ryd = 0.0000 cm-1 1.000 ag i d9 5s9h -d9 5s9k 4 0.0000 5 0.0000 5 0.0000 5 0.0000 5 73 77 1 0.023 0.039 882.875 sec sqrtdel= 1.0000 1.0000 0.0000 0.0000 0.0000 0.0000 rcn mod 32 ee,eee= -1.77810 -0.88905 ee,eee= -1.17977 -1.47894 slater integrals for ag i d10 8k nconf=74 z= 47 ion= 0 exf=0.650 irel= 1 ag i d9 5s8k nconf=76 kut=-1 corrf=0.000 class 0 k rdk( 4d, 4d, 4d, 5s) frac k rek( 4d, 4d, 4d, 5s) frac - ------------------------------------- ----- - ------------------------------------- ----- 2 -0.13771312 ryd = -15112.2670 cm-1 -0.475 2 -0.13771338 ryd = -15112.2960 cm-1 -0.475 ag i d10 8k -d9 5s8k 1 -15.1123 5 74 76 35 1.461 0.055 884.391 sec rcn mod 32 ee,eee= -0.01562 -0.00781 ee,eee= -0.01562 -0.01562 slater integrals for ag i d10 8k nconf=74 z= 47 ion= 0 exf=0.650 irel= 1 ag i d9 5s8k nconf=76 kut=-1 corrf=0.000 class 0 k rdk( 4d, 8k, 5s, 8k) frac k rek( 4d, 8k, 5s, 8k) frac - ------------------------------------- ----- - ------------------------------------- ----- 2 -0.00002944 ryd = -3.2305 cm-1 -0.961 7 0.00000000 ryd = 0.0000 cm-1 -1.000 ag i d10 8k -d9 5s8k 2 -0.0032 5 0.0000 5 74 76 35 0.984 0.008 885.383 sec sqrtdel= 1.0000 1.0000 -15.1123 -0.0032 0.0000 rcn mod 32 ee,eee= -1.77810 -0.88905 ee,eee= -1.18633 -1.48221 slater integrals for ag i d10 8k nconf=74 z= 47 ion= 0 exf=0.650 irel= 1 ag i d9 5s9k nconf=77 kut=-1 corrf=0.000 class 0 k rdk( 4d, 4d, 4d, 5s) frac k rek( 4d, 4d, 4d, 5s) frac - ------------------------------------- ----- - ------------------------------------- ----- 2 0.00000000 ryd = 0.0000 cm-1 0.000 2 0.00000000 ryd = 0.0000 cm-1 0.000 ag i d10 8k -d9 5s9k 1 0.0000 5 74 77 36 1.477 0.016 886.922 sec rcn mod 32 ee,eee= -0.01562 -0.00781 ee,eee= -0.01235 -0.01399 slater integrals for ag i d10 8k nconf=74 z= 47 ion= 0 exf=0.650 irel= 1 ag i d9 5s9k nconf=77 kut=-1 corrf=0.000 class 0 k rdk( 4d, 8k, 5s, 9k) frac k rek( 4d, 8k, 5s, 9k) frac - ------------------------------------- ----- - ------------------------------------- ----- 2 -0.00001603 ryd = -1.7586 cm-1 -0.715 7 0.00000000 ryd = 0.0000 cm-1 -1.000 ag i d10 8k -d9 5s9k 2 -0.0018 5 0.0000 5 74 77 36 1.000 0.023 887.945 sec sqrtdel= 1.0000 1.0000 0.0000 -0.0018 0.0000 rcn mod 32 ee,eee= -1.78466 -0.89233 ee,eee= -1.17977 -1.48221 slater integrals for ag i d10 9k nconf=75 z= 47 ion= 0 exf=0.650 irel= 1 ag i d9 5s8k nconf=76 kut=-1 corrf=0.000 class 0 k rdk( 4d, 4d, 4d, 5s) frac k rek( 4d, 4d, 4d, 5s) frac - ------------------------------------- ----- - ------------------------------------- ----- 2 0.00000000 ryd = 0.0000 cm-1 0.000 2 0.00000000 ryd = 0.0000 cm-1 0.000 ag i d10 9k -d9 5s8k 1 0.0000 5 75 76 35 1.609 0.023 889.594 sec rcn mod 32 ee,eee= -0.01235 -0.00617 ee,eee= -0.01562 -0.01399 slater integrals for ag i d10 9k nconf=75 z= 47 ion= 0 exf=0.650 irel= 1 ag i d9 5s8k nconf=76 kut=-1 corrf=0.000 class 0 k rdk( 4d, 9k, 5s, 8k) frac k rek( 4d, 9k, 5s, 8k) frac - ------------------------------------- ----- - ------------------------------------- ----- 2 -0.00001603 ryd = -1.7586 cm-1 -0.715 7 0.00000000 ryd = 0.0000 cm-1 -1.000 ag i d10 9k -d9 5s8k 2 -0.0018 5 0.0000 5 75 76 35 1.023 0.039 890.656 sec sqrtdel= 1.0000 1.0000 0.0000 -0.0018 0.0000 rcn mod 32 ee,eee= -1.78466 -0.89233 ee,eee= -1.18633 -1.48549 slater integrals for ag i d10 9k nconf=75 z= 47 ion= 0 exf=0.650 irel= 1 ag i d9 5s9k nconf=77 kut=-1 corrf=0.000 class 0 k rdk( 4d, 4d, 4d, 5s) frac k rek( 4d, 4d, 4d, 5s) frac - ------------------------------------- ----- - ------------------------------------- ----- 2 -0.13771312 ryd = -15112.2675 cm-1 -0.475 2 -0.13771339 ryd = -15112.2966 cm-1 -0.475 ag i d10 9k -d9 5s9k 1 -15.1123 5 75 77 36 1.211 0.016 891.883 sec rcn mod 32 ee,eee= -0.01235 -0.00617 ee,eee= -0.01235 -0.01235 slater integrals for ag i d10 9k nconf=75 z= 47 ion= 0 exf=0.650 irel= 1 ag i d9 5s9k nconf=77 kut=-1 corrf=0.000 class 0 k rdk( 4d, 9k, 5s, 9k) frac k rek( 4d, 9k, 5s, 9k) frac - ------------------------------------- ----- - ------------------------------------- ----- 2 -0.00002068 ryd = -2.2689 cm-1 -0.961 7 0.00000000 ryd = 0.0000 cm-1 -1.000 ag i d10 9k -d9 5s9k 2 -0.0023 5 0.0000 5 75 77 36 1.219 0.070 893.172 sec sqrtdel= 1.0000 1.0000 -15.1123 -0.0023 0.0000 rcn mod 32 ee,eee= -0.01562 -0.00781 ee,eee= -0.01235 -0.01399 slater integrals for ag i d9 5s8k nconf=76 z= 47 ion= 0 exf=0.650 irel= 1 ag i d9 5s9k nconf=77 kut=-1 corrf=0.000 class 11 k rdk( 4d, 8k, 4d, 9k) frac k rek( 4d, 8k, 4d, 9k) frac - ------------------------------------- ----- - ------------------------------------- ----- 0 0.00635720 ryd = 697.6223 cm-1 0.300 5 0.00000000 ryd = 0.0000 cm-1 1.000 2 0.00001099 ryd = 1.2056 cm-1 0.744 7 0.00000000 ryd = 0.0000 cm-1 1.000 4 0.00000003 ryd = 0.0030 cm-1 0.933 9 0.00000000 ryd = 0.0000 cm-1 1.000 - ------------------------------------- ----- - ------------------------------------- ----- 0 0.00635720 ryd = 697.6223 cm-1 0.300 5 0.00000000 ryd = 0.0000 cm-1 1.000 2 0.00001099 ryd = 1.2056 cm-1 0.744 7 0.00000000 ryd = 0.0000 cm-1 1.000 4 0.00000003 ryd = 0.0030 cm-1 0.933 9 0.00000000 ryd = 0.0000 cm-1 1.000 - ------------------------------------- ----- - ------------------------------------- ----- 0 0.00635720 ryd = 697.6223 cm-1 0.300 5 0.00000000 ryd = 0.0000 cm-1 1.000 2 0.00001099 ryd = 1.2056 cm-1 0.744 7 0.00000000 ryd = 0.0000 cm-1 1.000 4 0.00000003 ryd = 0.0030 cm-1 0.933 9 0.00000000 ryd = 0.0000 cm-1 1.000 - ------------------------------------- ----- - ------------------------------------- ----- 0 0.00635720 ryd = 697.6223 cm-1 0.300 5 0.00000000 ryd = 0.0000 cm-1 1.000 2 0.00001099 ryd = 1.2056 cm-1 0.744 7 0.00000000 ryd = 0.0000 cm-1 1.000 4 0.00000003 ryd = 0.0030 cm-1 0.933 9 0.00000000 ryd = 0.0000 cm-1 1.000 9.00000 0.00000 2.00000 5.00000 7.00000 0.00000 -0.01399 0.00000 9.00000 0.00000 2.00000 7.00000 7.00000 0.00000 -0.01399 0.00000 9.00000 0.00000 2.00000 9.00000 7.00000 0.00000 -0.01399 0.00000 ag i d9 5s8k -d9 5s9k 6 0.0000 5 0.0012 5 0.0000 5 0.0000 5 0.0000 5 0.0000 5 76 77 36 1.391 0.172 894.734 sec rcn mod 32 ee,eee= -0.01562 -0.00781 ee,eee= -0.01235 -0.01399 slater integrals for ag i d9 5s8k nconf=76 z= 47 ion= 0 exf=0.650 irel= 1 ag i d9 5s9k nconf=77 kut=-1 corrf=0.000 class 11 k rdk( 5s, 8k, 5s, 9k) frac k rek( 5s, 8k, 5s, 9k) frac - ------------------------------------- ----- - ------------------------------------- ----- 0 0.00635720 ryd = 697.6223 cm-1 0.300 7 0.00000000 ryd = 0.0000 cm-1 1.000 - ------------------------------------- ----- - ------------------------------------- ----- 0 0.00635720 ryd = 697.6223 cm-1 0.300 7 0.00000000 ryd = 0.0000 cm-1 1.000 - ------------------------------------- ----- - ------------------------------------- ----- 0 0.00635720 ryd = 697.6223 cm-1 0.300 7 0.00000000 ryd = 0.0000 cm-1 1.000 - ------------------------------------- ----- - ------------------------------------- ----- 0 0.00635720 ryd = 697.6223 cm-1 0.300 7 0.00000000 ryd = 0.0000 cm-1 1.000 1.00000 0.00000 0.00000 7.00000 7.00000 0.00000 -0.01399 0.00000 ag i d9 5s8k -d9 5s9k 2 0.0000 5 0.0000 5 76 77 36 1.297 0.070 896.102 sec sqrtdel= 1.0000 1.0000 0.0000 0.0012 0.0000 0.0000 0.0000 0.0000 0.0000 0.0000 z kut ca1 ca0 conf1 conf2 r integral reduced mupole element frac sigma sq over fr1 --- --- ---- ---- ------------------- ------------------- ---------- ---------------------------- ------ --------- ----- ----- 47 -1 0.70 0.50 ag i d10 5p ag i d10 5p 2.796E+01 ( 5p//r2// 5p)=-3.063E+01 a0 1.0000 2.606E+02 1.000 1.000 sqrtdel= 1.0000 -3.063E+01 47 -1 0.70 0.50 ag i d10 5p ag i d10 6p -2.321E+01 ( 5p//r2// 6p)= 2.542E+01 a0 -0.7979 1.795E+02-0.020-0.041 sqrtdel= 1.0000 2.542E+01 47 -1 0.70 0.50 ag i d10 5p ag i d10 7p -7.532E+00 ( 5p//r2// 7p)= 8.251E+00 a0 -0.4936 1.891E+01-0.013-0.045 sqrtdel= 1.0000 8.251E+00 47 -1 0.70 0.50 ag i d10 5p ag i d10 8p -4.155E+00 ( 5p//r2// 8p)= 4.551E+00 a0 -0.4019 5.754E+00-0.009-0.047 sqrtdel= 1.0000 4.551E+00 47 -1 0.70 0.50 ag i d10 5p ag i d10 9p -2.776E+00 ( 5p//r2// 9p)= 3.041E+00 a0 -0.3620 2.569E+00-0.007-0.049 sqrtdel= 1.0000 3.041E+00 47 -1 0.70 0.50 ag i d10 5p ag i d9 5s5p -3.295E+00 ( 4d//r2// 5s)=-3.295E+00 a0 -0.9650 7.239E-01-0.443-0.687 sqrtdel= 1.0000 -3.295E+00 47 -1 0.70 0.50 ag i d10 5p ag i d9 5s6p 0.000E+00 ( //r2// )= 0.000E+00 a0 0.0000 0.000E+00 0.000 0.000 sqrtdel= 1.0000 0.000E+00 47 -1 0.70 0.50 ag i d10 5p ag i d9 5s7p 0.000E+00 ( //r2// )= 0.000E+00 a0 0.0000 0.000E+00 0.000 0.000 sqrtdel= 1.0000 0.000E+00 47 -1 0.70 0.50 ag i d10 5p ag i d9 5s8p 0.000E+00 ( //r2// )= 0.000E+00 a0 0.0000 0.000E+00 0.000 0.000 sqrtdel= 1.0000 0.000E+00 47 -1 0.70 0.50 ag i d10 5p ag i d9 5s9p 0.000E+00 ( //r2// )= 0.000E+00 a0 0.0000 0.000E+00 0.000 0.000 sqrtdel= 1.0000 0.000E+00 47 -1 0.70 0.50 ag i d10 5p ag i d8 5s2 5p 0.000E+00 ( //r2// )= 0.000E+00 a0 0.0000 0.000E+00 0.000 0.000 sqrtdel= 1.0000 0.000E+00 47 -1 0.70 0.50 ag i d10 5p ag i d10 4f -2.076E+01 ( 5p//r2// 4f)=-2.785E+01 a0 -1.0000 1.231E+01-0.223-1.000 sqrtdel= 1.0000 -2.785E+01 47 -1 0.70 0.50 ag i d10 5p ag i d10 5f -1.324E+01 ( 5p//r2// 5f)=-1.776E+01 a0 -0.9661 5.007E+00-0.171-0.995 sqrtdel= 1.0000 -1.776E+01 47 -1 0.70 0.50 ag i d10 5p ag i d10 6f -9.348E+00 ( 5p//r2// 6f)=-1.254E+01 a0 -0.9295 2.497E+00-0.133-0.989 sqrtdel= 1.0000 -1.254E+01 47 -1 0.70 0.50 ag i d10 5p ag i d10 7f -7.080E+00 ( 5p//r2// 7f)=-9.498E+00 a0 -0.9044 1.432E+00-0.106-0.984 sqrtdel= 1.0000 -9.498E+00 47 -1 0.70 0.50 ag i d10 5p ag i d10 8f -5.619E+00 ( 5p//r2// 8f)=-7.539E+00 a0 -0.8877 9.022E-01-0.087-0.980 sqrtdel= 1.0000 -7.539E+00 47 -1 0.70 0.50 ag i d10 5p ag i d10 9f -4.611E+00 ( 5p//r2// 9f)=-6.186E+00 a0 -0.8756 6.074E-01-0.073-0.978 sqrtdel= 1.0000 -6.186E+00 47 -1 0.70 0.50 ag i d10 5p ag i d9 5s4f 0.000E+00 ( //r2// )= 0.000E+00 a0 0.0000 0.000E+00 0.000 0.000 sqrtdel= 1.0000 0.000E+00 47 -1 0.70 0.50 ag i d10 5p ag i d9 5s5f 0.000E+00 ( //r2// )= 0.000E+00 a0 0.0000 0.000E+00 0.000 0.000 sqrtdel= 1.0000 0.000E+00 47 -1 0.70 0.50 ag i d10 5p ag i d9 5s6f 0.000E+00 ( //r2// )= 0.000E+00 a0 0.0000 0.000E+00 0.000 0.000 sqrtdel= 1.0000 0.000E+00 47 -1 0.70 0.50 ag i d10 5p ag i d9 5s7f 0.000E+00 ( //r2// )= 0.000E+00 a0 0.0000 0.000E+00 0.000 0.000 sqrtdel= 1.0000 0.000E+00 47 -1 0.70 0.50 ag i d10 5p ag i d9 5s8f 0.000E+00 ( //r2// )= 0.000E+00 a0 0.0000 0.000E+00 0.000 0.000 sqrtdel= 1.0000 0.000E+00 47 -1 0.70 0.50 ag i d10 5p ag i d9 5s9f 0.000E+00 ( //r2// )= 0.000E+00 a0 0.0000 0.000E+00 0.000 0.000 sqrtdel= 1.0000 0.000E+00 47 -1 0.70 0.50 ag i d10 5p ag i d8 5s2 4f 0.000E+00 ( //r2// )= 0.000E+00 a0 0.0000 0.000E+00 0.000 0.000 sqrtdel= 1.0000 0.000E+00 47 -1 0.70 0.50 ag i d10 5p ag i d10 6h 0.000E+00 ( //r2// )= 0.000E+00 a0 0.0000 0.000E+00 0.000 0.000 sqrtdel= 1.0000 0.000E+00 47 -1 0.70 0.50 ag i d10 5p ag i d10 7h 0.000E+00 ( //r2// )= 0.000E+00 a0 0.0000 0.000E+00 0.000 0.000 sqrtdel= 1.0000 0.000E+00 47 -1 0.70 0.50 ag i d10 5p ag i d10 8h 0.000E+00 ( //r2// )= 0.000E+00 a0 0.0000 0.000E+00 0.000 0.000 sqrtdel= 1.0000 0.000E+00 47 -1 0.70 0.50 ag i d10 5p ag i d10 9h 0.000E+00 ( //r2// )= 0.000E+00 a0 0.0000 0.000E+00 0.000 0.000 sqrtdel= 1.0000 0.000E+00 47 -1 0.70 0.50 ag i d10 5p ag i d9 5s6h 0.000E+00 ( //r2// )= 0.000E+00 a0 0.0000 0.000E+00 0.000 0.000 sqrtdel= 1.0000 0.000E+00 47 -1 0.70 0.50 ag i d10 5p ag i d9 5s7h 0.000E+00 ( //r2// )= 0.000E+00 a0 0.0000 0.000E+00 0.000 0.000 sqrtdel= 1.0000 0.000E+00 47 -1 0.70 0.50 ag i d10 5p ag i d9 5s8h 0.000E+00 ( //r2// )= 0.000E+00 a0 0.0000 0.000E+00 0.000 0.000 sqrtdel= 1.0000 0.000E+00 47 -1 0.70 0.50 ag i d10 5p ag i d9 5s9h 0.000E+00 ( //r2// )= 0.000E+00 a0 0.0000 0.000E+00 0.000 0.000 sqrtdel= 1.0000 0.000E+00 47 -1 0.70 0.50 ag i d10 5p ag i d10 8k 0.000E+00 ( //r2// )= 0.000E+00 a0 0.0000 0.000E+00 0.000 0.000 sqrtdel= 1.0000 0.000E+00 47 -1 0.70 0.50 ag i d10 5p ag i d10 9k 0.000E+00 ( //r2// )= 0.000E+00 a0 0.0000 0.000E+00 0.000 0.000 sqrtdel= 1.0000 0.000E+00 47 -1 0.70 0.50 ag i d10 5p ag i d9 5s8k 0.000E+00 ( //r2// )= 0.000E+00 a0 0.0000 0.000E+00 0.000 0.000 sqrtdel= 1.0000 0.000E+00 47 -1 0.70 0.50 ag i d10 5p ag i d9 5s9k 0.000E+00 ( //r2// )= 0.000E+00 a0 0.0000 0.000E+00 0.000 0.000 sqrtdel= 1.0000 0.000E+00 47 -1 0.70 0.50 ag i d10 6p ag i d10 5p -2.321E+01 ( 6p//r2// 5p)= 2.542E+01 a0 -0.7979 1.795E+02-0.020-0.041 sqrtdel= 1.0000 2.542E+01 47 -1 0.70 0.50 ag i d10 6p ag i d10 6p 1.753E+02 ( 6p//r2// 6p)=-1.920E+02 a0 1.0000 1.024E+04 1.000 1.000 sqrtdel= 1.0000 -1.920E+02 47 -1 0.70 0.50 ag i d10 6p ag i d10 7p -1.102E+02 ( 6p//r2// 7p)= 1.207E+02 a0 -0.6783 4.048E+03-0.007-0.011 sqrtdel= 1.0000 1.207E+02 47 -1 0.70 0.50 ag i d10 6p ag i d10 8p -3.231E+01 ( 6p//r2// 8p)= 3.539E+01 a0 -0.3331 3.480E+02-0.005-0.013 sqrtdel= 1.0000 3.539E+01 47 -1 0.70 0.50 ag i d10 6p ag i d10 9p -1.690E+01 ( 6p//r2// 9p)= 1.852E+01 a0 -0.2438 9.525E+01-0.004-0.015 sqrtdel= 1.0000 1.852E+01 47 -1 0.70 0.50 ag i d10 6p ag i d9 5s5p 0.000E+00 ( //r2// )= 0.000E+00 a0 0.0000 0.000E+00 0.000 0.000 sqrtdel= 1.0000 0.000E+00 47 -1 0.70 0.50 ag i d10 6p ag i d9 5s6p -3.186E+00 ( 4d//r2// 5s)=-3.186E+00 a0 -0.9619 6.767E-01-0.449-0.677 sqrtdel= 1.0000 -3.186E+00 47 -1 0.70 0.50 ag i d10 6p ag i d9 5s7p 0.000E+00 ( //r2// )= 0.000E+00 a0 0.0000 0.000E+00 0.000 0.000 sqrtdel= 1.0000 0.000E+00 47 -1 0.70 0.50 ag i d10 6p ag i d9 5s8p 0.000E+00 ( //r2// )= 0.000E+00 a0 0.0000 0.000E+00 0.000 0.000 sqrtdel= 1.0000 0.000E+00 47 -1 0.70 0.50 ag i d10 6p ag i d9 5s9p 0.000E+00 ( //r2// )= 0.000E+00 a0 0.0000 0.000E+00 0.000 0.000 sqrtdel= 1.0000 0.000E+00 47 -1 0.70 0.50 ag i d10 6p ag i d8 5s2 5p 0.000E+00 ( //r2// )= 0.000E+00 a0 0.0000 0.000E+00 0.000 0.000 sqrtdel= 1.0000 0.000E+00 47 -1 0.70 0.50 ag i d10 6p ag i d10 4f 2.085E+02 ( 6p//r2// 4f)= 2.798E+02 a0 0.9985 1.242E+03 0.832 0.979 sqrtdel= 1.0000 2.798E+02 47 -1 0.70 0.50 ag i d10 6p ag i d10 5f 1.129E+01 ( 6p//r2// 5f)= 1.514E+01 a0 0.0982 3.639E+00 0.311 0.667 sqrtdel= 1.0000 1.514E+01 47 -1 0.70 0.50 ag i d10 6p ag i d10 6f -4.455E+00 ( 6p//r2// 6f)=-5.977E+00 a0 -0.0564 5.671E-01 0.170 0.519 sqrtdel= 1.0000 -5.977E+00 47 -1 0.70 0.50 ag i d10 6p ag i d10 7f -6.369E+00 ( 6p//r2// 7f)=-8.545E+00 a0 -0.1060 1.159E+00 0.110 0.442 sqrtdel= 1.0000 -8.545E+00 47 -1 0.70 0.50 ag i d10 6p ag i d10 8f -6.113E+00 ( 6p//r2// 8f)=-8.202E+00 a0 -0.1275 1.068E+00 0.079 0.397 sqrtdel= 1.0000 -8.202E+00 47 -1 0.70 0.50 ag i d10 6p ag i d10 9f -5.482E+00 ( 6p//r2// 9f)=-7.355E+00 a0 -0.1385 8.586E-01 0.060 0.367 sqrtdel= 1.0000 -7.355E+00 47 -1 0.70 0.50 ag i d10 6p ag i d9 5s4f 0.000E+00 ( //r2// )= 0.000E+00 a0 0.0000 0.000E+00 0.000 0.000 sqrtdel= 1.0000 0.000E+00 47 -1 0.70 0.50 ag i d10 6p ag i d9 5s5f 0.000E+00 ( //r2// )= 0.000E+00 a0 0.0000 0.000E+00 0.000 0.000 sqrtdel= 1.0000 0.000E+00 47 -1 0.70 0.50 ag i d10 6p ag i d9 5s6f 0.000E+00 ( //r2// )= 0.000E+00 a0 0.0000 0.000E+00 0.000 0.000 sqrtdel= 1.0000 0.000E+00 47 -1 0.70 0.50 ag i d10 6p ag i d9 5s7f 0.000E+00 ( //r2// )= 0.000E+00 a0 0.0000 0.000E+00 0.000 0.000 sqrtdel= 1.0000 0.000E+00 47 -1 0.70 0.50 ag i d10 6p ag i d9 5s8f 0.000E+00 ( //r2// )= 0.000E+00 a0 0.0000 0.000E+00 0.000 0.000 sqrtdel= 1.0000 0.000E+00 47 -1 0.70 0.50 ag i d10 6p ag i d9 5s9f 0.000E+00 ( //r2// )= 0.000E+00 a0 0.0000 0.000E+00 0.000 0.000 sqrtdel= 1.0000 0.000E+00 47 -1 0.70 0.50 ag i d10 6p ag i d8 5s2 4f 0.000E+00 ( //r2// )= 0.000E+00 a0 0.0000 0.000E+00 0.000 0.000 sqrtdel= 1.0000 0.000E+00 47 -1 0.70 0.50 ag i d10 6p ag i d10 6h 0.000E+00 ( //r2// )= 0.000E+00 a0 0.0000 0.000E+00 0.000 0.000 sqrtdel= 1.0000 0.000E+00 47 -1 0.70 0.50 ag i d10 6p ag i d10 7h 0.000E+00 ( //r2// )= 0.000E+00 a0 0.0000 0.000E+00 0.000 0.000 sqrtdel= 1.0000 0.000E+00 47 -1 0.70 0.50 ag i d10 6p ag i d10 8h 0.000E+00 ( //r2// )= 0.000E+00 a0 0.0000 0.000E+00 0.000 0.000 sqrtdel= 1.0000 0.000E+00 47 -1 0.70 0.50 ag i d10 6p ag i d10 9h 0.000E+00 ( //r2// )= 0.000E+00 a0 0.0000 0.000E+00 0.000 0.000 sqrtdel= 1.0000 0.000E+00 47 -1 0.70 0.50 ag i d10 6p ag i d9 5s6h 0.000E+00 ( //r2// )= 0.000E+00 a0 0.0000 0.000E+00 0.000 0.000 sqrtdel= 1.0000 0.000E+00 47 -1 0.70 0.50 ag i d10 6p ag i d9 5s7h 0.000E+00 ( //r2// )= 0.000E+00 a0 0.0000 0.000E+00 0.000 0.000 sqrtdel= 1.0000 0.000E+00 47 -1 0.70 0.50 ag i d10 6p ag i d9 5s8h 0.000E+00 ( //r2// )= 0.000E+00 a0 0.0000 0.000E+00 0.000 0.000 sqrtdel= 1.0000 0.000E+00 47 -1 0.70 0.50 ag i d10 6p ag i d9 5s9h 0.000E+00 ( //r2// )= 0.000E+00 a0 0.0000 0.000E+00 0.000 0.000 sqrtdel= 1.0000 0.000E+00 47 -1 0.70 0.50 ag i d10 6p ag i d10 8k 0.000E+00 ( //r2// )= 0.000E+00 a0 0.0000 0.000E+00 0.000 0.000 sqrtdel= 1.0000 0.000E+00 47 -1 0.70 0.50 ag i d10 6p ag i d10 9k 0.000E+00 ( //r2// )= 0.000E+00 a0 0.0000 0.000E+00 0.000 0.000 sqrtdel= 1.0000 0.000E+00 47 -1 0.70 0.50 ag i d10 6p ag i d9 5s8k 0.000E+00 ( //r2// )= 0.000E+00 a0 0.0000 0.000E+00 0.000 0.000 sqrtdel= 1.0000 0.000E+00 47 -1 0.70 0.50 ag i d10 6p ag i d9 5s9k 0.000E+00 ( //r2// )= 0.000E+00 a0 0.0000 0.000E+00 0.000 0.000 sqrtdel= 1.0000 0.000E+00 47 -1 0.70 0.50 ag i d10 7p ag i d10 5p -7.532E+00 ( 7p//r2// 5p)= 8.251E+00 a0 -0.4936 1.891E+01-0.013-0.045 sqrtdel= 1.0000 8.251E+00 47 -1 0.70 0.50 ag i d10 7p ag i d10 6p -1.102E+02 ( 7p//r2// 6p)= 1.207E+02 a0 -0.6783 4.048E+03-0.007-0.011 sqrtdel= 1.0000 1.207E+02 47 -1 0.70 0.50 ag i d10 7p ag i d10 7p 5.892E+02 ( 7p//r2// 7p)=-6.455E+02 a0 1.0000 1.157E+05 1.000 1.000 sqrtdel= 1.0000 -6.455E+02 47 -1 0.70 0.50 ag i d10 7p ag i d10 8p -3.247E+02 ( 7p//r2// 8p)= 3.557E+02 a0 -0.6176 3.515E+04-0.004-0.006 sqrtdel= 1.0000 3.557E+02 47 -1 0.70 0.50 ag i d10 7p ag i d10 9p -8.947E+01 ( 7p//r2// 9p)= 9.801E+01 a0 -0.2649 2.668E+03-0.003-0.007 sqrtdel= 1.0000 9.801E+01 47 -1 0.70 0.50 ag i d10 7p ag i d9 5s5p 0.000E+00 ( //r2// )= 0.000E+00 a0 0.0000 0.000E+00 0.000 0.000 sqrtdel= 1.0000 0.000E+00 47 -1 0.70 0.50 ag i d10 7p ag i d9 5s6p 0.000E+00 ( //r2// )= 0.000E+00 a0 0.0000 0.000E+00 0.000 0.000 sqrtdel= 1.0000 0.000E+00 47 -1 0.70 0.50 ag i d10 7p ag i d9 5s7p -3.173E+00 ( 4d//r2// 5s)=-3.173E+00 a0 -0.9616 6.711E-01-0.449-0.676 sqrtdel= 1.0000 -3.173E+00 47 -1 0.70 0.50 ag i d10 7p ag i d9 5s8p 0.000E+00 ( //r2// )= 0.000E+00 a0 0.0000 0.000E+00 0.000 0.000 sqrtdel= 1.0000 0.000E+00 47 -1 0.70 0.50 ag i d10 7p ag i d9 5s9p 0.000E+00 ( //r2// )= 0.000E+00 a0 0.0000 0.000E+00 0.000 0.000 sqrtdel= 1.0000 0.000E+00 47 -1 0.70 0.50 ag i d10 7p ag i d8 5s2 5p 0.000E+00 ( //r2// )= 0.000E+00 a0 0.0000 0.000E+00 0.000 0.000 sqrtdel= 1.0000 0.000E+00 47 -1 0.70 0.50 ag i d10 7p ag i d10 4f -3.699E+02 ( 7p//r2// 4f)=-4.963E+02 a0 -0.9162 3.910E+03-0.513-0.620 sqrtdel= 1.0000 -4.963E+02 47 -1 0.70 0.50 ag i d10 7p ag i d10 5f 5.742E+02 ( 7p//r2// 5f)= 7.704E+02 a0 0.9581 9.421E+03 0.645 0.874 sqrtdel= 1.0000 7.704E+02 47 -1 0.70 0.50 ag i d10 7p ag i d10 6f 8.612E+01 ( 7p//r2// 6f)= 1.155E+02 a0 0.2295 2.119E+02 0.326 0.667 sqrtdel= 1.0000 1.155E+02 47 -1 0.70 0.50 ag i d10 7p ag i d10 7f 2.431E+01 ( 7p//r2// 7f)= 3.261E+01 a0 0.0892 1.688E+01 0.208 0.561 sqrtdel= 1.0000 3.261E+01 47 -1 0.70 0.50 ag i d10 7p ag i d10 8f 8.241E+00 ( 7p//r2// 8f)= 1.106E+01 a0 0.0385 1.940E+00 0.148 0.502 sqrtdel= 1.0000 1.106E+01 47 -1 0.70 0.50 ag i d10 7p ag i d10 9f 2.566E+00 ( 7p//r2// 9f)= 3.443E+00 a0 0.0147 1.881E-01 0.114 0.466 sqrtdel= 1.0000 3.443E+00 47 -1 0.70 0.50 ag i d10 7p ag i d9 5s4f 0.000E+00 ( //r2// )= 0.000E+00 a0 0.0000 0.000E+00 0.000 0.000 sqrtdel= 1.0000 0.000E+00 47 -1 0.70 0.50 ag i d10 7p ag i d9 5s5f 0.000E+00 ( //r2// )= 0.000E+00 a0 0.0000 0.000E+00 0.000 0.000 sqrtdel= 1.0000 0.000E+00 47 -1 0.70 0.50 ag i d10 7p ag i d9 5s6f 0.000E+00 ( //r2// )= 0.000E+00 a0 0.0000 0.000E+00 0.000 0.000 sqrtdel= 1.0000 0.000E+00 47 -1 0.70 0.50 ag i d10 7p ag i d9 5s7f 0.000E+00 ( //r2// )= 0.000E+00 a0 0.0000 0.000E+00 0.000 0.000 sqrtdel= 1.0000 0.000E+00 47 -1 0.70 0.50 ag i d10 7p ag i d9 5s8f 0.000E+00 ( //r2// )= 0.000E+00 a0 0.0000 0.000E+00 0.000 0.000 sqrtdel= 1.0000 0.000E+00 47 -1 0.70 0.50 ag i d10 7p ag i d9 5s9f 0.000E+00 ( //r2// )= 0.000E+00 a0 0.0000 0.000E+00 0.000 0.000 sqrtdel= 1.0000 0.000E+00 47 -1 0.70 0.50 ag i d10 7p ag i d8 5s2 4f 0.000E+00 ( //r2// )= 0.000E+00 a0 0.0000 0.000E+00 0.000 0.000 sqrtdel= 1.0000 0.000E+00 47 -1 0.70 0.50 ag i d10 7p ag i d10 6h 0.000E+00 ( //r2// )= 0.000E+00 a0 0.0000 0.000E+00 0.000 0.000 sqrtdel= 1.0000 0.000E+00 47 -1 0.70 0.50 ag i d10 7p ag i d10 7h 0.000E+00 ( //r2// )= 0.000E+00 a0 0.0000 0.000E+00 0.000 0.000 sqrtdel= 1.0000 0.000E+00 47 -1 0.70 0.50 ag i d10 7p ag i d10 8h 0.000E+00 ( //r2// )= 0.000E+00 a0 0.0000 0.000E+00 0.000 0.000 sqrtdel= 1.0000 0.000E+00 47 -1 0.70 0.50 ag i d10 7p ag i d10 9h 0.000E+00 ( //r2// )= 0.000E+00 a0 0.0000 0.000E+00 0.000 0.000 sqrtdel= 1.0000 0.000E+00 47 -1 0.70 0.50 ag i d10 7p ag i d9 5s6h 0.000E+00 ( //r2// )= 0.000E+00 a0 0.0000 0.000E+00 0.000 0.000 sqrtdel= 1.0000 0.000E+00 47 -1 0.70 0.50 ag i d10 7p ag i d9 5s7h 0.000E+00 ( //r2// )= 0.000E+00 a0 0.0000 0.000E+00 0.000 0.000 sqrtdel= 1.0000 0.000E+00 47 -1 0.70 0.50 ag i d10 7p ag i d9 5s8h 0.000E+00 ( //r2// )= 0.000E+00 a0 0.0000 0.000E+00 0.000 0.000 sqrtdel= 1.0000 0.000E+00 47 -1 0.70 0.50 ag i d10 7p ag i d9 5s9h 0.000E+00 ( //r2// )= 0.000E+00 a0 0.0000 0.000E+00 0.000 0.000 sqrtdel= 1.0000 0.000E+00 47 -1 0.70 0.50 ag i d10 7p ag i d10 8k 0.000E+00 ( //r2// )= 0.000E+00 a0 0.0000 0.000E+00 0.000 0.000 sqrtdel= 1.0000 0.000E+00 47 -1 0.70 0.50 ag i d10 7p ag i d10 9k 0.000E+00 ( //r2// )= 0.000E+00 a0 0.0000 0.000E+00 0.000 0.000 sqrtdel= 1.0000 0.000E+00 47 -1 0.70 0.50 ag i d10 7p ag i d9 5s8k 0.000E+00 ( //r2// )= 0.000E+00 a0 0.0000 0.000E+00 0.000 0.000 sqrtdel= 1.0000 0.000E+00 47 -1 0.70 0.50 ag i d10 7p ag i d9 5s9k 0.000E+00 ( //r2// )= 0.000E+00 a0 0.0000 0.000E+00 0.000 0.000 sqrtdel= 1.0000 0.000E+00 47 -1 0.70 0.50 ag i d10 8p ag i d10 5p -4.155E+00 ( 8p//r2// 5p)= 4.551E+00 a0 -0.4019 5.754E+00-0.009-0.047 sqrtdel= 1.0000 4.551E+00 47 -1 0.70 0.50 ag i d10 8p ag i d10 6p -3.231E+01 ( 8p//r2// 6p)= 3.539E+01 a0 -0.3331 3.480E+02-0.005-0.013 sqrtdel= 1.0000 3.539E+01 47 -1 0.70 0.50 ag i d10 8p ag i d10 7p -3.247E+02 ( 8p//r2// 7p)= 3.557E+02 a0 -0.6176 3.515E+04-0.004-0.006 sqrtdel= 1.0000 3.557E+02 47 -1 0.70 0.50 ag i d10 8p ag i d10 8p 1.478E+03 ( 8p//r2// 8p)=-1.620E+03 a0 1.0000 7.286E+05 1.000 1.000 sqrtdel= 1.0000 -1.620E+03 47 -1 0.70 0.50 ag i d10 8p ag i d10 9p -7.507E+02 ( 8p//r2// 9p)= 8.223E+02 a0 -0.5800 1.878E+05-0.002-0.004 sqrtdel= 1.0000 8.223E+02 47 -1 0.70 0.50 ag i d10 8p ag i d9 5s5p 0.000E+00 ( //r2// )= 0.000E+00 a0 0.0000 0.000E+00 0.000 0.000 sqrtdel= 1.0000 0.000E+00 47 -1 0.70 0.50 ag i d10 8p ag i d9 5s6p 0.000E+00 ( //r2// )= 0.000E+00 a0 0.0000 0.000E+00 0.000 0.000 sqrtdel= 1.0000 0.000E+00 47 -1 0.70 0.50 ag i d10 8p ag i d9 5s7p 0.000E+00 ( //r2// )= 0.000E+00 a0 0.0000 0.000E+00 0.000 0.000 sqrtdel= 1.0000 0.000E+00 47 -1 0.70 0.50 ag i d10 8p ag i d9 5s8p -3.169E+00 ( 4d//r2// 5s)=-3.169E+00 a0 -0.9615 6.695E-01-0.449-0.676 sqrtdel= 1.0000 -3.169E+00 47 -1 0.70 0.50 ag i d10 8p ag i d9 5s9p 0.000E+00 ( //r2// )= 0.000E+00 a0 0.0000 0.000E+00 0.000 0.000 sqrtdel= 1.0000 0.000E+00 47 -1 0.70 0.50 ag i d10 8p ag i d8 5s2 5p 0.000E+00 ( //r2// )= 0.000E+00 a0 0.0000 0.000E+00 0.000 0.000 sqrtdel= 1.0000 0.000E+00 47 -1 0.70 0.50 ag i d10 8p ag i d10 4f 9.452E+01 ( 8p//r2// 4f)= 1.268E+02 a0 0.3110 2.553E+02-0.049-0.093 sqrtdel= 1.0000 1.268E+02 47 -1 0.70 0.50 ag i d10 8p ag i d10 5f -1.151E+03 ( 8p//r2// 5f)=-1.544E+03 a0 -0.9626 3.782E+04-0.675-0.777 sqrtdel= 1.0000 -1.544E+03 47 -1 0.70 0.50 ag i d10 8p ag i d10 6f 1.231E+03 ( 8p//r2// 6f)= 1.651E+03 a0 0.8842 4.326E+04 0.504 0.719 sqrtdel= 1.0000 1.651E+03 47 -1 0.70 0.50 ag i d10 8p ag i d10 7f 2.272E+02 ( 8p//r2// 7f)= 3.048E+02 a0 0.2434 1.474E+03 0.287 0.579 sqrtdel= 1.0000 3.048E+02 47 -1 0.70 0.50 ag i d10 8p ag i d10 8f 8.246E+01 ( 8p//r2// 8f)= 1.106E+02 a0 0.1174 1.943E+02 0.195 0.500 sqrtdel= 1.0000 1.106E+02 47 -1 0.70 0.50 ag i d10 8p ag i d10 9f 3.978E+01 ( 8p//r2// 9f)= 5.337E+01 a0 0.0703 4.521E+01 0.146 0.454 sqrtdel= 1.0000 5.337E+01 47 -1 0.70 0.50 ag i d10 8p ag i d9 5s4f 0.000E+00 ( //r2// )= 0.000E+00 a0 0.0000 0.000E+00 0.000 0.000 sqrtdel= 1.0000 0.000E+00 47 -1 0.70 0.50 ag i d10 8p ag i d9 5s5f 0.000E+00 ( //r2// )= 0.000E+00 a0 0.0000 0.000E+00 0.000 0.000 sqrtdel= 1.0000 0.000E+00 47 -1 0.70 0.50 ag i d10 8p ag i d9 5s6f 0.000E+00 ( //r2// )= 0.000E+00 a0 0.0000 0.000E+00 0.000 0.000 sqrtdel= 1.0000 0.000E+00 47 -1 0.70 0.50 ag i d10 8p ag i d9 5s7f 0.000E+00 ( //r2// )= 0.000E+00 a0 0.0000 0.000E+00 0.000 0.000 sqrtdel= 1.0000 0.000E+00 47 -1 0.70 0.50 ag i d10 8p ag i d9 5s8f 0.000E+00 ( //r2// )= 0.000E+00 a0 0.0000 0.000E+00 0.000 0.000 sqrtdel= 1.0000 0.000E+00 47 -1 0.70 0.50 ag i d10 8p ag i d9 5s9f 0.000E+00 ( //r2// )= 0.000E+00 a0 0.0000 0.000E+00 0.000 0.000 sqrtdel= 1.0000 0.000E+00 47 -1 0.70 0.50 ag i d10 8p ag i d8 5s2 4f 0.000E+00 ( //r2// )= 0.000E+00 a0 0.0000 0.000E+00 0.000 0.000 sqrtdel= 1.0000 0.000E+00 47 -1 0.70 0.50 ag i d10 8p ag i d10 6h 0.000E+00 ( //r2// )= 0.000E+00 a0 0.0000 0.000E+00 0.000 0.000 sqrtdel= 1.0000 0.000E+00 47 -1 0.70 0.50 ag i d10 8p ag i d10 7h 0.000E+00 ( //r2// )= 0.000E+00 a0 0.0000 0.000E+00 0.000 0.000 sqrtdel= 1.0000 0.000E+00 47 -1 0.70 0.50 ag i d10 8p ag i d10 8h 0.000E+00 ( //r2// )= 0.000E+00 a0 0.0000 0.000E+00 0.000 0.000 sqrtdel= 1.0000 0.000E+00 47 -1 0.70 0.50 ag i d10 8p ag i d10 9h 0.000E+00 ( //r2// )= 0.000E+00 a0 0.0000 0.000E+00 0.000 0.000 sqrtdel= 1.0000 0.000E+00 47 -1 0.70 0.50 ag i d10 8p ag i d9 5s6h 0.000E+00 ( //r2// )= 0.000E+00 a0 0.0000 0.000E+00 0.000 0.000 sqrtdel= 1.0000 0.000E+00 47 -1 0.70 0.50 ag i d10 8p ag i d9 5s7h 0.000E+00 ( //r2// )= 0.000E+00 a0 0.0000 0.000E+00 0.000 0.000 sqrtdel= 1.0000 0.000E+00 47 -1 0.70 0.50 ag i d10 8p ag i d9 5s8h 0.000E+00 ( //r2// )= 0.000E+00 a0 0.0000 0.000E+00 0.000 0.000 sqrtdel= 1.0000 0.000E+00 47 -1 0.70 0.50 ag i d10 8p ag i d9 5s9h 0.000E+00 ( //r2// )= 0.000E+00 a0 0.0000 0.000E+00 0.000 0.000 sqrtdel= 1.0000 0.000E+00 47 -1 0.70 0.50 ag i d10 8p ag i d10 8k 0.000E+00 ( //r2// )= 0.000E+00 a0 0.0000 0.000E+00 0.000 0.000 sqrtdel= 1.0000 0.000E+00 47 -1 0.70 0.50 ag i d10 8p ag i d10 9k 0.000E+00 ( //r2// )= 0.000E+00 a0 0.0000 0.000E+00 0.000 0.000 sqrtdel= 1.0000 0.000E+00 47 -1 0.70 0.50 ag i d10 8p ag i d9 5s8k 0.000E+00 ( //r2// )= 0.000E+00 a0 0.0000 0.000E+00 0.000 0.000 sqrtdel= 1.0000 0.000E+00 47 -1 0.70 0.50 ag i d10 8p ag i d9 5s9k 0.000E+00 ( //r2// )= 0.000E+00 a0 0.0000 0.000E+00 0.000 0.000 sqrtdel= 1.0000 0.000E+00 47 -1 0.70 0.50 ag i d10 9p ag i d10 5p -2.776E+00 ( 9p//r2// 5p)= 3.041E+00 a0 -0.3620 2.569E+00-0.007-0.049 sqrtdel= 1.0000 3.041E+00 47 -1 0.70 0.50 ag i d10 9p ag i d10 6p -1.690E+01 ( 9p//r2// 6p)= 1.852E+01 a0 -0.2438 9.525E+01-0.004-0.015 sqrtdel= 1.0000 1.852E+01 47 -1 0.70 0.50 ag i d10 9p ag i d10 7p -8.947E+01 ( 9p//r2// 7p)= 9.801E+01 a0 -0.2649 2.668E+03-0.003-0.007 sqrtdel= 1.0000 9.801E+01 47 -1 0.70 0.50 ag i d10 9p ag i d10 8p -7.507E+02 ( 9p//r2// 8p)= 8.223E+02 a0 -0.5800 1.878E+05-0.002-0.004 sqrtdel= 1.0000 8.223E+02 47 -1 0.70 0.50 ag i d10 9p ag i d10 9p 3.111E+03 ( 9p//r2// 9p)=-3.408E+03 a0 1.0000 3.227E+06 1.000 1.000 sqrtdel= 1.0000 -3.408E+03 47 -1 0.70 0.50 ag i d10 9p ag i d9 5s5p 0.000E+00 ( //r2// )= 0.000E+00 a0 0.0000 0.000E+00 0.000 0.000 sqrtdel= 1.0000 0.000E+00 47 -1 0.70 0.50 ag i d10 9p ag i d9 5s6p 0.000E+00 ( //r2// )= 0.000E+00 a0 0.0000 0.000E+00 0.000 0.000 sqrtdel= 1.0000 0.000E+00 47 -1 0.70 0.50 ag i d10 9p ag i d9 5s7p 0.000E+00 ( //r2// )= 0.000E+00 a0 0.0000 0.000E+00 0.000 0.000 sqrtdel= 1.0000 0.000E+00 47 -1 0.70 0.50 ag i d10 9p ag i d9 5s8p 0.000E+00 ( //r2// )= 0.000E+00 a0 0.0000 0.000E+00 0.000 0.000 sqrtdel= 1.0000 0.000E+00 47 -1 0.70 0.50 ag i d10 9p ag i d9 5s9p -3.167E+00 ( 4d//r2// 5s)=-3.167E+00 a0 -0.9615 6.688E-01-0.449-0.676 sqrtdel= 1.0000 -3.167E+00 47 -1 0.70 0.50 ag i d10 9p ag i d8 5s2 5p 0.000E+00 ( //r2// )= 0.000E+00 a0 0.0000 0.000E+00 0.000 0.000 sqrtdel= 1.0000 0.000E+00 47 -1 0.70 0.50 ag i d10 9p ag i d10 4f 2.536E+01 ( 9p//r2// 4f)= 3.402E+01 a0 0.1255 1.837E+01-0.025-0.068 sqrtdel= 1.0000 3.402E+01 47 -1 0.70 0.50 ag i d10 9p ag i d10 5f 3.145E+02 ( 9p//r2// 5f)= 4.219E+02 a0 0.3337 2.825E+03-0.064-0.108 sqrtdel= 1.0000 4.219E+02 47 -1 0.70 0.50 ag i d10 9p ag i d10 6f -2.651E+03 ( 9p//r2// 6f)=-3.557E+03 a0 -0.9801 2.008E+05-0.766-0.856 sqrtdel= 1.0000 -3.557E+03 47 -1 0.70 0.50 ag i d10 9p ag i d10 7f 2.299E+03 ( 9p//r2// 7f)= 3.084E+03 a0 0.8176 1.510E+05 0.405 0.586 sqrtdel= 1.0000 3.084E+03 47 -1 0.70 0.50 ag i d10 9p ag i d10 8f 4.611E+02 ( 9p//r2// 8f)= 6.186E+02 a0 0.2341 6.074E+03 0.246 0.487 sqrtdel= 1.0000 6.186E+02 47 -1 0.70 0.50 ag i d10 9p ag i d10 9f 1.811E+02 ( 9p//r2// 9f)= 2.430E+02 a0 0.1190 9.370E+02 0.174 0.427 sqrtdel= 1.0000 2.430E+02 47 -1 0.70 0.50 ag i d10 9p ag i d9 5s4f 0.000E+00 ( //r2// )= 0.000E+00 a0 0.0000 0.000E+00 0.000 0.000 sqrtdel= 1.0000 0.000E+00 47 -1 0.70 0.50 ag i d10 9p ag i d9 5s5f 0.000E+00 ( //r2// )= 0.000E+00 a0 0.0000 0.000E+00 0.000 0.000 sqrtdel= 1.0000 0.000E+00 47 -1 0.70 0.50 ag i d10 9p ag i d9 5s6f 0.000E+00 ( //r2// )= 0.000E+00 a0 0.0000 0.000E+00 0.000 0.000 sqrtdel= 1.0000 0.000E+00 47 -1 0.70 0.50 ag i d10 9p ag i d9 5s7f 0.000E+00 ( //r2// )= 0.000E+00 a0 0.0000 0.000E+00 0.000 0.000 sqrtdel= 1.0000 0.000E+00 47 -1 0.70 0.50 ag i d10 9p ag i d9 5s8f 0.000E+00 ( //r2// )= 0.000E+00 a0 0.0000 0.000E+00 0.000 0.000 sqrtdel= 1.0000 0.000E+00 47 -1 0.70 0.50 ag i d10 9p ag i d9 5s9f 0.000E+00 ( //r2// )= 0.000E+00 a0 0.0000 0.000E+00 0.000 0.000 sqrtdel= 1.0000 0.000E+00 47 -1 0.70 0.50 ag i d10 9p ag i d8 5s2 4f 0.000E+00 ( //r2// )= 0.000E+00 a0 0.0000 0.000E+00 0.000 0.000 sqrtdel= 1.0000 0.000E+00 47 -1 0.70 0.50 ag i d10 9p ag i d10 6h 0.000E+00 ( //r2// )= 0.000E+00 a0 0.0000 0.000E+00 0.000 0.000 sqrtdel= 1.0000 0.000E+00 47 -1 0.70 0.50 ag i d10 9p ag i d10 7h 0.000E+00 ( //r2// )= 0.000E+00 a0 0.0000 0.000E+00 0.000 0.000 sqrtdel= 1.0000 0.000E+00 47 -1 0.70 0.50 ag i d10 9p ag i d10 8h 0.000E+00 ( //r2// )= 0.000E+00 a0 0.0000 0.000E+00 0.000 0.000 sqrtdel= 1.0000 0.000E+00 47 -1 0.70 0.50 ag i d10 9p ag i d10 9h 0.000E+00 ( //r2// )= 0.000E+00 a0 0.0000 0.000E+00 0.000 0.000 sqrtdel= 1.0000 0.000E+00 47 -1 0.70 0.50 ag i d10 9p ag i d9 5s6h 0.000E+00 ( //r2// )= 0.000E+00 a0 0.0000 0.000E+00 0.000 0.000 sqrtdel= 1.0000 0.000E+00 47 -1 0.70 0.50 ag i d10 9p ag i d9 5s7h 0.000E+00 ( //r2// )= 0.000E+00 a0 0.0000 0.000E+00 0.000 0.000 sqrtdel= 1.0000 0.000E+00 47 -1 0.70 0.50 ag i d10 9p ag i d9 5s8h 0.000E+00 ( //r2// )= 0.000E+00 a0 0.0000 0.000E+00 0.000 0.000 sqrtdel= 1.0000 0.000E+00 47 -1 0.70 0.50 ag i d10 9p ag i d9 5s9h 0.000E+00 ( //r2// )= 0.000E+00 a0 0.0000 0.000E+00 0.000 0.000 sqrtdel= 1.0000 0.000E+00 47 -1 0.70 0.50 ag i d10 9p ag i d10 8k 0.000E+00 ( //r2// )= 0.000E+00 a0 0.0000 0.000E+00 0.000 0.000 sqrtdel= 1.0000 0.000E+00 47 -1 0.70 0.50 ag i d10 9p ag i d10 9k 0.000E+00 ( //r2// )= 0.000E+00 a0 0.0000 0.000E+00 0.000 0.000 sqrtdel= 1.0000 0.000E+00 47 -1 0.70 0.50 ag i d10 9p ag i d9 5s8k 0.000E+00 ( //r2// )= 0.000E+00 a0 0.0000 0.000E+00 0.000 0.000 sqrtdel= 1.0000 0.000E+00 47 -1 0.70 0.50 ag i d10 9p ag i d9 5s9k 0.000E+00 ( //r2// )= 0.000E+00 a0 0.0000 0.000E+00 0.000 0.000 sqrtdel= 1.0000 0.000E+00 47 -1 0.70 0.50 ag i d9 5s5p ag i d10 5p -3.295E+00 ( 5s//r2// 4d)=-3.295E+00 a0 -0.9650 7.239E-01-0.443-0.687 sqrtdel= 1.0000 -3.295E+00 47 -1 0.70 0.50 ag i d9 5s5p ag i d10 6p 0.000E+00 ( //r2// )= 0.000E+00 a0 0.0000 0.000E+00 0.000 0.000 sqrtdel= 1.0000 0.000E+00 47 -1 0.70 0.50 ag i d9 5s5p ag i d10 7p 0.000E+00 ( //r2// )= 0.000E+00 a0 0.0000 0.000E+00 0.000 0.000 sqrtdel= 1.0000 0.000E+00 47 -1 0.70 0.50 ag i d9 5s5p ag i d10 8p 0.000E+00 ( //r2// )= 0.000E+00 a0 0.0000 0.000E+00 0.000 0.000 sqrtdel= 1.0000 0.000E+00 47 -1 0.70 0.50 ag i d9 5s5p ag i d10 9p 0.000E+00 ( //r2// )= 0.000E+00 a0 0.0000 0.000E+00 0.000 0.000 sqrtdel= 1.0000 0.000E+00 47 -1 0.70 0.50 ag i d9 5s5p ag i d9 5s5p 2.157E+01 ( 5p//r2// 5p)=-2.362E+01 a0 1.0000 1.550E+02 1.000 1.000 sqrtdel= 1.0000 -2.362E+01 47 -1 0.70 0.50 ag i d9 5s5p ag i d9 5s6p -1.679E+01 ( 5p//r2// 6p)= 1.839E+01 a0 -0.7918 9.396E+01-0.013-0.029 sqrtdel= 1.0000 1.839E+01 47 -1 0.70 0.50 ag i d9 5s5p ag i d9 5s7p -6.060E+00 ( 5p//r2// 7p)= 6.639E+00 a0 -0.5534 1.224E+01-0.008-0.030 sqrtdel= 1.0000 6.639E+00 47 -1 0.70 0.50 ag i d9 5s5p ag i d9 5s8p -3.486E+00 ( 5p//r2// 8p)= 3.819E+00 a0 -0.4718 4.052E+00-0.005-0.031 sqrtdel= 1.0000 3.819E+00 47 -1 0.70 0.50 ag i d9 5s5p ag i d9 5s9p -2.379E+00 ( 5p//r2// 9p)= 2.606E+00 a0 -0.4349 1.886E+00-0.004-0.032 sqrtdel= 1.0000 2.606E+00 47 -1 0.70 0.50 ag i d9 5s5p ag i d8 5s2 5p -2.874E+00 ( 4d//r2// 5s)=-2.874E+00 a0 -0.9576 5.506E-01-0.417-0.657 sqrtdel= 1.0000 -2.874E+00 47 -1 0.70 0.50 ag i d9 5s5p ag i d10 4f 0.000E+00 ( //r2// )= 0.000E+00 a0 0.0000 0.000E+00 0.000 0.000 sqrtdel= 1.0000 0.000E+00 47 -1 0.70 0.50 ag i d9 5s5p ag i d10 5f 0.000E+00 ( //r2// )= 0.000E+00 a0 0.0000 0.000E+00 0.000 0.000 sqrtdel= 1.0000 0.000E+00 47 -1 0.70 0.50 ag i d9 5s5p ag i d10 6f 0.000E+00 ( //r2// )= 0.000E+00 a0 0.0000 0.000E+00 0.000 0.000 sqrtdel= 1.0000 0.000E+00 47 -1 0.70 0.50 ag i d9 5s5p ag i d10 7f 0.000E+00 ( //r2// )= 0.000E+00 a0 0.0000 0.000E+00 0.000 0.000 sqrtdel= 1.0000 0.000E+00 47 -1 0.70 0.50 ag i d9 5s5p ag i d10 8f 0.000E+00 ( //r2// )= 0.000E+00 a0 0.0000 0.000E+00 0.000 0.000 sqrtdel= 1.0000 0.000E+00 47 -1 0.70 0.50 ag i d9 5s5p ag i d10 9f 0.000E+00 ( //r2// )= 0.000E+00 a0 0.0000 0.000E+00 0.000 0.000 sqrtdel= 1.0000 0.000E+00 47 -1 0.70 0.50 ag i d9 5s5p ag i d9 5s4f -1.306E+01 ( 5p//r2// 4f)=-1.752E+01 a0 -1.0000 4.872E+00-0.167-0.999 sqrtdel= 1.0000 -1.752E+01 47 -1 0.70 0.50 ag i d9 5s5p ag i d9 5s5f -9.028E+00 ( 5p//r2// 5f)=-1.211E+01 a0 -0.9847 2.328E+00-0.135-0.997 sqrtdel= 1.0000 -1.211E+01 47 -1 0.70 0.50 ag i d9 5s5p ag i d9 5s6f -6.633E+00 ( 5p//r2// 6f)=-8.899E+00 a0 -0.9648 1.257E+00-0.107-0.994 sqrtdel= 1.0000 -8.899E+00 47 -1 0.70 0.50 ag i d9 5s5p ag i d9 5s7f -5.140E+00 ( 5p//r2// 7f)=-6.896E+00 a0 -0.9499 7.549E-01-0.087-0.992 sqrtdel= 1.0000 -6.896E+00 47 -1 0.70 0.50 ag i d9 5s5p ag i d9 5s8f -4.140E+00 ( 5p//r2// 8f)=-5.555E+00 a0 -0.9395 4.898E-01-0.072-0.990 sqrtdel= 1.0000 -5.555E+00 47 -1 0.70 0.50 ag i d9 5s5p ag i d9 5s9f -3.432E+00 ( 5p//r2// 9f)=-4.604E+00 a0 -0.9319 3.364E-01-0.061-0.988 sqrtdel= 1.0000 -4.604E+00 47 -1 0.70 0.50 ag i d9 5s5p ag i d8 5s2 4f 0.000E+00 ( //r2// )= 0.000E+00 a0 0.0000 0.000E+00 0.000 0.000 sqrtdel= 1.0000 0.000E+00 47 -1 0.70 0.50 ag i d9 5s5p ag i d10 6h 0.000E+00 ( //r2// )= 0.000E+00 a0 0.0000 0.000E+00 0.000 0.000 sqrtdel= 1.0000 0.000E+00 47 -1 0.70 0.50 ag i d9 5s5p ag i d10 7h 0.000E+00 ( //r2// )= 0.000E+00 a0 0.0000 0.000E+00 0.000 0.000 sqrtdel= 1.0000 0.000E+00 47 -1 0.70 0.50 ag i d9 5s5p ag i d10 8h 0.000E+00 ( //r2// )= 0.000E+00 a0 0.0000 0.000E+00 0.000 0.000 sqrtdel= 1.0000 0.000E+00 47 -1 0.70 0.50 ag i d9 5s5p ag i d10 9h 0.000E+00 ( //r2// )= 0.000E+00 a0 0.0000 0.000E+00 0.000 0.000 sqrtdel= 1.0000 0.000E+00 47 -1 0.70 0.50 ag i d9 5s5p ag i d9 5s6h 0.000E+00 ( //r2// )= 0.000E+00 a0 0.0000 0.000E+00 0.000 0.000 sqrtdel= 1.0000 0.000E+00 47 -1 0.70 0.50 ag i d9 5s5p ag i d9 5s7h 0.000E+00 ( //r2// )= 0.000E+00 a0 0.0000 0.000E+00 0.000 0.000 sqrtdel= 1.0000 0.000E+00 47 -1 0.70 0.50 ag i d9 5s5p ag i d9 5s8h 0.000E+00 ( //r2// )= 0.000E+00 a0 0.0000 0.000E+00 0.000 0.000 sqrtdel= 1.0000 0.000E+00 47 -1 0.70 0.50 ag i d9 5s5p ag i d9 5s9h 0.000E+00 ( //r2// )= 0.000E+00 a0 0.0000 0.000E+00 0.000 0.000 sqrtdel= 1.0000 0.000E+00 47 -1 0.70 0.50 ag i d9 5s5p ag i d10 8k 0.000E+00 ( //r2// )= 0.000E+00 a0 0.0000 0.000E+00 0.000 0.000 sqrtdel= 1.0000 0.000E+00 47 -1 0.70 0.50 ag i d9 5s5p ag i d10 9k 0.000E+00 ( //r2// )= 0.000E+00 a0 0.0000 0.000E+00 0.000 0.000 sqrtdel= 1.0000 0.000E+00 47 -1 0.70 0.50 ag i d9 5s5p ag i d9 5s8k 0.000E+00 ( //r2// )= 0.000E+00 a0 0.0000 0.000E+00 0.000 0.000 sqrtdel= 1.0000 0.000E+00 47 -1 0.70 0.50 ag i d9 5s5p ag i d9 5s9k 0.000E+00 ( //r2// )= 0.000E+00 a0 0.0000 0.000E+00 0.000 0.000 sqrtdel= 1.0000 0.000E+00 47 -1 0.70 0.50 ag i d9 5s6p ag i d10 5p 0.000E+00 ( //r2// )= 0.000E+00 a0 0.0000 0.000E+00 0.000 0.000 sqrtdel= 1.0000 0.000E+00 47 -1 0.70 0.50 ag i d9 5s6p ag i d10 6p -3.186E+00 ( 5s//r2// 4d)=-3.186E+00 a0 -0.9619 6.767E-01-0.449-0.677 sqrtdel= 1.0000 -3.186E+00 47 -1 0.70 0.50 ag i d9 5s6p ag i d10 7p 0.000E+00 ( //r2// )= 0.000E+00 a0 0.0000 0.000E+00 0.000 0.000 sqrtdel= 1.0000 0.000E+00 47 -1 0.70 0.50 ag i d9 5s6p ag i d10 8p 0.000E+00 ( //r2// )= 0.000E+00 a0 0.0000 0.000E+00 0.000 0.000 sqrtdel= 1.0000 0.000E+00 47 -1 0.70 0.50 ag i d9 5s6p ag i d10 9p 0.000E+00 ( //r2// )= 0.000E+00 a0 0.0000 0.000E+00 0.000 0.000 sqrtdel= 1.0000 0.000E+00 47 -1 0.70 0.50 ag i d9 5s6p ag i d9 5s5p -1.679E+01 ( 6p//r2// 5p)= 1.839E+01 a0 -0.7918 9.396E+01-0.013-0.029 sqrtdel= 1.0000 1.839E+01 47 -1 0.70 0.50 ag i d9 5s6p ag i d9 5s6p 1.565E+02 ( 6p//r2// 6p)=-1.714E+02 a0 1.0000 8.160E+03 1.000 1.000 sqrtdel= 1.0000 -1.714E+02 47 -1 0.70 0.50 ag i d9 5s6p ag i d9 5s7p -9.755E+01 ( 6p//r2// 7p)= 1.069E+02 a0 -0.6759 3.172E+03-0.004-0.007 sqrtdel= 1.0000 1.069E+02 47 -1 0.70 0.50 ag i d9 5s6p ag i d9 5s8p -2.924E+01 ( 6p//r2// 8p)= 3.203E+01 a0 -0.3424 2.849E+02-0.003-0.008 sqrtdel= 1.0000 3.203E+01 47 -1 0.70 0.50 ag i d9 5s6p ag i d9 5s9p -1.547E+01 ( 6p//r2// 9p)= 1.695E+01 a0 -0.2542 7.982E+01-0.002-0.009 sqrtdel= 1.0000 1.695E+01 47 -1 0.70 0.50 ag i d9 5s6p ag i d8 5s2 5p 0.000E+00 ( //r2// )= 0.000E+00 a0 0.0000 0.000E+00 0.000 0.000 sqrtdel= 1.0000 0.000E+00 47 -1 0.70 0.50 ag i d9 5s6p ag i d10 4f 0.000E+00 ( //r2// )= 0.000E+00 a0 0.0000 0.000E+00 0.000 0.000 sqrtdel= 1.0000 0.000E+00 47 -1 0.70 0.50 ag i d9 5s6p ag i d10 5f 0.000E+00 ( //r2// )= 0.000E+00 a0 0.0000 0.000E+00 0.000 0.000 sqrtdel= 1.0000 0.000E+00 47 -1 0.70 0.50 ag i d9 5s6p ag i d10 6f 0.000E+00 ( //r2// )= 0.000E+00 a0 0.0000 0.000E+00 0.000 0.000 sqrtdel= 1.0000 0.000E+00 47 -1 0.70 0.50 ag i d9 5s6p ag i d10 7f 0.000E+00 ( //r2// )= 0.000E+00 a0 0.0000 0.000E+00 0.000 0.000 sqrtdel= 1.0000 0.000E+00 47 -1 0.70 0.50 ag i d9 5s6p ag i d10 8f 0.000E+00 ( //r2// )= 0.000E+00 a0 0.0000 0.000E+00 0.000 0.000 sqrtdel= 1.0000 0.000E+00 47 -1 0.70 0.50 ag i d9 5s6p ag i d10 9f 0.000E+00 ( //r2// )= 0.000E+00 a0 0.0000 0.000E+00 0.000 0.000 sqrtdel= 1.0000 0.000E+00 47 -1 0.70 0.50 ag i d9 5s6p ag i d9 5s4f 1.857E+02 ( 6p//r2// 4f)= 2.491E+02 a0 0.9991 9.850E+02 0.803 0.985 sqrtdel= 1.0000 2.491E+02 47 -1 0.70 0.50 ag i d9 5s6p ag i d9 5s5f 2.318E+01 ( 6p//r2// 5f)= 3.109E+01 a0 0.2321 1.535E+01 0.342 0.746 sqrtdel= 1.0000 3.109E+01 47 -1 0.70 0.50 ag i d9 5s6p ag i d9 5s6f 3.950E+00 ( 6p//r2// 6f)= 5.300E+00 a0 0.0572 4.458E-01 0.200 0.618 sqrtdel= 1.0000 5.300E+00 47 -1 0.70 0.50 ag i d9 5s6p ag i d9 5s7f -4.440E-01 ( 6p//r2// 7f)=-5.956E-01 a0 -0.0084 5.632E-03 0.136 0.547 sqrtdel= 1.0000 -5.956E-01 47 -1 0.70 0.50 ag i d9 5s6p ag i d9 5s8f -1.690E+00 ( 6p//r2// 8f)=-2.268E+00 a0 -0.0402 8.161E-02 0.100 0.505 sqrtdel= 1.0000 -2.268E+00 47 -1 0.70 0.50 ag i d9 5s6p ag i d9 5s9f -2.022E+00 ( 6p//r2// 9f)=-2.713E+00 a0 -0.0583 1.168E-01 0.078 0.476 sqrtdel= 1.0000 -2.713E+00 47 -1 0.70 0.50 ag i d9 5s6p ag i d8 5s2 4f 0.000E+00 ( //r2// )= 0.000E+00 a0 0.0000 0.000E+00 0.000 0.000 sqrtdel= 1.0000 0.000E+00 47 -1 0.70 0.50 ag i d9 5s6p ag i d10 6h 0.000E+00 ( //r2// )= 0.000E+00 a0 0.0000 0.000E+00 0.000 0.000 sqrtdel= 1.0000 0.000E+00 47 -1 0.70 0.50 ag i d9 5s6p ag i d10 7h 0.000E+00 ( //r2// )= 0.000E+00 a0 0.0000 0.000E+00 0.000 0.000 sqrtdel= 1.0000 0.000E+00 47 -1 0.70 0.50 ag i d9 5s6p ag i d10 8h 0.000E+00 ( //r2// )= 0.000E+00 a0 0.0000 0.000E+00 0.000 0.000 sqrtdel= 1.0000 0.000E+00 47 -1 0.70 0.50 ag i d9 5s6p ag i d10 9h 0.000E+00 ( //r2// )= 0.000E+00 a0 0.0000 0.000E+00 0.000 0.000 sqrtdel= 1.0000 0.000E+00 47 -1 0.70 0.50 ag i d9 5s6p ag i d9 5s6h 0.000E+00 ( //r2// )= 0.000E+00 a0 0.0000 0.000E+00 0.000 0.000 sqrtdel= 1.0000 0.000E+00 47 -1 0.70 0.50 ag i d9 5s6p ag i d9 5s7h 0.000E+00 ( //r2// )= 0.000E+00 a0 0.0000 0.000E+00 0.000 0.000 sqrtdel= 1.0000 0.000E+00 47 -1 0.70 0.50 ag i d9 5s6p ag i d9 5s8h 0.000E+00 ( //r2// )= 0.000E+00 a0 0.0000 0.000E+00 0.000 0.000 sqrtdel= 1.0000 0.000E+00 47 -1 0.70 0.50 ag i d9 5s6p ag i d9 5s9h 0.000E+00 ( //r2// )= 0.000E+00 a0 0.0000 0.000E+00 0.000 0.000 sqrtdel= 1.0000 0.000E+00 47 -1 0.70 0.50 ag i d9 5s6p ag i d10 8k 0.000E+00 ( //r2// )= 0.000E+00 a0 0.0000 0.000E+00 0.000 0.000 sqrtdel= 1.0000 0.000E+00 47 -1 0.70 0.50 ag i d9 5s6p ag i d10 9k 0.000E+00 ( //r2// )= 0.000E+00 a0 0.0000 0.000E+00 0.000 0.000 sqrtdel= 1.0000 0.000E+00 47 -1 0.70 0.50 ag i d9 5s6p ag i d9 5s8k 0.000E+00 ( //r2// )= 0.000E+00 a0 0.0000 0.000E+00 0.000 0.000 sqrtdel= 1.0000 0.000E+00 47 -1 0.70 0.50 ag i d9 5s6p ag i d9 5s9k 0.000E+00 ( //r2// )= 0.000E+00 a0 0.0000 0.000E+00 0.000 0.000 sqrtdel= 1.0000 0.000E+00 47 -1 0.70 0.50 ag i d9 5s7p ag i d10 5p 0.000E+00 ( //r2// )= 0.000E+00 a0 0.0000 0.000E+00 0.000 0.000 sqrtdel= 1.0000 0.000E+00 47 -1 0.70 0.50 ag i d9 5s7p ag i d10 6p 0.000E+00 ( //r2// )= 0.000E+00 a0 0.0000 0.000E+00 0.000 0.000 sqrtdel= 1.0000 0.000E+00 47 -1 0.70 0.50 ag i d9 5s7p ag i d10 7p -3.173E+00 ( 5s//r2// 4d)=-3.173E+00 a0 -0.9616 6.711E-01-0.449-0.676 sqrtdel= 1.0000 -3.173E+00 47 -1 0.70 0.50 ag i d9 5s7p ag i d10 8p 0.000E+00 ( //r2// )= 0.000E+00 a0 0.0000 0.000E+00 0.000 0.000 sqrtdel= 1.0000 0.000E+00 47 -1 0.70 0.50 ag i d9 5s7p ag i d10 9p 0.000E+00 ( //r2// )= 0.000E+00 a0 0.0000 0.000E+00 0.000 0.000 sqrtdel= 1.0000 0.000E+00 47 -1 0.70 0.50 ag i d9 5s7p ag i d9 5s5p -6.060E+00 ( 7p//r2// 5p)= 6.639E+00 a0 -0.5534 1.224E+01-0.008-0.030 sqrtdel= 1.0000 6.639E+00 47 -1 0.70 0.50 ag i d9 5s7p ag i d9 5s6p -9.755E+01 ( 7p//r2// 6p)= 1.069E+02 a0 -0.6759 3.172E+03-0.004-0.007 sqrtdel= 1.0000 1.069E+02 47 -1 0.70 0.50 ag i d9 5s7p ag i d9 5s7p 5.457E+02 ( 7p//r2// 7p)=-5.978E+02 a0 1.0000 9.926E+04 1.000 1.000 sqrtdel= 1.0000 -5.978E+02 47 -1 0.70 0.50 ag i d9 5s7p ag i d9 5s8p -3.005E+02 ( 7p//r2// 8p)= 3.292E+02 a0 -0.6178 3.011E+04-0.002-0.004 sqrtdel= 1.0000 3.292E+02 47 -1 0.70 0.50 ag i d9 5s7p ag i d9 5s9p -8.361E+01 ( 7p//r2// 9p)= 9.159E+01 a0 -0.2688 2.330E+03-0.002-0.005 sqrtdel= 1.0000 9.159E+01 47 -1 0.70 0.50 ag i d9 5s7p ag i d8 5s2 5p 0.000E+00 ( //r2// )= 0.000E+00 a0 0.0000 0.000E+00 0.000 0.000 sqrtdel= 1.0000 0.000E+00 47 -1 0.70 0.50 ag i d9 5s7p ag i d10 4f 0.000E+00 ( //r2// )= 0.000E+00 a0 0.0000 0.000E+00 0.000 0.000 sqrtdel= 1.0000 0.000E+00 47 -1 0.70 0.50 ag i d9 5s7p ag i d10 5f 0.000E+00 ( //r2// )= 0.000E+00 a0 0.0000 0.000E+00 0.000 0.000 sqrtdel= 1.0000 0.000E+00 47 -1 0.70 0.50 ag i d9 5s7p ag i d10 6f 0.000E+00 ( //r2// )= 0.000E+00 a0 0.0000 0.000E+00 0.000 0.000 sqrtdel= 1.0000 0.000E+00 47 -1 0.70 0.50 ag i d9 5s7p ag i d10 7f 0.000E+00 ( //r2// )= 0.000E+00 a0 0.0000 0.000E+00 0.000 0.000 sqrtdel= 1.0000 0.000E+00 47 -1 0.70 0.50 ag i d9 5s7p ag i d10 8f 0.000E+00 ( //r2// )= 0.000E+00 a0 0.0000 0.000E+00 0.000 0.000 sqrtdel= 1.0000 0.000E+00 47 -1 0.70 0.50 ag i d9 5s7p ag i d10 9f 0.000E+00 ( //r2// )= 0.000E+00 a0 0.0000 0.000E+00 0.000 0.000 sqrtdel= 1.0000 0.000E+00 47 -1 0.70 0.50 ag i d9 5s7p ag i d9 5s4f -3.739E+02 ( 7p//r2// 4f)=-5.016E+02 a0 -0.9330 3.994E+03-0.574-0.672 sqrtdel= 1.0000 -5.016E+02 47 -1 0.70 0.50 ag i d9 5s7p ag i d9 5s5f 5.055E+02 ( 7p//r2// 5f)= 6.782E+02 a0 0.9367 7.302E+03 0.571 0.817 sqrtdel= 1.0000 6.782E+02 47 -1 0.70 0.50 ag i d9 5s7p ag i d9 5s6f 1.021E+02 ( 7p//r2// 6f)= 1.370E+02 a0 0.3039 2.981E+02 0.318 0.680 sqrtdel= 1.0000 1.370E+02 47 -1 0.70 0.50 ag i d9 5s7p ag i d9 5s7f 3.792E+01 ( 7p//r2// 7f)= 5.088E+01 a0 0.1542 4.109E+01 0.211 0.593 sqrtdel= 1.0000 5.088E+01 47 -1 0.70 0.50 ag i d9 5s7p ag i d9 5s8f 1.838E+01 ( 7p//r2// 8f)= 2.466E+01 a0 0.0949 9.651E+00 0.155 0.542 sqrtdel= 1.0000 2.466E+01 47 -1 0.70 0.50 ag i d9 5s7p ag i d9 5s9f 1.034E+01 ( 7p//r2// 9f)= 1.387E+01 a0 0.0651 3.053E+00 0.120 0.509 sqrtdel= 1.0000 1.387E+01 47 -1 0.70 0.50 ag i d9 5s7p ag i d8 5s2 4f 0.000E+00 ( //r2// )= 0.000E+00 a0 0.0000 0.000E+00 0.000 0.000 sqrtdel= 1.0000 0.000E+00 47 -1 0.70 0.50 ag i d9 5s7p ag i d10 6h 0.000E+00 ( //r2// )= 0.000E+00 a0 0.0000 0.000E+00 0.000 0.000 sqrtdel= 1.0000 0.000E+00 47 -1 0.70 0.50 ag i d9 5s7p ag i d10 7h 0.000E+00 ( //r2// )= 0.000E+00 a0 0.0000 0.000E+00 0.000 0.000 sqrtdel= 1.0000 0.000E+00 47 -1 0.70 0.50 ag i d9 5s7p ag i d10 8h 0.000E+00 ( //r2// )= 0.000E+00 a0 0.0000 0.000E+00 0.000 0.000 sqrtdel= 1.0000 0.000E+00 47 -1 0.70 0.50 ag i d9 5s7p ag i d10 9h 0.000E+00 ( //r2// )= 0.000E+00 a0 0.0000 0.000E+00 0.000 0.000 sqrtdel= 1.0000 0.000E+00 47 -1 0.70 0.50 ag i d9 5s7p ag i d9 5s6h 0.000E+00 ( //r2// )= 0.000E+00 a0 0.0000 0.000E+00 0.000 0.000 sqrtdel= 1.0000 0.000E+00 47 -1 0.70 0.50 ag i d9 5s7p ag i d9 5s7h 0.000E+00 ( //r2// )= 0.000E+00 a0 0.0000 0.000E+00 0.000 0.000 sqrtdel= 1.0000 0.000E+00 47 -1 0.70 0.50 ag i d9 5s7p ag i d9 5s8h 0.000E+00 ( //r2// )= 0.000E+00 a0 0.0000 0.000E+00 0.000 0.000 sqrtdel= 1.0000 0.000E+00 47 -1 0.70 0.50 ag i d9 5s7p ag i d9 5s9h 0.000E+00 ( //r2// )= 0.000E+00 a0 0.0000 0.000E+00 0.000 0.000 sqrtdel= 1.0000 0.000E+00 47 -1 0.70 0.50 ag i d9 5s7p ag i d10 8k 0.000E+00 ( //r2// )= 0.000E+00 a0 0.0000 0.000E+00 0.000 0.000 sqrtdel= 1.0000 0.000E+00 47 -1 0.70 0.50 ag i d9 5s7p ag i d10 9k 0.000E+00 ( //r2// )= 0.000E+00 a0 0.0000 0.000E+00 0.000 0.000 sqrtdel= 1.0000 0.000E+00 47 -1 0.70 0.50 ag i d9 5s7p ag i d9 5s8k 0.000E+00 ( //r2// )= 0.000E+00 a0 0.0000 0.000E+00 0.000 0.000 sqrtdel= 1.0000 0.000E+00 47 -1 0.70 0.50 ag i d9 5s7p ag i d9 5s9k 0.000E+00 ( //r2// )= 0.000E+00 a0 0.0000 0.000E+00 0.000 0.000 sqrtdel= 1.0000 0.000E+00 47 -1 0.70 0.50 ag i d9 5s8p ag i d10 5p 0.000E+00 ( //r2// )= 0.000E+00 a0 0.0000 0.000E+00 0.000 0.000 sqrtdel= 1.0000 0.000E+00 47 -1 0.70 0.50 ag i d9 5s8p ag i d10 6p 0.000E+00 ( //r2// )= 0.000E+00 a0 0.0000 0.000E+00 0.000 0.000 sqrtdel= 1.0000 0.000E+00 47 -1 0.70 0.50 ag i d9 5s8p ag i d10 7p 0.000E+00 ( //r2// )= 0.000E+00 a0 0.0000 0.000E+00 0.000 0.000 sqrtdel= 1.0000 0.000E+00 47 -1 0.70 0.50 ag i d9 5s8p ag i d10 8p -3.169E+00 ( 5s//r2// 4d)=-3.169E+00 a0 -0.9615 6.695E-01-0.449-0.676 sqrtdel= 1.0000 -3.169E+00 47 -1 0.70 0.50 ag i d9 5s8p ag i d10 9p 0.000E+00 ( //r2// )= 0.000E+00 a0 0.0000 0.000E+00 0.000 0.000 sqrtdel= 1.0000 0.000E+00 47 -1 0.70 0.50 ag i d9 5s8p ag i d9 5s5p -3.486E+00 ( 8p//r2// 5p)= 3.819E+00 a0 -0.4718 4.052E+00-0.005-0.031 sqrtdel= 1.0000 3.819E+00 47 -1 0.70 0.50 ag i d9 5s8p ag i d9 5s6p -2.924E+01 ( 8p//r2// 6p)= 3.203E+01 a0 -0.3424 2.849E+02-0.003-0.008 sqrtdel= 1.0000 3.203E+01 47 -1 0.70 0.50 ag i d9 5s8p ag i d9 5s7p -3.005E+02 ( 8p//r2// 7p)= 3.292E+02 a0 -0.6178 3.011E+04-0.002-0.004 sqrtdel= 1.0000 3.292E+02 47 -1 0.70 0.50 ag i d9 5s8p ag i d9 5s8p 1.394E+03 ( 8p//r2// 8p)=-1.527E+03 a0 1.0000 6.480E+05 1.000 1.000 sqrtdel= 1.0000 -1.527E+03 47 -1 0.70 0.50 ag i d9 5s8p ag i d9 5s9p -7.085E+02 ( 8p//r2// 9p)= 7.761E+02 a0 -0.5805 1.673E+05-0.002-0.003 sqrtdel= 1.0000 7.761E+02 47 -1 0.70 0.50 ag i d9 5s8p ag i d8 5s2 5p 0.000E+00 ( //r2// )= 0.000E+00 a0 0.0000 0.000E+00 0.000 0.000 sqrtdel= 1.0000 0.000E+00 47 -1 0.70 0.50 ag i d9 5s8p ag i d10 4f 0.000E+00 ( //r2// )= 0.000E+00 a0 0.0000 0.000E+00 0.000 0.000 sqrtdel= 1.0000 0.000E+00 47 -1 0.70 0.50 ag i d9 5s8p ag i d10 5f 0.000E+00 ( //r2// )= 0.000E+00 a0 0.0000 0.000E+00 0.000 0.000 sqrtdel= 1.0000 0.000E+00 47 -1 0.70 0.50 ag i d9 5s8p ag i d10 6f 0.000E+00 ( //r2// )= 0.000E+00 a0 0.0000 0.000E+00 0.000 0.000 sqrtdel= 1.0000 0.000E+00 47 -1 0.70 0.50 ag i d9 5s8p ag i d10 7f 0.000E+00 ( //r2// )= 0.000E+00 a0 0.0000 0.000E+00 0.000 0.000 sqrtdel= 1.0000 0.000E+00 47 -1 0.70 0.50 ag i d9 5s8p ag i d10 8f 0.000E+00 ( //r2// )= 0.000E+00 a0 0.0000 0.000E+00 0.000 0.000 sqrtdel= 1.0000 0.000E+00 47 -1 0.70 0.50 ag i d9 5s8p ag i d10 9f 0.000E+00 ( //r2// )= 0.000E+00 a0 0.0000 0.000E+00 0.000 0.000 sqrtdel= 1.0000 0.000E+00 47 -1 0.70 0.50 ag i d9 5s8p ag i d9 5s4f 1.176E+02 ( 8p//r2// 4f)= 1.578E+02 a0 0.3749 3.952E+02-0.038-0.070 sqrtdel= 1.0000 1.578E+02 47 -1 0.70 0.50 ag i d9 5s8p ag i d9 5s5f -1.156E+03 ( 8p//r2// 5f)=-1.551E+03 a0 -0.9747 3.819E+04-0.733-0.821 sqrtdel= 1.0000 -1.551E+03 47 -1 0.70 0.50 ag i d9 5s8p ag i d9 5s6f 1.077E+03 ( 8p//r2// 6f)= 1.445E+03 a0 0.8435 3.317E+04 0.419 0.623 sqrtdel= 1.0000 1.445E+03 47 -1 0.70 0.50 ag i d9 5s8p ag i d9 5s7f 2.468E+02 ( 8p//r2// 7f)= 3.312E+02 a0 0.2890 1.741E+03 0.263 0.552 sqrtdel= 1.0000 3.312E+02 47 -1 0.70 0.50 ag i d9 5s8p ag i d9 5s8f 1.027E+02 ( 8p//r2// 8f)= 1.378E+02 a0 0.1590 3.014E+02 0.186 0.496 sqrtdel= 1.0000 1.378E+02 47 -1 0.70 0.50 ag i d9 5s8p ag i d9 5s9f 5.553E+01 ( 8p//r2// 9f)= 7.450E+01 a0 0.1065 8.810E+01 0.142 0.460 sqrtdel= 1.0000 7.450E+01 47 -1 0.70 0.50 ag i d9 5s8p ag i d8 5s2 4f 0.000E+00 ( //r2// )= 0.000E+00 a0 0.0000 0.000E+00 0.000 0.000 sqrtdel= 1.0000 0.000E+00 47 -1 0.70 0.50 ag i d9 5s8p ag i d10 6h 0.000E+00 ( //r2// )= 0.000E+00 a0 0.0000 0.000E+00 0.000 0.000 sqrtdel= 1.0000 0.000E+00 47 -1 0.70 0.50 ag i d9 5s8p ag i d10 7h 0.000E+00 ( //r2// )= 0.000E+00 a0 0.0000 0.000E+00 0.000 0.000 sqrtdel= 1.0000 0.000E+00 47 -1 0.70 0.50 ag i d9 5s8p ag i d10 8h 0.000E+00 ( //r2// )= 0.000E+00 a0 0.0000 0.000E+00 0.000 0.000 sqrtdel= 1.0000 0.000E+00 47 -1 0.70 0.50 ag i d9 5s8p ag i d10 9h 0.000E+00 ( //r2// )= 0.000E+00 a0 0.0000 0.000E+00 0.000 0.000 sqrtdel= 1.0000 0.000E+00 47 -1 0.70 0.50 ag i d9 5s8p ag i d9 5s6h 0.000E+00 ( //r2// )= 0.000E+00 a0 0.0000 0.000E+00 0.000 0.000 sqrtdel= 1.0000 0.000E+00 47 -1 0.70 0.50 ag i d9 5s8p ag i d9 5s7h 0.000E+00 ( //r2// )= 0.000E+00 a0 0.0000 0.000E+00 0.000 0.000 sqrtdel= 1.0000 0.000E+00 47 -1 0.70 0.50 ag i d9 5s8p ag i d9 5s8h 0.000E+00 ( //r2// )= 0.000E+00 a0 0.0000 0.000E+00 0.000 0.000 sqrtdel= 1.0000 0.000E+00 47 -1 0.70 0.50 ag i d9 5s8p ag i d9 5s9h 0.000E+00 ( //r2// )= 0.000E+00 a0 0.0000 0.000E+00 0.000 0.000 sqrtdel= 1.0000 0.000E+00 47 -1 0.70 0.50 ag i d9 5s8p ag i d10 8k 0.000E+00 ( //r2// )= 0.000E+00 a0 0.0000 0.000E+00 0.000 0.000 sqrtdel= 1.0000 0.000E+00 47 -1 0.70 0.50 ag i d9 5s8p ag i d10 9k 0.000E+00 ( //r2// )= 0.000E+00 a0 0.0000 0.000E+00 0.000 0.000 sqrtdel= 1.0000 0.000E+00 47 -1 0.70 0.50 ag i d9 5s8p ag i d9 5s8k 0.000E+00 ( //r2// )= 0.000E+00 a0 0.0000 0.000E+00 0.000 0.000 sqrtdel= 1.0000 0.000E+00 47 -1 0.70 0.50 ag i d9 5s8p ag i d9 5s9k 0.000E+00 ( //r2// )= 0.000E+00 a0 0.0000 0.000E+00 0.000 0.000 sqrtdel= 1.0000 0.000E+00 47 -1 0.70 0.50 ag i d9 5s9p ag i d10 5p 0.000E+00 ( //r2// )= 0.000E+00 a0 0.0000 0.000E+00 0.000 0.000 sqrtdel= 1.0000 0.000E+00 47 -1 0.70 0.50 ag i d9 5s9p ag i d10 6p 0.000E+00 ( //r2// )= 0.000E+00 a0 0.0000 0.000E+00 0.000 0.000 sqrtdel= 1.0000 0.000E+00 47 -1 0.70 0.50 ag i d9 5s9p ag i d10 7p 0.000E+00 ( //r2// )= 0.000E+00 a0 0.0000 0.000E+00 0.000 0.000 sqrtdel= 1.0000 0.000E+00 47 -1 0.70 0.50 ag i d9 5s9p ag i d10 8p 0.000E+00 ( //r2// )= 0.000E+00 a0 0.0000 0.000E+00 0.000 0.000 sqrtdel= 1.0000 0.000E+00 47 -1 0.70 0.50 ag i d9 5s9p ag i d10 9p -3.167E+00 ( 5s//r2// 4d)=-3.167E+00 a0 -0.9615 6.688E-01-0.449-0.676 sqrtdel= 1.0000 -3.167E+00 47 -1 0.70 0.50 ag i d9 5s9p ag i d9 5s5p -2.379E+00 ( 9p//r2// 5p)= 2.606E+00 a0 -0.4349 1.886E+00-0.004-0.032 sqrtdel= 1.0000 2.606E+00 47 -1 0.70 0.50 ag i d9 5s9p ag i d9 5s6p -1.547E+01 ( 9p//r2// 6p)= 1.695E+01 a0 -0.2542 7.982E+01-0.002-0.009 sqrtdel= 1.0000 1.695E+01 47 -1 0.70 0.50 ag i d9 5s9p ag i d9 5s7p -8.361E+01 ( 9p//r2// 7p)= 9.159E+01 a0 -0.2688 2.330E+03-0.002-0.005 sqrtdel= 1.0000 9.159E+01 47 -1 0.70 0.50 ag i d9 5s9p ag i d9 5s8p -7.085E+02 ( 9p//r2// 8p)= 7.761E+02 a0 -0.5805 1.673E+05-0.002-0.003 sqrtdel= 1.0000 7.761E+02 47 -1 0.70 0.50 ag i d9 5s9p ag i d9 5s9p 2.966E+03 ( 9p//r2// 9p)=-3.249E+03 a0 1.0000 2.933E+06 1.000 1.000 sqrtdel= 1.0000 -3.249E+03 47 -1 0.70 0.50 ag i d9 5s9p ag i d8 5s2 5p 0.000E+00 ( //r2// )= 0.000E+00 a0 0.0000 0.000E+00 0.000 0.000 sqrtdel= 1.0000 0.000E+00 47 -1 0.70 0.50 ag i d9 5s9p ag i d10 4f 0.000E+00 ( //r2// )= 0.000E+00 a0 0.0000 0.000E+00 0.000 0.000 sqrtdel= 1.0000 0.000E+00 47 -1 0.70 0.50 ag i d9 5s9p ag i d10 5f 0.000E+00 ( //r2// )= 0.000E+00 a0 0.0000 0.000E+00 0.000 0.000 sqrtdel= 1.0000 0.000E+00 47 -1 0.70 0.50 ag i d9 5s9p ag i d10 6f 0.000E+00 ( //r2// )= 0.000E+00 a0 0.0000 0.000E+00 0.000 0.000 sqrtdel= 1.0000 0.000E+00 47 -1 0.70 0.50 ag i d9 5s9p ag i d10 7f 0.000E+00 ( //r2// )= 0.000E+00 a0 0.0000 0.000E+00 0.000 0.000 sqrtdel= 1.0000 0.000E+00 47 -1 0.70 0.50 ag i d9 5s9p ag i d10 8f 0.000E+00 ( //r2// )= 0.000E+00 a0 0.0000 0.000E+00 0.000 0.000 sqrtdel= 1.0000 0.000E+00 47 -1 0.70 0.50 ag i d9 5s9p ag i d10 9f 0.000E+00 ( //r2// )= 0.000E+00 a0 0.0000 0.000E+00 0.000 0.000 sqrtdel= 1.0000 0.000E+00 47 -1 0.70 0.50 ag i d9 5s9p ag i d9 5s4f 2.850E+01 ( 9p//r2// 4f)= 3.824E+01 a0 0.1379 2.321E+01-0.021-0.057 sqrtdel= 1.0000 3.824E+01 47 -1 0.70 0.50 ag i d9 5s9p ag i d9 5s5f 3.834E+02 ( 9p//r2// 5f)= 5.144E+02 a0 0.3962 4.200E+03-0.046-0.076 sqrtdel= 1.0000 5.144E+02 47 -1 0.70 0.50 ag i d9 5s9p ag i d9 5s6f -2.656E+03 ( 9p//r2// 6f)=-3.563E+03 a0 -0.9883 2.015E+05-0.817-0.890 sqrtdel= 1.0000 -3.563E+03 47 -1 0.70 0.50 ag i d9 5s9p ag i d9 5s7f 2.006E+03 ( 9p//r2// 7f)= 2.691E+03 a0 0.7655 1.150E+05 0.319 0.473 sqrtdel= 1.0000 2.691E+03 47 -1 0.70 0.50 ag i d9 5s9p ag i d9 5s8f 4.827E+02 ( 9p//r2// 8f)= 6.477E+02 a0 0.2640 6.658E+03 0.215 0.438 sqrtdel= 1.0000 6.477E+02 47 -1 0.70 0.50 ag i d9 5s9p ag i d9 5s9f 2.094E+02 ( 9p//r2// 9f)= 2.809E+02 a0 0.1475 1.252E+03 0.159 0.401 sqrtdel= 1.0000 2.809E+02 47 -1 0.70 0.50 ag i d9 5s9p ag i d8 5s2 4f 0.000E+00 ( //r2// )= 0.000E+00 a0 0.0000 0.000E+00 0.000 0.000 sqrtdel= 1.0000 0.000E+00 47 -1 0.70 0.50 ag i d9 5s9p ag i d10 6h 0.000E+00 ( //r2// )= 0.000E+00 a0 0.0000 0.000E+00 0.000 0.000 sqrtdel= 1.0000 0.000E+00 47 -1 0.70 0.50 ag i d9 5s9p ag i d10 7h 0.000E+00 ( //r2// )= 0.000E+00 a0 0.0000 0.000E+00 0.000 0.000 sqrtdel= 1.0000 0.000E+00 47 -1 0.70 0.50 ag i d9 5s9p ag i d10 8h 0.000E+00 ( //r2// )= 0.000E+00 a0 0.0000 0.000E+00 0.000 0.000 sqrtdel= 1.0000 0.000E+00 47 -1 0.70 0.50 ag i d9 5s9p ag i d10 9h 0.000E+00 ( //r2// )= 0.000E+00 a0 0.0000 0.000E+00 0.000 0.000 sqrtdel= 1.0000 0.000E+00 47 -1 0.70 0.50 ag i d9 5s9p ag i d9 5s6h 0.000E+00 ( //r2// )= 0.000E+00 a0 0.0000 0.000E+00 0.000 0.000 sqrtdel= 1.0000 0.000E+00 47 -1 0.70 0.50 ag i d9 5s9p ag i d9 5s7h 0.000E+00 ( //r2// )= 0.000E+00 a0 0.0000 0.000E+00 0.000 0.000 sqrtdel= 1.0000 0.000E+00 47 -1 0.70 0.50 ag i d9 5s9p ag i d9 5s8h 0.000E+00 ( //r2// )= 0.000E+00 a0 0.0000 0.000E+00 0.000 0.000 sqrtdel= 1.0000 0.000E+00 47 -1 0.70 0.50 ag i d9 5s9p ag i d9 5s9h 0.000E+00 ( //r2// )= 0.000E+00 a0 0.0000 0.000E+00 0.000 0.000 sqrtdel= 1.0000 0.000E+00 47 -1 0.70 0.50 ag i d9 5s9p ag i d10 8k 0.000E+00 ( //r2// )= 0.000E+00 a0 0.0000 0.000E+00 0.000 0.000 sqrtdel= 1.0000 0.000E+00 47 -1 0.70 0.50 ag i d9 5s9p ag i d10 9k 0.000E+00 ( //r2// )= 0.000E+00 a0 0.0000 0.000E+00 0.000 0.000 sqrtdel= 1.0000 0.000E+00 47 -1 0.70 0.50 ag i d9 5s9p ag i d9 5s8k 0.000E+00 ( //r2// )= 0.000E+00 a0 0.0000 0.000E+00 0.000 0.000 sqrtdel= 1.0000 0.000E+00 47 -1 0.70 0.50 ag i d9 5s9p ag i d9 5s9k 0.000E+00 ( //r2// )= 0.000E+00 a0 0.0000 0.000E+00 0.000 0.000 sqrtdel= 1.0000 0.000E+00 47 -1 0.70 0.50 ag i d8 5s2 5p ag i d10 5p 0.000E+00 ( //r2// )= 0.000E+00 a0 0.0000 0.000E+00 0.000 0.000 sqrtdel= 1.0000 0.000E+00 47 -1 0.70 0.50 ag i d8 5s2 5p ag i d10 6p 0.000E+00 ( //r2// )= 0.000E+00 a0 0.0000 0.000E+00 0.000 0.000 sqrtdel= 1.0000 0.000E+00 47 -1 0.70 0.50 ag i d8 5s2 5p ag i d10 7p 0.000E+00 ( //r2// )= 0.000E+00 a0 0.0000 0.000E+00 0.000 0.000 sqrtdel= 1.0000 0.000E+00 47 -1 0.70 0.50 ag i d8 5s2 5p ag i d10 8p 0.000E+00 ( //r2// )= 0.000E+00 a0 0.0000 0.000E+00 0.000 0.000 sqrtdel= 1.0000 0.000E+00 47 -1 0.70 0.50 ag i d8 5s2 5p ag i d10 9p 0.000E+00 ( //r2// )= 0.000E+00 a0 0.0000 0.000E+00 0.000 0.000 sqrtdel= 1.0000 0.000E+00 47 -1 0.70 0.50 ag i d8 5s2 5p ag i d9 5s5p -2.874E+00 ( 5s//r2// 4d)=-2.874E+00 a0 -0.9576 5.506E-01-0.417-0.657 sqrtdel= 1.0000 -2.874E+00 47 -1 0.70 0.50 ag i d8 5s2 5p ag i d9 5s6p 0.000E+00 ( //r2// )= 0.000E+00 a0 0.0000 0.000E+00 0.000 0.000 sqrtdel= 1.0000 0.000E+00 47 -1 0.70 0.50 ag i d8 5s2 5p ag i d9 5s7p 0.000E+00 ( //r2// )= 0.000E+00 a0 0.0000 0.000E+00 0.000 0.000 sqrtdel= 1.0000 0.000E+00 47 -1 0.70 0.50 ag i d8 5s2 5p ag i d9 5s8p 0.000E+00 ( //r2// )= 0.000E+00 a0 0.0000 0.000E+00 0.000 0.000 sqrtdel= 1.0000 0.000E+00 47 -1 0.70 0.50 ag i d8 5s2 5p ag i d9 5s9p 0.000E+00 ( //r2// )= 0.000E+00 a0 0.0000 0.000E+00 0.000 0.000 sqrtdel= 1.0000 0.000E+00 47 -1 0.70 0.50 ag i d8 5s2 5p ag i d8 5s2 5p 1.757E+01 ( 5p//r2// 5p)=-1.924E+01 a0 1.0000 1.029E+02 1.000 1.000 sqrtdel= 1.0000 -1.924E+01 47 -1 0.70 0.50 ag i d8 5s2 5p ag i d10 4f 0.000E+00 ( //r2// )= 0.000E+00 a0 0.0000 0.000E+00 0.000 0.000 sqrtdel= 1.0000 0.000E+00 47 -1 0.70 0.50 ag i d8 5s2 5p ag i d10 5f 0.000E+00 ( //r2// )= 0.000E+00 a0 0.0000 0.000E+00 0.000 0.000 sqrtdel= 1.0000 0.000E+00 47 -1 0.70 0.50 ag i d8 5s2 5p ag i d10 6f 0.000E+00 ( //r2// )= 0.000E+00 a0 0.0000 0.000E+00 0.000 0.000 sqrtdel= 1.0000 0.000E+00 47 -1 0.70 0.50 ag i d8 5s2 5p ag i d10 7f 0.000E+00 ( //r2// )= 0.000E+00 a0 0.0000 0.000E+00 0.000 0.000 sqrtdel= 1.0000 0.000E+00 47 -1 0.70 0.50 ag i d8 5s2 5p ag i d10 8f 0.000E+00 ( //r2// )= 0.000E+00 a0 0.0000 0.000E+00 0.000 0.000 sqrtdel= 1.0000 0.000E+00 47 -1 0.70 0.50 ag i d8 5s2 5p ag i d10 9f 0.000E+00 ( //r2// )= 0.000E+00 a0 0.0000 0.000E+00 0.000 0.000 sqrtdel= 1.0000 0.000E+00 47 -1 0.70 0.50 ag i d8 5s2 5p ag i d9 5s4f 0.000E+00 ( //r2// )= 0.000E+00 a0 0.0000 0.000E+00 0.000 0.000 sqrtdel= 1.0000 0.000E+00 47 -1 0.70 0.50 ag i d8 5s2 5p ag i d9 5s5f 0.000E+00 ( //r2// )= 0.000E+00 a0 0.0000 0.000E+00 0.000 0.000 sqrtdel= 1.0000 0.000E+00 47 -1 0.70 0.50 ag i d8 5s2 5p ag i d9 5s6f 0.000E+00 ( //r2// )= 0.000E+00 a0 0.0000 0.000E+00 0.000 0.000 sqrtdel= 1.0000 0.000E+00 47 -1 0.70 0.50 ag i d8 5s2 5p ag i d9 5s7f 0.000E+00 ( //r2// )= 0.000E+00 a0 0.0000 0.000E+00 0.000 0.000 sqrtdel= 1.0000 0.000E+00 47 -1 0.70 0.50 ag i d8 5s2 5p ag i d9 5s8f 0.000E+00 ( //r2// )= 0.000E+00 a0 0.0000 0.000E+00 0.000 0.000 sqrtdel= 1.0000 0.000E+00 47 -1 0.70 0.50 ag i d8 5s2 5p ag i d9 5s9f 0.000E+00 ( //r2// )= 0.000E+00 a0 0.0000 0.000E+00 0.000 0.000 sqrtdel= 1.0000 0.000E+00 47 -1 0.70 0.50 ag i d8 5s2 5p ag i d8 5s2 4f -8.645E+00 ( 5p//r2// 4f)=-1.160E+01 a0 -1.0000 2.135E+00-0.131-0.999 sqrtdel= 1.0000 -1.160E+01 47 -1 0.70 0.50 ag i d8 5s2 5p ag i d10 6h 0.000E+00 ( //r2// )= 0.000E+00 a0 0.0000 0.000E+00 0.000 0.000 sqrtdel= 1.0000 0.000E+00 47 -1 0.70 0.50 ag i d8 5s2 5p ag i d10 7h 0.000E+00 ( //r2// )= 0.000E+00 a0 0.0000 0.000E+00 0.000 0.000 sqrtdel= 1.0000 0.000E+00 47 -1 0.70 0.50 ag i d8 5s2 5p ag i d10 8h 0.000E+00 ( //r2// )= 0.000E+00 a0 0.0000 0.000E+00 0.000 0.000 sqrtdel= 1.0000 0.000E+00 47 -1 0.70 0.50 ag i d8 5s2 5p ag i d10 9h 0.000E+00 ( //r2// )= 0.000E+00 a0 0.0000 0.000E+00 0.000 0.000 sqrtdel= 1.0000 0.000E+00 47 -1 0.70 0.50 ag i d8 5s2 5p ag i d9 5s6h 0.000E+00 ( //r2// )= 0.000E+00 a0 0.0000 0.000E+00 0.000 0.000 sqrtdel= 1.0000 0.000E+00 47 -1 0.70 0.50 ag i d8 5s2 5p ag i d9 5s7h 0.000E+00 ( //r2// )= 0.000E+00 a0 0.0000 0.000E+00 0.000 0.000 sqrtdel= 1.0000 0.000E+00 47 -1 0.70 0.50 ag i d8 5s2 5p ag i d9 5s8h 0.000E+00 ( //r2// )= 0.000E+00 a0 0.0000 0.000E+00 0.000 0.000 sqrtdel= 1.0000 0.000E+00 47 -1 0.70 0.50 ag i d8 5s2 5p ag i d9 5s9h 0.000E+00 ( //r2// )= 0.000E+00 a0 0.0000 0.000E+00 0.000 0.000 sqrtdel= 1.0000 0.000E+00 47 -1 0.70 0.50 ag i d8 5s2 5p ag i d10 8k 0.000E+00 ( //r2// )= 0.000E+00 a0 0.0000 0.000E+00 0.000 0.000 sqrtdel= 1.0000 0.000E+00 47 -1 0.70 0.50 ag i d8 5s2 5p ag i d10 9k 0.000E+00 ( //r2// )= 0.000E+00 a0 0.0000 0.000E+00 0.000 0.000 sqrtdel= 1.0000 0.000E+00 47 -1 0.70 0.50 ag i d8 5s2 5p ag i d9 5s8k 0.000E+00 ( //r2// )= 0.000E+00 a0 0.0000 0.000E+00 0.000 0.000 sqrtdel= 1.0000 0.000E+00 47 -1 0.70 0.50 ag i d8 5s2 5p ag i d9 5s9k 0.000E+00 ( //r2// )= 0.000E+00 a0 0.0000 0.000E+00 0.000 0.000 sqrtdel= 1.0000 0.000E+00 47 -1 0.70 0.50 ag i d10 4f ag i d10 5p -2.076E+01 ( 4f//r2// 5p)=-2.785E+01 a0 -1.0000 1.231E+01-0.223-1.000 sqrtdel= 1.0000 -2.785E+01 47 -1 0.70 0.50 ag i d10 4f ag i d10 6p 2.085E+02 ( 4f//r2// 6p)= 2.798E+02 a0 0.9985 1.242E+03 0.832 0.979 sqrtdel= 1.0000 2.798E+02 47 -1 0.70 0.50 ag i d10 4f ag i d10 7p -3.699E+02 ( 4f//r2// 7p)=-4.963E+02 a0 -0.9162 3.910E+03-0.513-0.620 sqrtdel= 1.0000 -4.963E+02 47 -1 0.70 0.50 ag i d10 4f ag i d10 8p 9.452E+01 ( 4f//r2// 8p)= 1.268E+02 a0 0.3110 2.553E+02-0.049-0.093 sqrtdel= 1.0000 1.268E+02 47 -1 0.70 0.50 ag i d10 4f ag i d10 9p 2.536E+01 ( 4f//r2// 9p)= 3.402E+01 a0 0.1255 1.837E+01-0.025-0.068 sqrtdel= 1.0000 3.402E+01 47 -1 0.70 0.50 ag i d10 4f ag i d9 5s5p 0.000E+00 ( //r2// )= 0.000E+00 a0 0.0000 0.000E+00 0.000 0.000 sqrtdel= 1.0000 0.000E+00 47 -1 0.70 0.50 ag i d10 4f ag i d9 5s6p 0.000E+00 ( //r2// )= 0.000E+00 a0 0.0000 0.000E+00 0.000 0.000 sqrtdel= 1.0000 0.000E+00 47 -1 0.70 0.50 ag i d10 4f ag i d9 5s7p 0.000E+00 ( //r2// )= 0.000E+00 a0 0.0000 0.000E+00 0.000 0.000 sqrtdel= 1.0000 0.000E+00 47 -1 0.70 0.50 ag i d10 4f ag i d9 5s8p 0.000E+00 ( //r2// )= 0.000E+00 a0 0.0000 0.000E+00 0.000 0.000 sqrtdel= 1.0000 0.000E+00 47 -1 0.70 0.50 ag i d10 4f ag i d9 5s9p 0.000E+00 ( //r2// )= 0.000E+00 a0 0.0000 0.000E+00 0.000 0.000 sqrtdel= 1.0000 0.000E+00 47 -1 0.70 0.50 ag i d10 4f ag i d8 5s2 5p 0.000E+00 ( //r2// )= 0.000E+00 a0 0.0000 0.000E+00 0.000 0.000 sqrtdel= 1.0000 0.000E+00 47 -1 0.70 0.50 ag i d10 4f ag i d10 4f 3.595E+02 ( 4f//r2// 4f)=-4.911E+02 a0 1.0000 3.692E+03 1.000 1.000 sqrtdel= 1.0000 -4.911E+02 47 -1 0.70 0.50 ag i d10 4f ag i d10 5f -2.363E+02 ( 4f//r2// 5f)= 3.229E+02 a0 -0.6768 1.596E+03 0.000-0.001 sqrtdel= 1.0000 3.229E+02 47 -1 0.70 0.50 ag i d10 4f ag i d10 6f -5.623E+01 ( 4f//r2// 6f)= 7.683E+01 a0 -0.2520 9.035E+01 0.000-0.001 sqrtdel= 1.0000 7.683E+01 47 -1 0.70 0.50 ag i d10 4f ag i d10 7f -2.619E+01 ( 4f//r2// 7f)= 3.578E+01 a0 -0.1589 1.960E+01 0.000-0.001 sqrtdel= 1.0000 3.578E+01 47 -1 0.70 0.50 ag i d10 4f ag i d10 8f -1.583E+01 ( 4f//r2// 8f)= 2.162E+01 a0 -0.1216 7.158E+00 0.000-0.001 sqrtdel= 1.0000 2.162E+01 47 -1 0.70 0.50 ag i d10 4f ag i d10 9f -1.094E+01 ( 4f//r2// 9f)= 1.495E+01 a0 -0.1024 3.420E+00 0.000-0.001 sqrtdel= 1.0000 1.495E+01 47 -1 0.70 0.50 ag i d10 4f ag i d9 5s4f -3.165E+00 ( 4d//r2// 5s)=-3.165E+00 a0 -0.9614 6.680E-01-0.449-0.676 sqrtdel= 1.0000 -3.165E+00 47 -1 0.70 0.50 ag i d10 4f ag i d9 5s5f 0.000E+00 ( //r2// )= 0.000E+00 a0 0.0000 0.000E+00 0.000 0.000 sqrtdel= 1.0000 0.000E+00 47 -1 0.70 0.50 ag i d10 4f ag i d9 5s6f 0.000E+00 ( //r2// )= 0.000E+00 a0 0.0000 0.000E+00 0.000 0.000 sqrtdel= 1.0000 0.000E+00 47 -1 0.70 0.50 ag i d10 4f ag i d9 5s7f 0.000E+00 ( //r2// )= 0.000E+00 a0 0.0000 0.000E+00 0.000 0.000 sqrtdel= 1.0000 0.000E+00 47 -1 0.70 0.50 ag i d10 4f ag i d9 5s8f 0.000E+00 ( //r2// )= 0.000E+00 a0 0.0000 0.000E+00 0.000 0.000 sqrtdel= 1.0000 0.000E+00 47 -1 0.70 0.50 ag i d10 4f ag i d9 5s9f 0.000E+00 ( //r2// )= 0.000E+00 a0 0.0000 0.000E+00 0.000 0.000 sqrtdel= 1.0000 0.000E+00 47 -1 0.70 0.50 ag i d10 4f ag i d8 5s2 4f 0.000E+00 ( //r2// )= 0.000E+00 a0 0.0000 0.000E+00 0.000 0.000 sqrtdel= 1.0000 0.000E+00 47 -1 0.70 0.50 ag i d10 4f ag i d10 6h 3.338E+02 ( 4f//r2// 6h)= 6.094E+02 a0 1.0000 1.125E+03 0.439 1.000 sqrtdel= 1.0000 6.094E+02 47 -1 0.70 0.50 ag i d10 4f ag i d10 7h 1.793E+02 ( 4f//r2// 7h)= 3.273E+02 a0 0.8182 3.246E+02 0.329 0.957 sqrtdel= 1.0000 3.273E+02 47 -1 0.70 0.50 ag i d10 4f ag i d10 8h 1.148E+02 ( 4f//r2// 8h)= 2.096E+02 a0 0.6874 1.331E+02 0.254 0.913 sqrtdel= 1.0000 2.096E+02 47 -1 0.70 0.50 ag i d10 4f ag i d10 9h 8.186E+01 ( 4f//r2// 9h)= 1.494E+02 a0 0.6088 6.768E+01 0.203 0.881 sqrtdel= 1.0000 1.494E+02 47 -1 0.70 0.50 ag i d10 4f ag i d9 5s6h 0.000E+00 ( //r2// )= 0.000E+00 a0 0.0000 0.000E+00 0.000 0.000 sqrtdel= 1.0000 0.000E+00 47 -1 0.70 0.50 ag i d10 4f ag i d9 5s7h 0.000E+00 ( //r2// )= 0.000E+00 a0 0.0000 0.000E+00 0.000 0.000 sqrtdel= 1.0000 0.000E+00 47 -1 0.70 0.50 ag i d10 4f ag i d9 5s8h 0.000E+00 ( //r2// )= 0.000E+00 a0 0.0000 0.000E+00 0.000 0.000 sqrtdel= 1.0000 0.000E+00 47 -1 0.70 0.50 ag i d10 4f ag i d9 5s9h 0.000E+00 ( //r2// )= 0.000E+00 a0 0.0000 0.000E+00 0.000 0.000 sqrtdel= 1.0000 0.000E+00 47 -1 0.70 0.50 ag i d10 4f ag i d10 8k 0.000E+00 ( //r2// )= 0.000E+00 a0 0.0000 0.000E+00 0.000 0.000 sqrtdel= 1.0000 0.000E+00 47 -1 0.70 0.50 ag i d10 4f ag i d10 9k 0.000E+00 ( //r2// )= 0.000E+00 a0 0.0000 0.000E+00 0.000 0.000 sqrtdel= 1.0000 0.000E+00 47 -1 0.70 0.50 ag i d10 4f ag i d9 5s8k 0.000E+00 ( //r2// )= 0.000E+00 a0 0.0000 0.000E+00 0.000 0.000 sqrtdel= 1.0000 0.000E+00 47 -1 0.70 0.50 ag i d10 4f ag i d9 5s9k 0.000E+00 ( //r2// )= 0.000E+00 a0 0.0000 0.000E+00 0.000 0.000 sqrtdel= 1.0000 0.000E+00 47 -1 0.70 0.50 ag i d10 5f ag i d10 5p -1.324E+01 ( 5f//r2// 5p)=-1.776E+01 a0 -0.9661 5.007E+00-0.171-0.995 sqrtdel= 1.0000 -1.776E+01 47 -1 0.70 0.50 ag i d10 5f ag i d10 6p 1.129E+01 ( 5f//r2// 6p)= 1.514E+01 a0 0.0982 3.639E+00 0.311 0.667 sqrtdel= 1.0000 1.514E+01 47 -1 0.70 0.50 ag i d10 5f ag i d10 7p 5.742E+02 ( 5f//r2// 7p)= 7.704E+02 a0 0.9581 9.421E+03 0.645 0.874 sqrtdel= 1.0000 7.704E+02 47 -1 0.70 0.50 ag i d10 5f ag i d10 8p -1.151E+03 ( 5f//r2// 8p)=-1.544E+03 a0 -0.9626 3.782E+04-0.675-0.777 sqrtdel= 1.0000 -1.544E+03 47 -1 0.70 0.50 ag i d10 5f ag i d10 9p 3.145E+02 ( 5f//r2// 9p)= 4.219E+02 a0 0.3337 2.825E+03-0.064-0.108 sqrtdel= 1.0000 4.219E+02 47 -1 0.70 0.50 ag i d10 5f ag i d9 5s5p 0.000E+00 ( //r2// )= 0.000E+00 a0 0.0000 0.000E+00 0.000 0.000 sqrtdel= 1.0000 0.000E+00 47 -1 0.70 0.50 ag i d10 5f ag i d9 5s6p 0.000E+00 ( //r2// )= 0.000E+00 a0 0.0000 0.000E+00 0.000 0.000 sqrtdel= 1.0000 0.000E+00 47 -1 0.70 0.50 ag i d10 5f ag i d9 5s7p 0.000E+00 ( //r2// )= 0.000E+00 a0 0.0000 0.000E+00 0.000 0.000 sqrtdel= 1.0000 0.000E+00 47 -1 0.70 0.50 ag i d10 5f ag i d9 5s8p 0.000E+00 ( //r2// )= 0.000E+00 a0 0.0000 0.000E+00 0.000 0.000 sqrtdel= 1.0000 0.000E+00 47 -1 0.70 0.50 ag i d10 5f ag i d9 5s9p 0.000E+00 ( //r2// )= 0.000E+00 a0 0.0000 0.000E+00 0.000 0.000 sqrtdel= 1.0000 0.000E+00 47 -1 0.70 0.50 ag i d10 5f ag i d8 5s2 5p 0.000E+00 ( //r2// )= 0.000E+00 a0 0.0000 0.000E+00 0.000 0.000 sqrtdel= 1.0000 0.000E+00 47 -1 0.70 0.50 ag i d10 5f ag i d10 4f -2.363E+02 ( 5f//r2// 4f)= 3.229E+02 a0 -0.6768 1.596E+03 0.000-0.001 sqrtdel= 1.0000 3.229E+02 47 -1 0.70 0.50 ag i d10 5f ag i d10 5f 1.123E+03 ( 5f//r2// 5f)=-1.534E+03 a0 1.0000 3.602E+04 1.000 1.000 sqrtdel= 1.0000 -1.534E+03 47 -1 0.70 0.50 ag i d10 5f ag i d10 6f -6.383E+02 ( 5f//r2// 6f)= 8.721E+02 a0 -0.6235 1.164E+04 0.000-0.001 sqrtdel= 1.0000 8.721E+02 47 -1 0.70 0.50 ag i d10 5f ag i d10 7f -1.539E+02 ( 5f//r2// 7f)= 2.103E+02 a0 -0.2231 6.768E+02 0.000-0.001 sqrtdel= 1.0000 2.103E+02 47 -1 0.70 0.50 ag i d10 5f ag i d10 8f -7.148E+01 ( 5f//r2// 8f)= 9.766E+01 a0 -0.1366 1.460E+02 0.000-0.001 sqrtdel= 1.0000 9.766E+01 47 -1 0.70 0.50 ag i d10 5f ag i d10 9f -4.296E+01 ( 5f//r2// 9f)= 5.870E+01 a0 -0.1018 5.274E+01 0.000-0.001 sqrtdel= 1.0000 5.870E+01 47 -1 0.70 0.50 ag i d10 5f ag i d9 5s4f 0.000E+00 ( //r2// )= 0.000E+00 a0 0.0000 0.000E+00 0.000 0.000 sqrtdel= 1.0000 0.000E+00 47 -1 0.70 0.50 ag i d10 5f ag i d9 5s5f -3.165E+00 ( 4d//r2// 5s)=-3.165E+00 a0 -0.9614 6.680E-01-0.449-0.676 sqrtdel= 1.0000 -3.165E+00 47 -1 0.70 0.50 ag i d10 5f ag i d9 5s6f 0.000E+00 ( //r2// )= 0.000E+00 a0 0.0000 0.000E+00 0.000 0.000 sqrtdel= 1.0000 0.000E+00 47 -1 0.70 0.50 ag i d10 5f ag i d9 5s7f 0.000E+00 ( //r2// )= 0.000E+00 a0 0.0000 0.000E+00 0.000 0.000 sqrtdel= 1.0000 0.000E+00 47 -1 0.70 0.50 ag i d10 5f ag i d9 5s8f 0.000E+00 ( //r2// )= 0.000E+00 a0 0.0000 0.000E+00 0.000 0.000 sqrtdel= 1.0000 0.000E+00 47 -1 0.70 0.50 ag i d10 5f ag i d9 5s9f 0.000E+00 ( //r2// )= 0.000E+00 a0 0.0000 0.000E+00 0.000 0.000 sqrtdel= 1.0000 0.000E+00 47 -1 0.70 0.50 ag i d10 5f ag i d8 5s2 4f 0.000E+00 ( //r2// )= 0.000E+00 a0 0.0000 0.000E+00 0.000 0.000 sqrtdel= 1.0000 0.000E+00 47 -1 0.70 0.50 ag i d10 5f ag i d10 6h -1.260E+03 ( 5f//r2// 6h)=-2.301E+03 a0 -0.9885 1.604E+04-0.831-0.929 sqrtdel= 1.0000 -2.301E+03 47 -1 0.70 0.50 ag i d10 5f ag i d10 7h 2.027E+02 ( 5f//r2// 7h)= 3.702E+02 a0 0.2452 4.152E+02-0.129-0.249 sqrtdel= 1.0000 3.702E+02 47 -1 0.70 0.50 ag i d10 5f ag i d10 8h 1.866E+02 ( 5f//r2// 8h)= 3.407E+02 a0 0.3164 3.517E+02 0.001 0.003 sqrtdel= 1.0000 3.407E+02 47 -1 0.70 0.50 ag i d10 5f ag i d10 9h 1.416E+02 ( 5f//r2// 9h)= 2.584E+02 a0 0.3032 2.024E+02 0.036 0.119 sqrtdel= 1.0000 2.584E+02 47 -1 0.70 0.50 ag i d10 5f ag i d9 5s6h 0.000E+00 ( //r2// )= 0.000E+00 a0 0.0000 0.000E+00 0.000 0.000 sqrtdel= 1.0000 0.000E+00 47 -1 0.70 0.50 ag i d10 5f ag i d9 5s7h 0.000E+00 ( //r2// )= 0.000E+00 a0 0.0000 0.000E+00 0.000 0.000 sqrtdel= 1.0000 0.000E+00 47 -1 0.70 0.50 ag i d10 5f ag i d9 5s8h 0.000E+00 ( //r2// )= 0.000E+00 a0 0.0000 0.000E+00 0.000 0.000 sqrtdel= 1.0000 0.000E+00 47 -1 0.70 0.50 ag i d10 5f ag i d9 5s9h 0.000E+00 ( //r2// )= 0.000E+00 a0 0.0000 0.000E+00 0.000 0.000 sqrtdel= 1.0000 0.000E+00 47 -1 0.70 0.50 ag i d10 5f ag i d10 8k 0.000E+00 ( //r2// )= 0.000E+00 a0 0.0000 0.000E+00 0.000 0.000 sqrtdel= 1.0000 0.000E+00 47 -1 0.70 0.50 ag i d10 5f ag i d10 9k 0.000E+00 ( //r2// )= 0.000E+00 a0 0.0000 0.000E+00 0.000 0.000 sqrtdel= 1.0000 0.000E+00 47 -1 0.70 0.50 ag i d10 5f ag i d9 5s8k 0.000E+00 ( //r2// )= 0.000E+00 a0 0.0000 0.000E+00 0.000 0.000 sqrtdel= 1.0000 0.000E+00 47 -1 0.70 0.50 ag i d10 5f ag i d9 5s9k 0.000E+00 ( //r2// )= 0.000E+00 a0 0.0000 0.000E+00 0.000 0.000 sqrtdel= 1.0000 0.000E+00 47 -1 0.70 0.50 ag i d10 6f ag i d10 5p -9.348E+00 ( 6f//r2// 5p)=-1.254E+01 a0 -0.9295 2.497E+00-0.133-0.989 sqrtdel= 1.0000 -1.254E+01 47 -1 0.70 0.50 ag i d10 6f ag i d10 6p -4.455E+00 ( 6f//r2// 6p)=-5.977E+00 a0 -0.0564 5.671E-01 0.170 0.519 sqrtdel= 1.0000 -5.977E+00 47 -1 0.70 0.50 ag i d10 6f ag i d10 7p 8.612E+01 ( 6f//r2// 7p)= 1.155E+02 a0 0.2295 2.119E+02 0.326 0.667 sqrtdel= 1.0000 1.155E+02 47 -1 0.70 0.50 ag i d10 6f ag i d10 8p 1.231E+03 ( 6f//r2// 8p)= 1.651E+03 a0 0.8842 4.326E+04 0.504 0.719 sqrtdel= 1.0000 1.651E+03 47 -1 0.70 0.50 ag i d10 6f ag i d10 9p -2.651E+03 ( 6f//r2// 9p)=-3.557E+03 a0 -0.9801 2.008E+05-0.766-0.856 sqrtdel= 1.0000 -3.557E+03 47 -1 0.70 0.50 ag i d10 6f ag i d9 5s5p 0.000E+00 ( //r2// )= 0.000E+00 a0 0.0000 0.000E+00 0.000 0.000 sqrtdel= 1.0000 0.000E+00 47 -1 0.70 0.50 ag i d10 6f ag i d9 5s6p 0.000E+00 ( //r2// )= 0.000E+00 a0 0.0000 0.000E+00 0.000 0.000 sqrtdel= 1.0000 0.000E+00 47 -1 0.70 0.50 ag i d10 6f ag i d9 5s7p 0.000E+00 ( //r2// )= 0.000E+00 a0 0.0000 0.000E+00 0.000 0.000 sqrtdel= 1.0000 0.000E+00 47 -1 0.70 0.50 ag i d10 6f ag i d9 5s8p 0.000E+00 ( //r2// )= 0.000E+00 a0 0.0000 0.000E+00 0.000 0.000 sqrtdel= 1.0000 0.000E+00 47 -1 0.70 0.50 ag i d10 6f ag i d9 5s9p 0.000E+00 ( //r2// )= 0.000E+00 a0 0.0000 0.000E+00 0.000 0.000 sqrtdel= 1.0000 0.000E+00 47 -1 0.70 0.50 ag i d10 6f ag i d8 5s2 5p 0.000E+00 ( //r2// )= 0.000E+00 a0 0.0000 0.000E+00 0.000 0.000 sqrtdel= 1.0000 0.000E+00 47 -1 0.70 0.50 ag i d10 6f ag i d10 4f -5.623E+01 ( 6f//r2// 4f)= 7.683E+01 a0 -0.2520 9.035E+01 0.000-0.001 sqrtdel= 1.0000 7.683E+01 47 -1 0.70 0.50 ag i d10 6f ag i d10 5f -6.383E+02 ( 6f//r2// 5f)= 8.721E+02 a0 -0.6235 1.164E+04 0.000-0.001 sqrtdel= 1.0000 8.721E+02 47 -1 0.70 0.50 ag i d10 6f ag i d10 6f 2.604E+03 ( 6f//r2// 6f)=-3.558E+03 a0 1.0000 1.938E+05 1.000 1.000 sqrtdel= 1.0000 -3.558E+03 47 -1 0.70 0.50 ag i d10 6f ag i d10 7f -1.349E+03 ( 6f//r2// 7f)= 1.844E+03 a0 -0.5850 5.202E+04 0.000 0.000 sqrtdel= 1.0000 1.844E+03 47 -1 0.70 0.50 ag i d10 6f ag i d10 8f -3.238E+02 ( 6f//r2// 8f)= 4.424E+02 a0 -0.2010 2.996E+03 0.000-0.001 sqrtdel= 1.0000 4.424E+02 47 -1 0.70 0.50 ag i d10 6f ag i d10 9f -1.491E+02 ( 6f//r2// 9f)= 2.038E+02 a0 -0.1195 6.355E+02 0.000-0.001 sqrtdel= 1.0000 2.038E+02 47 -1 0.70 0.50 ag i d10 6f ag i d9 5s4f 0.000E+00 ( //r2// )= 0.000E+00 a0 0.0000 0.000E+00 0.000 0.000 sqrtdel= 1.0000 0.000E+00 47 -1 0.70 0.50 ag i d10 6f ag i d9 5s5f 0.000E+00 ( //r2// )= 0.000E+00 a0 0.0000 0.000E+00 0.000 0.000 sqrtdel= 1.0000 0.000E+00 47 -1 0.70 0.50 ag i d10 6f ag i d9 5s6f -3.165E+00 ( 4d//r2// 5s)=-3.165E+00 a0 -0.9614 6.680E-01-0.449-0.676 sqrtdel= 1.0000 -3.165E+00 47 -1 0.70 0.50 ag i d10 6f ag i d9 5s7f 0.000E+00 ( //r2// )= 0.000E+00 a0 0.0000 0.000E+00 0.000 0.000 sqrtdel= 1.0000 0.000E+00 47 -1 0.70 0.50 ag i d10 6f ag i d9 5s8f 0.000E+00 ( //r2// )= 0.000E+00 a0 0.0000 0.000E+00 0.000 0.000 sqrtdel= 1.0000 0.000E+00 47 -1 0.70 0.50 ag i d10 6f ag i d9 5s9f 0.000E+00 ( //r2// )= 0.000E+00 a0 0.0000 0.000E+00 0.000 0.000 sqrtdel= 1.0000 0.000E+00 47 -1 0.70 0.50 ag i d10 6f ag i d8 5s2 4f 0.000E+00 ( //r2// )= 0.000E+00 a0 0.0000 0.000E+00 0.000 0.000 sqrtdel= 1.0000 0.000E+00 47 -1 0.70 0.50 ag i d10 6f ag i d10 6h 1.337E+03 ( 6f//r2// 6h)= 2.440E+03 a0 0.7984 1.805E+04 0.339 0.437 sqrtdel= 1.0000 2.440E+03 47 -1 0.70 0.50 ag i d10 6f ag i d10 7h -2.689E+03 ( 6f//r2// 7h)=-4.909E+03 a0 -0.9871 7.303E+04-0.795-0.940 sqrtdel= 1.0000 -4.909E+03 47 -1 0.70 0.50 ag i d10 6f ag i d10 8h -2.601E+01 ( 6f//r2// 8h)=-4.748E+01 a0 -0.0139 6.831E+00-0.289-0.495 sqrtdel= 1.0000 -4.748E+01 47 -1 0.70 0.50 ag i d10 6f ag i d10 9h 1.348E+02 ( 6f//r2// 9h)= 2.461E+02 a0 0.0968 1.835E+02-0.138-0.307 sqrtdel= 1.0000 2.461E+02 47 -1 0.70 0.50 ag i d10 6f ag i d9 5s6h 0.000E+00 ( //r2// )= 0.000E+00 a0 0.0000 0.000E+00 0.000 0.000 sqrtdel= 1.0000 0.000E+00 47 -1 0.70 0.50 ag i d10 6f ag i d9 5s7h 0.000E+00 ( //r2// )= 0.000E+00 a0 0.0000 0.000E+00 0.000 0.000 sqrtdel= 1.0000 0.000E+00 47 -1 0.70 0.50 ag i d10 6f ag i d9 5s8h 0.000E+00 ( //r2// )= 0.000E+00 a0 0.0000 0.000E+00 0.000 0.000 sqrtdel= 1.0000 0.000E+00 47 -1 0.70 0.50 ag i d10 6f ag i d9 5s9h 0.000E+00 ( //r2// )= 0.000E+00 a0 0.0000 0.000E+00 0.000 0.000 sqrtdel= 1.0000 0.000E+00 47 -1 0.70 0.50 ag i d10 6f ag i d10 8k 0.000E+00 ( //r2// )= 0.000E+00 a0 0.0000 0.000E+00 0.000 0.000 sqrtdel= 1.0000 0.000E+00 47 -1 0.70 0.50 ag i d10 6f ag i d10 9k 0.000E+00 ( //r2// )= 0.000E+00 a0 0.0000 0.000E+00 0.000 0.000 sqrtdel= 1.0000 0.000E+00 47 -1 0.70 0.50 ag i d10 6f ag i d9 5s8k 0.000E+00 ( //r2// )= 0.000E+00 a0 0.0000 0.000E+00 0.000 0.000 sqrtdel= 1.0000 0.000E+00 47 -1 0.70 0.50 ag i d10 6f ag i d9 5s9k 0.000E+00 ( //r2// )= 0.000E+00 a0 0.0000 0.000E+00 0.000 0.000 sqrtdel= 1.0000 0.000E+00 47 -1 0.70 0.50 ag i d10 7f ag i d10 5p -7.080E+00 ( 7f//r2// 5p)=-9.498E+00 a0 -0.9044 1.432E+00-0.106-0.984 sqrtdel= 1.0000 -9.498E+00 47 -1 0.70 0.50 ag i d10 7f ag i d10 6p -6.369E+00 ( 7f//r2// 6p)=-8.545E+00 a0 -0.1060 1.159E+00 0.110 0.442 sqrtdel= 1.0000 -8.545E+00 47 -1 0.70 0.50 ag i d10 7f ag i d10 7p 2.431E+01 ( 7f//r2// 7p)= 3.261E+01 a0 0.0892 1.688E+01 0.208 0.561 sqrtdel= 1.0000 3.261E+01 47 -1 0.70 0.50 ag i d10 7f ag i d10 8p 2.272E+02 ( 7f//r2// 8p)= 3.048E+02 a0 0.2434 1.474E+03 0.287 0.579 sqrtdel= 1.0000 3.048E+02 47 -1 0.70 0.50 ag i d10 7f ag i d10 9p 2.299E+03 ( 7f//r2// 9p)= 3.084E+03 a0 0.8176 1.510E+05 0.405 0.586 sqrtdel= 1.0000 3.084E+03 47 -1 0.70 0.50 ag i d10 7f ag i d9 5s5p 0.000E+00 ( //r2// )= 0.000E+00 a0 0.0000 0.000E+00 0.000 0.000 sqrtdel= 1.0000 0.000E+00 47 -1 0.70 0.50 ag i d10 7f ag i d9 5s6p 0.000E+00 ( //r2// )= 0.000E+00 a0 0.0000 0.000E+00 0.000 0.000 sqrtdel= 1.0000 0.000E+00 47 -1 0.70 0.50 ag i d10 7f ag i d9 5s7p 0.000E+00 ( //r2// )= 0.000E+00 a0 0.0000 0.000E+00 0.000 0.000 sqrtdel= 1.0000 0.000E+00 47 -1 0.70 0.50 ag i d10 7f ag i d9 5s8p 0.000E+00 ( //r2// )= 0.000E+00 a0 0.0000 0.000E+00 0.000 0.000 sqrtdel= 1.0000 0.000E+00 47 -1 0.70 0.50 ag i d10 7f ag i d9 5s9p 0.000E+00 ( //r2// )= 0.000E+00 a0 0.0000 0.000E+00 0.000 0.000 sqrtdel= 1.0000 0.000E+00 47 -1 0.70 0.50 ag i d10 7f ag i d8 5s2 5p 0.000E+00 ( //r2// )= 0.000E+00 a0 0.0000 0.000E+00 0.000 0.000 sqrtdel= 1.0000 0.000E+00 47 -1 0.70 0.50 ag i d10 7f ag i d10 4f -2.619E+01 ( 7f//r2// 4f)= 3.578E+01 a0 -0.1589 1.960E+01 0.000-0.001 sqrtdel= 1.0000 3.578E+01 47 -1 0.70 0.50 ag i d10 7f ag i d10 5f -1.539E+02 ( 7f//r2// 5f)= 2.103E+02 a0 -0.2231 6.768E+02 0.000-0.001 sqrtdel= 1.0000 2.103E+02 47 -1 0.70 0.50 ag i d10 7f ag i d10 6f -1.349E+03 ( 7f//r2// 6f)= 1.844E+03 a0 -0.5850 5.202E+04 0.000 0.000 sqrtdel= 1.0000 1.844E+03 47 -1 0.70 0.50 ag i d10 7f ag i d10 7f 5.134E+03 ( 7f//r2// 7f)=-7.014E+03 a0 1.0000 7.531E+05 1.000 1.000 sqrtdel= 1.0000 -7.014E+03 47 -1 0.70 0.50 ag i d10 7f ag i d10 8f -2.498E+03 ( 7f//r2// 8f)= 3.412E+03 a0 -0.5583 1.782E+05 0.000 0.000 sqrtdel= 1.0000 3.412E+03 47 -1 0.70 0.50 ag i d10 7f ag i d10 9f -5.937E+02 ( 7f//r2// 9f)= 8.112E+02 a0 -0.1847 1.007E+04 0.000-0.001 sqrtdel= 1.0000 8.112E+02 47 -1 0.70 0.50 ag i d10 7f ag i d9 5s4f 0.000E+00 ( //r2// )= 0.000E+00 a0 0.0000 0.000E+00 0.000 0.000 sqrtdel= 1.0000 0.000E+00 47 -1 0.70 0.50 ag i d10 7f ag i d9 5s5f 0.000E+00 ( //r2// )= 0.000E+00 a0 0.0000 0.000E+00 0.000 0.000 sqrtdel= 1.0000 0.000E+00 47 -1 0.70 0.50 ag i d10 7f ag i d9 5s6f 0.000E+00 ( //r2// )= 0.000E+00 a0 0.0000 0.000E+00 0.000 0.000 sqrtdel= 1.0000 0.000E+00 47 -1 0.70 0.50 ag i d10 7f ag i d9 5s7f -3.165E+00 ( 4d//r2// 5s)=-3.165E+00 a0 -0.9614 6.679E-01-0.449-0.676 sqrtdel= 1.0000 -3.165E+00 47 -1 0.70 0.50 ag i d10 7f ag i d9 5s8f 0.000E+00 ( //r2// )= 0.000E+00 a0 0.0000 0.000E+00 0.000 0.000 sqrtdel= 1.0000 0.000E+00 47 -1 0.70 0.50 ag i d10 7f ag i d9 5s9f 0.000E+00 ( //r2// )= 0.000E+00 a0 0.0000 0.000E+00 0.000 0.000 sqrtdel= 1.0000 0.000E+00 47 -1 0.70 0.50 ag i d10 7f ag i d8 5s2 4f 0.000E+00 ( //r2// )= 0.000E+00 a0 0.0000 0.000E+00 0.000 0.000 sqrtdel= 1.0000 0.000E+00 47 -1 0.70 0.50 ag i d10 7f ag i d10 6h -2.230E+02 ( 7f//r2// 6h)=-4.071E+02 a0 -0.1761 5.022E+02 0.032 0.059 sqrtdel= 1.0000 -4.071E+02 47 -1 0.70 0.50 ag i d10 7f ag i d10 7h 3.452E+03 ( 7f//r2// 7h)= 6.303E+03 a0 0.8905 1.204E+05 0.490 0.598 sqrtdel= 1.0000 6.303E+03 47 -1 0.70 0.50 ag i d10 7f ag i d10 8h -4.761E+03 ( 7f//r2// 8h)=-8.693E+03 a0 -0.9510 2.290E+05-0.704-0.887 sqrtdel= 1.0000 -8.693E+03 47 -1 0.70 0.50 ag i d10 7f ag i d10 9h -3.889E+02 ( 7f//r2// 9h)=-7.100E+02 a0 -0.1072 1.528E+03-0.326-0.544 sqrtdel= 1.0000 -7.100E+02 47 -1 0.70 0.50 ag i d10 7f ag i d9 5s6h 0.000E+00 ( //r2// )= 0.000E+00 a0 0.0000 0.000E+00 0.000 0.000 sqrtdel= 1.0000 0.000E+00 47 -1 0.70 0.50 ag i d10 7f ag i d9 5s7h 0.000E+00 ( //r2// )= 0.000E+00 a0 0.0000 0.000E+00 0.000 0.000 sqrtdel= 1.0000 0.000E+00 47 -1 0.70 0.50 ag i d10 7f ag i d9 5s8h 0.000E+00 ( //r2// )= 0.000E+00 a0 0.0000 0.000E+00 0.000 0.000 sqrtdel= 1.0000 0.000E+00 47 -1 0.70 0.50 ag i d10 7f ag i d9 5s9h 0.000E+00 ( //r2// )= 0.000E+00 a0 0.0000 0.000E+00 0.000 0.000 sqrtdel= 1.0000 0.000E+00 47 -1 0.70 0.50 ag i d10 7f ag i d10 8k 0.000E+00 ( //r2// )= 0.000E+00 a0 0.0000 0.000E+00 0.000 0.000 sqrtdel= 1.0000 0.000E+00 47 -1 0.70 0.50 ag i d10 7f ag i d10 9k 0.000E+00 ( //r2// )= 0.000E+00 a0 0.0000 0.000E+00 0.000 0.000 sqrtdel= 1.0000 0.000E+00 47 -1 0.70 0.50 ag i d10 7f ag i d9 5s8k 0.000E+00 ( //r2// )= 0.000E+00 a0 0.0000 0.000E+00 0.000 0.000 sqrtdel= 1.0000 0.000E+00 47 -1 0.70 0.50 ag i d10 7f ag i d9 5s9k 0.000E+00 ( //r2// )= 0.000E+00 a0 0.0000 0.000E+00 0.000 0.000 sqrtdel= 1.0000 0.000E+00 47 -1 0.70 0.50 ag i d10 8f ag i d10 5p -5.619E+00 ( 8f//r2// 5p)=-7.539E+00 a0 -0.8877 9.022E-01-0.087-0.980 sqrtdel= 1.0000 -7.539E+00 47 -1 0.70 0.50 ag i d10 8f ag i d10 6p -6.113E+00 ( 8f//r2// 6p)=-8.202E+00 a0 -0.1275 1.068E+00 0.079 0.397 sqrtdel= 1.0000 -8.202E+00 47 -1 0.70 0.50 ag i d10 8f ag i d10 7p 8.241E+00 ( 8f//r2// 7p)= 1.106E+01 a0 0.0385 1.940E+00 0.148 0.502 sqrtdel= 1.0000 1.106E+01 47 -1 0.70 0.50 ag i d10 8f ag i d10 8p 8.246E+01 ( 8f//r2// 8p)= 1.106E+02 a0 0.1174 1.943E+02 0.195 0.500 sqrtdel= 1.0000 1.106E+02 47 -1 0.70 0.50 ag i d10 8f ag i d10 9p 4.611E+02 ( 8f//r2// 9p)= 6.186E+02 a0 0.2341 6.074E+03 0.246 0.487 sqrtdel= 1.0000 6.186E+02 47 -1 0.70 0.50 ag i d10 8f ag i d9 5s5p 0.000E+00 ( //r2// )= 0.000E+00 a0 0.0000 0.000E+00 0.000 0.000 sqrtdel= 1.0000 0.000E+00 47 -1 0.70 0.50 ag i d10 8f ag i d9 5s6p 0.000E+00 ( //r2// )= 0.000E+00 a0 0.0000 0.000E+00 0.000 0.000 sqrtdel= 1.0000 0.000E+00 47 -1 0.70 0.50 ag i d10 8f ag i d9 5s7p 0.000E+00 ( //r2// )= 0.000E+00 a0 0.0000 0.000E+00 0.000 0.000 sqrtdel= 1.0000 0.000E+00 47 -1 0.70 0.50 ag i d10 8f ag i d9 5s8p 0.000E+00 ( //r2// )= 0.000E+00 a0 0.0000 0.000E+00 0.000 0.000 sqrtdel= 1.0000 0.000E+00 47 -1 0.70 0.50 ag i d10 8f ag i d9 5s9p 0.000E+00 ( //r2// )= 0.000E+00 a0 0.0000 0.000E+00 0.000 0.000 sqrtdel= 1.0000 0.000E+00 47 -1 0.70 0.50 ag i d10 8f ag i d8 5s2 5p 0.000E+00 ( //r2// )= 0.000E+00 a0 0.0000 0.000E+00 0.000 0.000 sqrtdel= 1.0000 0.000E+00 47 -1 0.70 0.50 ag i d10 8f ag i d10 4f -1.583E+01 ( 8f//r2// 4f)= 2.162E+01 a0 -0.1216 7.158E+00 0.000-0.001 sqrtdel= 1.0000 2.162E+01 47 -1 0.70 0.50 ag i d10 8f ag i d10 5f -7.148E+01 ( 8f//r2// 5f)= 9.766E+01 a0 -0.1366 1.460E+02 0.000-0.001 sqrtdel= 1.0000 9.766E+01 47 -1 0.70 0.50 ag i d10 8f ag i d10 6f -3.238E+02 ( 8f//r2// 6f)= 4.424E+02 a0 -0.2010 2.996E+03 0.000-0.001 sqrtdel= 1.0000 4.424E+02 47 -1 0.70 0.50 ag i d10 8f ag i d10 7f -2.498E+03 ( 8f//r2// 7f)= 3.412E+03 a0 -0.5583 1.782E+05 0.000 0.000 sqrtdel= 1.0000 3.412E+03 47 -1 0.70 0.50 ag i d10 8f ag i d10 8f 9.101E+03 ( 8f//r2// 8f)=-1.243E+04 a0 1.0000 2.367E+06 1.000 1.000 sqrtdel= 1.0000 -1.243E+04 47 -1 0.70 0.50 ag i d10 8f ag i d10 9f -4.231E+03 ( 8f//r2// 9f)= 5.781E+03 a0 -0.5386 5.116E+05 0.000 0.000 sqrtdel= 1.0000 5.781E+03 47 -1 0.70 0.50 ag i d10 8f ag i d9 5s4f 0.000E+00 ( //r2// )= 0.000E+00 a0 0.0000 0.000E+00 0.000 0.000 sqrtdel= 1.0000 0.000E+00 47 -1 0.70 0.50 ag i d10 8f ag i d9 5s5f 0.000E+00 ( //r2// )= 0.000E+00 a0 0.0000 0.000E+00 0.000 0.000 sqrtdel= 1.0000 0.000E+00 47 -1 0.70 0.50 ag i d10 8f ag i d9 5s6f 0.000E+00 ( //r2// )= 0.000E+00 a0 0.0000 0.000E+00 0.000 0.000 sqrtdel= 1.0000 0.000E+00 47 -1 0.70 0.50 ag i d10 8f ag i d9 5s7f 0.000E+00 ( //r2// )= 0.000E+00 a0 0.0000 0.000E+00 0.000 0.000 sqrtdel= 1.0000 0.000E+00 47 -1 0.70 0.50 ag i d10 8f ag i d9 5s8f -3.165E+00 ( 4d//r2// 5s)=-3.165E+00 a0 -0.9614 6.679E-01-0.449-0.676 sqrtdel= 1.0000 -3.165E+00 47 -1 0.70 0.50 ag i d10 8f ag i d9 5s9f 0.000E+00 ( //r2// )= 0.000E+00 a0 0.0000 0.000E+00 0.000 0.000 sqrtdel= 1.0000 0.000E+00 47 -1 0.70 0.50 ag i d10 8f ag i d8 5s2 4f 0.000E+00 ( //r2// )= 0.000E+00 a0 0.0000 0.000E+00 0.000 0.000 sqrtdel= 1.0000 0.000E+00 47 -1 0.70 0.50 ag i d10 8f ag i d10 6h -5.246E+01 ( 8f//r2// 6h)=-9.577E+01 a0 -0.0568 2.779E+01 0.015 0.036 sqrtdel= 1.0000 -9.577E+01 47 -1 0.70 0.50 ag i d10 8f ag i d10 7h -6.465E+02 ( 8f//r2// 7h)=-1.180E+03 a0 -0.2121 4.222E+03 0.049 0.081 sqrtdel= 1.0000 -1.180E+03 47 -1 0.70 0.50 ag i d10 8f ag i d10 8h 6.933E+03 ( 8f//r2// 8h)= 1.266E+04 a0 0.9335 4.855E+05 0.592 0.702 sqrtdel= 1.0000 1.266E+04 47 -1 0.70 0.50 ag i d10 8f ag i d10 9h -7.676E+03 ( 8f//r2// 9h)=-1.401E+04 a0 -0.9054 5.952E+05-0.617-0.809 sqrtdel= 1.0000 -1.401E+04 47 -1 0.70 0.50 ag i d10 8f ag i d9 5s6h 0.000E+00 ( //r2// )= 0.000E+00 a0 0.0000 0.000E+00 0.000 0.000 sqrtdel= 1.0000 0.000E+00 47 -1 0.70 0.50 ag i d10 8f ag i d9 5s7h 0.000E+00 ( //r2// )= 0.000E+00 a0 0.0000 0.000E+00 0.000 0.000 sqrtdel= 1.0000 0.000E+00 47 -1 0.70 0.50 ag i d10 8f ag i d9 5s8h 0.000E+00 ( //r2// )= 0.000E+00 a0 0.0000 0.000E+00 0.000 0.000 sqrtdel= 1.0000 0.000E+00 47 -1 0.70 0.50 ag i d10 8f ag i d9 5s9h 0.000E+00 ( //r2// )= 0.000E+00 a0 0.0000 0.000E+00 0.000 0.000 sqrtdel= 1.0000 0.000E+00 47 -1 0.70 0.50 ag i d10 8f ag i d10 8k 0.000E+00 ( //r2// )= 0.000E+00 a0 0.0000 0.000E+00 0.000 0.000 sqrtdel= 1.0000 0.000E+00 47 -1 0.70 0.50 ag i d10 8f ag i d10 9k 0.000E+00 ( //r2// )= 0.000E+00 a0 0.0000 0.000E+00 0.000 0.000 sqrtdel= 1.0000 0.000E+00 47 -1 0.70 0.50 ag i d10 8f ag i d9 5s8k 0.000E+00 ( //r2// )= 0.000E+00 a0 0.0000 0.000E+00 0.000 0.000 sqrtdel= 1.0000 0.000E+00 47 -1 0.70 0.50 ag i d10 8f ag i d9 5s9k 0.000E+00 ( //r2// )= 0.000E+00 a0 0.0000 0.000E+00 0.000 0.000 sqrtdel= 1.0000 0.000E+00 47 -1 0.70 0.50 ag i d10 9f ag i d10 5p -4.611E+00 ( 9f//r2// 5p)=-6.186E+00 a0 -0.8756 6.074E-01-0.073-0.978 sqrtdel= 1.0000 -6.186E+00 47 -1 0.70 0.50 ag i d10 9f ag i d10 6p -5.482E+00 ( 9f//r2// 6p)=-7.355E+00 a0 -0.1385 8.586E-01 0.060 0.367 sqrtdel= 1.0000 -7.355E+00 47 -1 0.70 0.50 ag i d10 9f ag i d10 7p 2.566E+00 ( 9f//r2// 7p)= 3.443E+00 a0 0.0147 1.881E-01 0.114 0.466 sqrtdel= 1.0000 3.443E+00 47 -1 0.70 0.50 ag i d10 9f ag i d10 8p 3.978E+01 ( 9f//r2// 8p)= 5.337E+01 a0 0.0703 4.521E+01 0.146 0.454 sqrtdel= 1.0000 5.337E+01 47 -1 0.70 0.50 ag i d10 9f ag i d10 9p 1.811E+02 ( 9f//r2// 9p)= 2.430E+02 a0 0.1190 9.370E+02 0.174 0.427 sqrtdel= 1.0000 2.430E+02 47 -1 0.70 0.50 ag i d10 9f ag i d9 5s5p 0.000E+00 ( //r2// )= 0.000E+00 a0 0.0000 0.000E+00 0.000 0.000 sqrtdel= 1.0000 0.000E+00 47 -1 0.70 0.50 ag i d10 9f ag i d9 5s6p 0.000E+00 ( //r2// )= 0.000E+00 a0 0.0000 0.000E+00 0.000 0.000 sqrtdel= 1.0000 0.000E+00 47 -1 0.70 0.50 ag i d10 9f ag i d9 5s7p 0.000E+00 ( //r2// )= 0.000E+00 a0 0.0000 0.000E+00 0.000 0.000 sqrtdel= 1.0000 0.000E+00 47 -1 0.70 0.50 ag i d10 9f ag i d9 5s8p 0.000E+00 ( //r2// )= 0.000E+00 a0 0.0000 0.000E+00 0.000 0.000 sqrtdel= 1.0000 0.000E+00 47 -1 0.70 0.50 ag i d10 9f ag i d9 5s9p 0.000E+00 ( //r2// )= 0.000E+00 a0 0.0000 0.000E+00 0.000 0.000 sqrtdel= 1.0000 0.000E+00 47 -1 0.70 0.50 ag i d10 9f ag i d8 5s2 5p 0.000E+00 ( //r2// )= 0.000E+00 a0 0.0000 0.000E+00 0.000 0.000 sqrtdel= 1.0000 0.000E+00 47 -1 0.70 0.50 ag i d10 9f ag i d10 4f -1.094E+01 ( 9f//r2// 4f)= 1.495E+01 a0 -0.1024 3.420E+00 0.000-0.001 sqrtdel= 1.0000 1.495E+01 47 -1 0.70 0.50 ag i d10 9f ag i d10 5f -4.296E+01 ( 9f//r2// 5f)= 5.870E+01 a0 -0.1018 5.274E+01 0.000-0.001 sqrtdel= 1.0000 5.870E+01 47 -1 0.70 0.50 ag i d10 9f ag i d10 6f -1.491E+02 ( 9f//r2// 6f)= 2.038E+02 a0 -0.1195 6.355E+02 0.000-0.001 sqrtdel= 1.0000 2.038E+02 47 -1 0.70 0.50 ag i d10 9f ag i d10 7f -5.937E+02 ( 9f//r2// 7f)= 8.112E+02 a0 -0.1847 1.007E+04 0.000-0.001 sqrtdel= 1.0000 8.112E+02 47 -1 0.70 0.50 ag i d10 9f ag i d10 8f -4.231E+03 ( 9f//r2// 8f)= 5.781E+03 a0 -0.5386 5.116E+05 0.000 0.000 sqrtdel= 1.0000 5.781E+03 47 -1 0.70 0.50 ag i d10 9f ag i d10 9f 1.495E+04 ( 9f//r2// 9f)=-2.043E+04 a0 1.0000 6.390E+06 1.000 1.000 sqrtdel= 1.0000 -2.043E+04 47 -1 0.70 0.50 ag i d10 9f ag i d9 5s4f 0.000E+00 ( //r2// )= 0.000E+00 a0 0.0000 0.000E+00 0.000 0.000 sqrtdel= 1.0000 0.000E+00 47 -1 0.70 0.50 ag i d10 9f ag i d9 5s5f 0.000E+00 ( //r2// )= 0.000E+00 a0 0.0000 0.000E+00 0.000 0.000 sqrtdel= 1.0000 0.000E+00 47 -1 0.70 0.50 ag i d10 9f ag i d9 5s6f 0.000E+00 ( //r2// )= 0.000E+00 a0 0.0000 0.000E+00 0.000 0.000 sqrtdel= 1.0000 0.000E+00 47 -1 0.70 0.50 ag i d10 9f ag i d9 5s7f 0.000E+00 ( //r2// )= 0.000E+00 a0 0.0000 0.000E+00 0.000 0.000 sqrtdel= 1.0000 0.000E+00 47 -1 0.70 0.50 ag i d10 9f ag i d9 5s8f 0.000E+00 ( //r2// )= 0.000E+00 a0 0.0000 0.000E+00 0.000 0.000 sqrtdel= 1.0000 0.000E+00 47 -1 0.70 0.50 ag i d10 9f ag i d9 5s9f -3.165E+00 ( 4d//r2// 5s)=-3.165E+00 a0 -0.9614 6.679E-01-0.449-0.676 sqrtdel= 1.0000 -3.165E+00 47 -1 0.70 0.50 ag i d10 9f ag i d8 5s2 4f 0.000E+00 ( //r2// )= 0.000E+00 a0 0.0000 0.000E+00 0.000 0.000 sqrtdel= 1.0000 0.000E+00 47 -1 0.70 0.50 ag i d10 9f ag i d10 6h -2.349E+01 ( 9f//r2// 6h)=-4.289E+01 a0 -0.0321 5.574E+00 0.009 0.027 sqrtdel= 1.0000 -4.289E+01 47 -1 0.70 0.50 ag i d10 9f ag i d10 7h -1.520E+02 ( 9f//r2// 7h)=-2.776E+02 a0 -0.0670 2.335E+02 0.024 0.051 sqrtdel= 1.0000 -2.776E+02 47 -1 0.70 0.50 ag i d10 9f ag i d10 8h -1.411E+03 ( 9f//r2// 8h)=-2.577E+03 a0 -0.2343 2.012E+04 0.060 0.093 sqrtdel= 1.0000 -2.577E+03 47 -1 0.70 0.50 ag i d10 9f ag i d10 9h 1.223E+04 ( 9f//r2// 9h)= 2.234E+04 a0 0.9558 1.512E+06 0.667 0.771 sqrtdel= 1.0000 2.234E+04 47 -1 0.70 0.50 ag i d10 9f ag i d9 5s6h 0.000E+00 ( //r2// )= 0.000E+00 a0 0.0000 0.000E+00 0.000 0.000 sqrtdel= 1.0000 0.000E+00 47 -1 0.70 0.50 ag i d10 9f ag i d9 5s7h 0.000E+00 ( //r2// )= 0.000E+00 a0 0.0000 0.000E+00 0.000 0.000 sqrtdel= 1.0000 0.000E+00 47 -1 0.70 0.50 ag i d10 9f ag i d9 5s8h 0.000E+00 ( //r2// )= 0.000E+00 a0 0.0000 0.000E+00 0.000 0.000 sqrtdel= 1.0000 0.000E+00 47 -1 0.70 0.50 ag i d10 9f ag i d9 5s9h 0.000E+00 ( //r2// )= 0.000E+00 a0 0.0000 0.000E+00 0.000 0.000 sqrtdel= 1.0000 0.000E+00 47 -1 0.70 0.50 ag i d10 9f ag i d10 8k 0.000E+00 ( //r2// )= 0.000E+00 a0 0.0000 0.000E+00 0.000 0.000 sqrtdel= 1.0000 0.000E+00 47 -1 0.70 0.50 ag i d10 9f ag i d10 9k 0.000E+00 ( //r2// )= 0.000E+00 a0 0.0000 0.000E+00 0.000 0.000 sqrtdel= 1.0000 0.000E+00 47 -1 0.70 0.50 ag i d10 9f ag i d9 5s8k 0.000E+00 ( //r2// )= 0.000E+00 a0 0.0000 0.000E+00 0.000 0.000 sqrtdel= 1.0000 0.000E+00 47 -1 0.70 0.50 ag i d10 9f ag i d9 5s9k 0.000E+00 ( //r2// )= 0.000E+00 a0 0.0000 0.000E+00 0.000 0.000 sqrtdel= 1.0000 0.000E+00 47 -1 0.70 0.50 ag i d9 5s4f ag i d10 5p 0.000E+00 ( //r2// )= 0.000E+00 a0 0.0000 0.000E+00 0.000 0.000 sqrtdel= 1.0000 0.000E+00 47 -1 0.70 0.50 ag i d9 5s4f ag i d10 6p 0.000E+00 ( //r2// )= 0.000E+00 a0 0.0000 0.000E+00 0.000 0.000 sqrtdel= 1.0000 0.000E+00 47 -1 0.70 0.50 ag i d9 5s4f ag i d10 7p 0.000E+00 ( //r2// )= 0.000E+00 a0 0.0000 0.000E+00 0.000 0.000 sqrtdel= 1.0000 0.000E+00 47 -1 0.70 0.50 ag i d9 5s4f ag i d10 8p 0.000E+00 ( //r2// )= 0.000E+00 a0 0.0000 0.000E+00 0.000 0.000 sqrtdel= 1.0000 0.000E+00 47 -1 0.70 0.50 ag i d9 5s4f ag i d10 9p 0.000E+00 ( //r2// )= 0.000E+00 a0 0.0000 0.000E+00 0.000 0.000 sqrtdel= 1.0000 0.000E+00 47 -1 0.70 0.50 ag i d9 5s4f ag i d9 5s5p -1.306E+01 ( 4f//r2// 5p)=-1.752E+01 a0 -1.0000 4.872E+00-0.167-0.999 sqrtdel= 1.0000 -1.752E+01 47 -1 0.70 0.50 ag i d9 5s4f ag i d9 5s6p 1.857E+02 ( 4f//r2// 6p)= 2.491E+02 a0 0.9991 9.850E+02 0.803 0.985 sqrtdel= 1.0000 2.491E+02 47 -1 0.70 0.50 ag i d9 5s4f ag i d9 5s7p -3.739E+02 ( 4f//r2// 7p)=-5.016E+02 a0 -0.9330 3.994E+03-0.574-0.672 sqrtdel= 1.0000 -5.016E+02 47 -1 0.70 0.50 ag i d9 5s4f ag i d9 5s8p 1.176E+02 ( 4f//r2// 8p)= 1.578E+02 a0 0.3749 3.952E+02-0.038-0.070 sqrtdel= 1.0000 1.578E+02 47 -1 0.70 0.50 ag i d9 5s4f ag i d9 5s9p 2.850E+01 ( 4f//r2// 9p)= 3.824E+01 a0 0.1379 2.321E+01-0.021-0.057 sqrtdel= 1.0000 3.824E+01 47 -1 0.70 0.50 ag i d9 5s4f ag i d8 5s2 5p 0.000E+00 ( //r2// )= 0.000E+00 a0 0.0000 0.000E+00 0.000 0.000 sqrtdel= 1.0000 0.000E+00 47 -1 0.70 0.50 ag i d9 5s4f ag i d10 4f -3.165E+00 ( 5s//r2// 4d)=-3.165E+00 a0 -0.9614 6.680E-01-0.449-0.676 sqrtdel= 1.0000 -3.165E+00 47 -1 0.70 0.50 ag i d9 5s4f ag i d10 5f 0.000E+00 ( //r2// )= 0.000E+00 a0 0.0000 0.000E+00 0.000 0.000 sqrtdel= 1.0000 0.000E+00 47 -1 0.70 0.50 ag i d9 5s4f ag i d10 6f 0.000E+00 ( //r2// )= 0.000E+00 a0 0.0000 0.000E+00 0.000 0.000 sqrtdel= 1.0000 0.000E+00 47 -1 0.70 0.50 ag i d9 5s4f ag i d10 7f 0.000E+00 ( //r2// )= 0.000E+00 a0 0.0000 0.000E+00 0.000 0.000 sqrtdel= 1.0000 0.000E+00 47 -1 0.70 0.50 ag i d9 5s4f ag i d10 8f 0.000E+00 ( //r2// )= 0.000E+00 a0 0.0000 0.000E+00 0.000 0.000 sqrtdel= 1.0000 0.000E+00 47 -1 0.70 0.50 ag i d9 5s4f ag i d10 9f 0.000E+00 ( //r2// )= 0.000E+00 a0 0.0000 0.000E+00 0.000 0.000 sqrtdel= 1.0000 0.000E+00 47 -1 0.70 0.50 ag i d9 5s4f ag i d9 5s4f 3.587E+02 ( 4f//r2// 4f)=-4.900E+02 a0 1.0000 3.675E+03 1.000 1.000 sqrtdel= 1.0000 -4.900E+02 47 -1 0.70 0.50 ag i d9 5s4f ag i d9 5s5f -2.364E+02 ( 4f//r2// 5f)= 3.230E+02 a0 -0.6781 1.597E+03-0.001-0.002 sqrtdel= 1.0000 3.230E+02 47 -1 0.70 0.50 ag i d9 5s4f ag i d9 5s6f -5.604E+01 ( 4f//r2// 6f)= 7.657E+01 a0 -0.2515 8.973E+01-0.001-0.002 sqrtdel= 1.0000 7.657E+01 47 -1 0.70 0.50 ag i d9 5s4f ag i d9 5s7f -2.600E+01 ( 4f//r2// 7f)= 3.552E+01 a0 -0.1579 1.931E+01-0.001-0.003 sqrtdel= 1.0000 3.552E+01 47 -1 0.70 0.50 ag i d9 5s4f ag i d9 5s8f -1.566E+01 ( 4f//r2// 8f)= 2.139E+01 a0 -0.1204 7.005E+00-0.001-0.003 sqrtdel= 1.0000 2.139E+01 47 -1 0.70 0.50 ag i d9 5s4f ag i d9 5s9f -1.079E+01 ( 4f//r2// 9f)= 1.474E+01 a0 -0.1010 3.326E+00-0.001-0.004 sqrtdel= 1.0000 1.474E+01 47 -1 0.70 0.50 ag i d9 5s4f ag i d8 5s2 4f -2.794E+00 ( 4d//r2// 5s)=-2.794E+00 a0 -0.9543 5.204E-01-0.423-0.647 sqrtdel= 1.0000 -2.794E+00 47 -1 0.70 0.50 ag i d9 5s4f ag i d10 6h 0.000E+00 ( //r2// )= 0.000E+00 a0 0.0000 0.000E+00 0.000 0.000 sqrtdel= 1.0000 0.000E+00 47 -1 0.70 0.50 ag i d9 5s4f ag i d10 7h 0.000E+00 ( //r2// )= 0.000E+00 a0 0.0000 0.000E+00 0.000 0.000 sqrtdel= 1.0000 0.000E+00 47 -1 0.70 0.50 ag i d9 5s4f ag i d10 8h 0.000E+00 ( //r2// )= 0.000E+00 a0 0.0000 0.000E+00 0.000 0.000 sqrtdel= 1.0000 0.000E+00 47 -1 0.70 0.50 ag i d9 5s4f ag i d10 9h 0.000E+00 ( //r2// )= 0.000E+00 a0 0.0000 0.000E+00 0.000 0.000 sqrtdel= 1.0000 0.000E+00 47 -1 0.70 0.50 ag i d9 5s4f ag i d9 5s6h 3.329E+02 ( 4f//r2// 6h)= 6.078E+02 a0 1.0000 1.120E+03 0.438 1.000 sqrtdel= 1.0000 6.078E+02 47 -1 0.70 0.50 ag i d9 5s4f ag i d9 5s7h 1.790E+02 ( 4f//r2// 7h)= 3.267E+02 a0 0.8187 3.235E+02 0.329 0.957 sqrtdel= 1.0000 3.267E+02 47 -1 0.70 0.50 ag i d9 5s4f ag i d9 5s8h 1.147E+02 ( 4f//r2// 8h)= 2.093E+02 a0 0.6881 1.328E+02 0.254 0.913 sqrtdel= 1.0000 2.093E+02 47 -1 0.70 0.50 ag i d9 5s4f ag i d9 5s9h 8.179E+01 ( 4f//r2// 9h)= 1.493E+02 a0 0.6096 6.757E+01 0.203 0.881 sqrtdel= 1.0000 1.493E+02 47 -1 0.70 0.50 ag i d9 5s4f ag i d10 8k 0.000E+00 ( //r2// )= 0.000E+00 a0 0.0000 0.000E+00 0.000 0.000 sqrtdel= 1.0000 0.000E+00 47 -1 0.70 0.50 ag i d9 5s4f ag i d10 9k 0.000E+00 ( //r2// )= 0.000E+00 a0 0.0000 0.000E+00 0.000 0.000 sqrtdel= 1.0000 0.000E+00 47 -1 0.70 0.50 ag i d9 5s4f ag i d9 5s8k 0.000E+00 ( //r2// )= 0.000E+00 a0 0.0000 0.000E+00 0.000 0.000 sqrtdel= 1.0000 0.000E+00 47 -1 0.70 0.50 ag i d9 5s4f ag i d9 5s9k 0.000E+00 ( //r2// )= 0.000E+00 a0 0.0000 0.000E+00 0.000 0.000 sqrtdel= 1.0000 0.000E+00 47 -1 0.70 0.50 ag i d9 5s5f ag i d10 5p 0.000E+00 ( //r2// )= 0.000E+00 a0 0.0000 0.000E+00 0.000 0.000 sqrtdel= 1.0000 0.000E+00 47 -1 0.70 0.50 ag i d9 5s5f ag i d10 6p 0.000E+00 ( //r2// )= 0.000E+00 a0 0.0000 0.000E+00 0.000 0.000 sqrtdel= 1.0000 0.000E+00 47 -1 0.70 0.50 ag i d9 5s5f ag i d10 7p 0.000E+00 ( //r2// )= 0.000E+00 a0 0.0000 0.000E+00 0.000 0.000 sqrtdel= 1.0000 0.000E+00 47 -1 0.70 0.50 ag i d9 5s5f ag i d10 8p 0.000E+00 ( //r2// )= 0.000E+00 a0 0.0000 0.000E+00 0.000 0.000 sqrtdel= 1.0000 0.000E+00 47 -1 0.70 0.50 ag i d9 5s5f ag i d10 9p 0.000E+00 ( //r2// )= 0.000E+00 a0 0.0000 0.000E+00 0.000 0.000 sqrtdel= 1.0000 0.000E+00 47 -1 0.70 0.50 ag i d9 5s5f ag i d9 5s5p -9.028E+00 ( 5f//r2// 5p)=-1.211E+01 a0 -0.9847 2.328E+00-0.135-0.997 sqrtdel= 1.0000 -1.211E+01 47 -1 0.70 0.50 ag i d9 5s5f ag i d9 5s6p 2.318E+01 ( 5f//r2// 6p)= 3.109E+01 a0 0.2321 1.535E+01 0.342 0.746 sqrtdel= 1.0000 3.109E+01 47 -1 0.70 0.50 ag i d9 5s5f ag i d9 5s7p 5.055E+02 ( 5f//r2// 7p)= 6.782E+02 a0 0.9367 7.302E+03 0.571 0.817 sqrtdel= 1.0000 6.782E+02 47 -1 0.70 0.50 ag i d9 5s5f ag i d9 5s8p -1.156E+03 ( 5f//r2// 8p)=-1.551E+03 a0 -0.9747 3.819E+04-0.733-0.821 sqrtdel= 1.0000 -1.551E+03 47 -1 0.70 0.50 ag i d9 5s5f ag i d9 5s9p 3.834E+02 ( 5f//r2// 9p)= 5.144E+02 a0 0.3962 4.200E+03-0.046-0.076 sqrtdel= 1.0000 5.144E+02 47 -1 0.70 0.50 ag i d9 5s5f ag i d8 5s2 5p 0.000E+00 ( //r2// )= 0.000E+00 a0 0.0000 0.000E+00 0.000 0.000 sqrtdel= 1.0000 0.000E+00 47 -1 0.70 0.50 ag i d9 5s5f ag i d10 4f 0.000E+00 ( //r2// )= 0.000E+00 a0 0.0000 0.000E+00 0.000 0.000 sqrtdel= 1.0000 0.000E+00 47 -1 0.70 0.50 ag i d9 5s5f ag i d10 5f -3.165E+00 ( 5s//r2// 4d)=-3.165E+00 a0 -0.9614 6.680E-01-0.449-0.676 sqrtdel= 1.0000 -3.165E+00 47 -1 0.70 0.50 ag i d9 5s5f ag i d10 6f 0.000E+00 ( //r2// )= 0.000E+00 a0 0.0000 0.000E+00 0.000 0.000 sqrtdel= 1.0000 0.000E+00 47 -1 0.70 0.50 ag i d9 5s5f ag i d10 7f 0.000E+00 ( //r2// )= 0.000E+00 a0 0.0000 0.000E+00 0.000 0.000 sqrtdel= 1.0000 0.000E+00 47 -1 0.70 0.50 ag i d9 5s5f ag i d10 8f 0.000E+00 ( //r2// )= 0.000E+00 a0 0.0000 0.000E+00 0.000 0.000 sqrtdel= 1.0000 0.000E+00 47 -1 0.70 0.50 ag i d9 5s5f ag i d10 9f 0.000E+00 ( //r2// )= 0.000E+00 a0 0.0000 0.000E+00 0.000 0.000 sqrtdel= 1.0000 0.000E+00 47 -1 0.70 0.50 ag i d9 5s5f ag i d9 5s4f -2.364E+02 ( 5f//r2// 4f)= 3.230E+02 a0 -0.6781 1.597E+03-0.001-0.002 sqrtdel= 1.0000 3.230E+02 47 -1 0.70 0.50 ag i d9 5s5f ag i d9 5s5f 1.119E+03 ( 5f//r2// 5f)=-1.529E+03 a0 1.0000 3.580E+04 1.000 1.000 sqrtdel= 1.0000 -1.529E+03 47 -1 0.70 0.50 ag i d9 5s5f ag i d9 5s6f -6.382E+02 ( 5f//r2// 6f)= 8.719E+02 a0 -0.6250 1.164E+04-0.001-0.002 sqrtdel= 1.0000 8.719E+02 47 -1 0.70 0.50 ag i d9 5s5f ag i d9 5s7f -1.534E+02 ( 5f//r2// 7f)= 2.096E+02 a0 -0.2228 6.725E+02-0.001-0.002 sqrtdel= 1.0000 2.096E+02 47 -1 0.70 0.50 ag i d9 5s5f ag i d9 5s8f -7.105E+01 ( 5f//r2// 8f)= 9.707E+01 a0 -0.1361 1.442E+02-0.001-0.003 sqrtdel= 1.0000 9.707E+01 47 -1 0.70 0.50 ag i d9 5s5f ag i d9 5s9f -4.259E+01 ( 5f//r2// 9f)= 5.819E+01 a0 -0.1011 5.182E+01-0.001-0.003 sqrtdel= 1.0000 5.819E+01 47 -1 0.70 0.50 ag i d9 5s5f ag i d8 5s2 4f 0.000E+00 ( //r2// )= 0.000E+00 a0 0.0000 0.000E+00 0.000 0.000 sqrtdel= 1.0000 0.000E+00 47 -1 0.70 0.50 ag i d9 5s5f ag i d10 6h 0.000E+00 ( //r2// )= 0.000E+00 a0 0.0000 0.000E+00 0.000 0.000 sqrtdel= 1.0000 0.000E+00 47 -1 0.70 0.50 ag i d9 5s5f ag i d10 7h 0.000E+00 ( //r2// )= 0.000E+00 a0 0.0000 0.000E+00 0.000 0.000 sqrtdel= 1.0000 0.000E+00 47 -1 0.70 0.50 ag i d9 5s5f ag i d10 8h 0.000E+00 ( //r2// )= 0.000E+00 a0 0.0000 0.000E+00 0.000 0.000 sqrtdel= 1.0000 0.000E+00 47 -1 0.70 0.50 ag i d9 5s5f ag i d10 9h 0.000E+00 ( //r2// )= 0.000E+00 a0 0.0000 0.000E+00 0.000 0.000 sqrtdel= 1.0000 0.000E+00 47 -1 0.70 0.50 ag i d9 5s5f ag i d9 5s6h -1.258E+03 ( 5f//r2// 6h)=-2.296E+03 a0 -0.9887 1.597E+04-0.831-0.930 sqrtdel= 1.0000 -2.296E+03 47 -1 0.70 0.50 ag i d9 5s5f ag i d9 5s7h 1.991E+02 ( 5f//r2// 7h)= 3.635E+02 a0 0.2417 4.005E+02-0.131-0.253 sqrtdel= 1.0000 3.635E+02 47 -1 0.70 0.50 ag i d9 5s5f ag i d9 5s8h 1.848E+02 ( 5f//r2// 8h)= 3.374E+02 a0 0.3143 3.449E+02 0.000-0.001 sqrtdel= 1.0000 3.374E+02 47 -1 0.70 0.50 ag i d9 5s5f ag i d9 5s9h 1.405E+02 ( 5f//r2// 9h)= 2.565E+02 a0 0.3019 1.994E+02 0.035 0.115 sqrtdel= 1.0000 2.565E+02 47 -1 0.70 0.50 ag i d9 5s5f ag i d10 8k 0.000E+00 ( //r2// )= 0.000E+00 a0 0.0000 0.000E+00 0.000 0.000 sqrtdel= 1.0000 0.000E+00 47 -1 0.70 0.50 ag i d9 5s5f ag i d10 9k 0.000E+00 ( //r2// )= 0.000E+00 a0 0.0000 0.000E+00 0.000 0.000 sqrtdel= 1.0000 0.000E+00 47 -1 0.70 0.50 ag i d9 5s5f ag i d9 5s8k 0.000E+00 ( //r2// )= 0.000E+00 a0 0.0000 0.000E+00 0.000 0.000 sqrtdel= 1.0000 0.000E+00 47 -1 0.70 0.50 ag i d9 5s5f ag i d9 5s9k 0.000E+00 ( //r2// )= 0.000E+00 a0 0.0000 0.000E+00 0.000 0.000 sqrtdel= 1.0000 0.000E+00 47 -1 0.70 0.50 ag i d9 5s6f ag i d10 5p 0.000E+00 ( //r2// )= 0.000E+00 a0 0.0000 0.000E+00 0.000 0.000 sqrtdel= 1.0000 0.000E+00 47 -1 0.70 0.50 ag i d9 5s6f ag i d10 6p 0.000E+00 ( //r2// )= 0.000E+00 a0 0.0000 0.000E+00 0.000 0.000 sqrtdel= 1.0000 0.000E+00 47 -1 0.70 0.50 ag i d9 5s6f ag i d10 7p 0.000E+00 ( //r2// )= 0.000E+00 a0 0.0000 0.000E+00 0.000 0.000 sqrtdel= 1.0000 0.000E+00 47 -1 0.70 0.50 ag i d9 5s6f ag i d10 8p 0.000E+00 ( //r2// )= 0.000E+00 a0 0.0000 0.000E+00 0.000 0.000 sqrtdel= 1.0000 0.000E+00 47 -1 0.70 0.50 ag i d9 5s6f ag i d10 9p 0.000E+00 ( //r2// )= 0.000E+00 a0 0.0000 0.000E+00 0.000 0.000 sqrtdel= 1.0000 0.000E+00 47 -1 0.70 0.50 ag i d9 5s6f ag i d9 5s5p -6.633E+00 ( 6f//r2// 5p)=-8.899E+00 a0 -0.9648 1.257E+00-0.107-0.994 sqrtdel= 1.0000 -8.899E+00 47 -1 0.70 0.50 ag i d9 5s6f ag i d9 5s6p 3.950E+00 ( 6f//r2// 6p)= 5.300E+00 a0 0.0572 4.458E-01 0.200 0.618 sqrtdel= 1.0000 5.300E+00 47 -1 0.70 0.50 ag i d9 5s6f ag i d9 5s7p 1.021E+02 ( 6f//r2// 7p)= 1.370E+02 a0 0.3039 2.981E+02 0.318 0.680 sqrtdel= 1.0000 1.370E+02 47 -1 0.70 0.50 ag i d9 5s6f ag i d9 5s8p 1.077E+03 ( 6f//r2// 8p)= 1.445E+03 a0 0.8435 3.317E+04 0.419 0.623 sqrtdel= 1.0000 1.445E+03 47 -1 0.70 0.50 ag i d9 5s6f ag i d9 5s9p -2.656E+03 ( 6f//r2// 9p)=-3.563E+03 a0 -0.9883 2.015E+05-0.817-0.890 sqrtdel= 1.0000 -3.563E+03 47 -1 0.70 0.50 ag i d9 5s6f ag i d8 5s2 5p 0.000E+00 ( //r2// )= 0.000E+00 a0 0.0000 0.000E+00 0.000 0.000 sqrtdel= 1.0000 0.000E+00 47 -1 0.70 0.50 ag i d9 5s6f ag i d10 4f 0.000E+00 ( //r2// )= 0.000E+00 a0 0.0000 0.000E+00 0.000 0.000 sqrtdel= 1.0000 0.000E+00 47 -1 0.70 0.50 ag i d9 5s6f ag i d10 5f 0.000E+00 ( //r2// )= 0.000E+00 a0 0.0000 0.000E+00 0.000 0.000 sqrtdel= 1.0000 0.000E+00 47 -1 0.70 0.50 ag i d9 5s6f ag i d10 6f -3.165E+00 ( 5s//r2// 4d)=-3.165E+00 a0 -0.9614 6.680E-01-0.449-0.676 sqrtdel= 1.0000 -3.165E+00 47 -1 0.70 0.50 ag i d9 5s6f ag i d10 7f 0.000E+00 ( //r2// )= 0.000E+00 a0 0.0000 0.000E+00 0.000 0.000 sqrtdel= 1.0000 0.000E+00 47 -1 0.70 0.50 ag i d9 5s6f ag i d10 8f 0.000E+00 ( //r2// )= 0.000E+00 a0 0.0000 0.000E+00 0.000 0.000 sqrtdel= 1.0000 0.000E+00 47 -1 0.70 0.50 ag i d9 5s6f ag i d10 9f 0.000E+00 ( //r2// )= 0.000E+00 a0 0.0000 0.000E+00 0.000 0.000 sqrtdel= 1.0000 0.000E+00 47 -1 0.70 0.50 ag i d9 5s6f ag i d9 5s4f -5.604E+01 ( 6f//r2// 4f)= 7.657E+01 a0 -0.2515 8.973E+01-0.001-0.002 sqrtdel= 1.0000 7.657E+01 47 -1 0.70 0.50 ag i d9 5s6f ag i d9 5s5f -6.382E+02 ( 6f//r2// 5f)= 8.719E+02 a0 -0.6250 1.164E+04-0.001-0.002 sqrtdel= 1.0000 8.719E+02 47 -1 0.70 0.50 ag i d9 5s6f ag i d9 5s6f 2.596E+03 ( 6f//r2// 6f)=-3.546E+03 a0 1.0000 1.925E+05 1.000 1.000 sqrtdel= 1.0000 -3.546E+03 47 -1 0.70 0.50 ag i d9 5s6f ag i d9 5s7f -1.348E+03 ( 6f//r2// 7f)= 1.842E+03 a0 -0.5862 5.195E+04-0.001-0.001 sqrtdel= 1.0000 1.842E+03 47 -1 0.70 0.50 ag i d9 5s6f ag i d9 5s8f -3.229E+02 ( 6f//r2// 8f)= 4.411E+02 a0 -0.2009 2.978E+03-0.001-0.002 sqrtdel= 1.0000 4.411E+02 47 -1 0.70 0.50 ag i d9 5s6f ag i d9 5s9f -1.483E+02 ( 6f//r2// 9f)= 2.027E+02 a0 -0.1192 6.288E+02-0.001-0.002 sqrtdel= 1.0000 2.027E+02 47 -1 0.70 0.50 ag i d9 5s6f ag i d8 5s2 4f 0.000E+00 ( //r2// )= 0.000E+00 a0 0.0000 0.000E+00 0.000 0.000 sqrtdel= 1.0000 0.000E+00 47 -1 0.70 0.50 ag i d9 5s6f ag i d10 6h 0.000E+00 ( //r2// )= 0.000E+00 a0 0.0000 0.000E+00 0.000 0.000 sqrtdel= 1.0000 0.000E+00 47 -1 0.70 0.50 ag i d9 5s6f ag i d10 7h 0.000E+00 ( //r2// )= 0.000E+00 a0 0.0000 0.000E+00 0.000 0.000 sqrtdel= 1.0000 0.000E+00 47 -1 0.70 0.50 ag i d9 5s6f ag i d10 8h 0.000E+00 ( //r2// )= 0.000E+00 a0 0.0000 0.000E+00 0.000 0.000 sqrtdel= 1.0000 0.000E+00 47 -1 0.70 0.50 ag i d9 5s6f ag i d10 9h 0.000E+00 ( //r2// )= 0.000E+00 a0 0.0000 0.000E+00 0.000 0.000 sqrtdel= 1.0000 0.000E+00 47 -1 0.70 0.50 ag i d9 5s6f ag i d9 5s6h 1.339E+03 ( 6f//r2// 6h)= 2.445E+03 a0 0.8001 1.812E+04 0.341 0.440 sqrtdel= 1.0000 2.445E+03 47 -1 0.70 0.50 ag i d9 5s6f ag i d9 5s7h -2.678E+03 ( 6f//r2// 7h)=-4.889E+03 a0 -0.9868 7.243E+04-0.793-0.940 sqrtdel= 1.0000 -4.889E+03 47 -1 0.70 0.50 ag i d9 5s6f ag i d9 5s8h -3.418E+01 ( 6f//r2// 8h)=-6.240E+01 a0 -0.0183 1.180E+01-0.291-0.498 sqrtdel= 1.0000 -6.240E+01 47 -1 0.70 0.50 ag i d9 5s6f ag i d9 5s9h 1.300E+02 ( 6f//r2// 9h)= 2.374E+02 a0 0.0937 1.708E+02-0.140-0.311 sqrtdel= 1.0000 2.374E+02 47 -1 0.70 0.50 ag i d9 5s6f ag i d10 8k 0.000E+00 ( //r2// )= 0.000E+00 a0 0.0000 0.000E+00 0.000 0.000 sqrtdel= 1.0000 0.000E+00 47 -1 0.70 0.50 ag i d9 5s6f ag i d10 9k 0.000E+00 ( //r2// )= 0.000E+00 a0 0.0000 0.000E+00 0.000 0.000 sqrtdel= 1.0000 0.000E+00 47 -1 0.70 0.50 ag i d9 5s6f ag i d9 5s8k 0.000E+00 ( //r2// )= 0.000E+00 a0 0.0000 0.000E+00 0.000 0.000 sqrtdel= 1.0000 0.000E+00 47 -1 0.70 0.50 ag i d9 5s6f ag i d9 5s9k 0.000E+00 ( //r2// )= 0.000E+00 a0 0.0000 0.000E+00 0.000 0.000 sqrtdel= 1.0000 0.000E+00 47 -1 0.70 0.50 ag i d9 5s7f ag i d10 5p 0.000E+00 ( //r2// )= 0.000E+00 a0 0.0000 0.000E+00 0.000 0.000 sqrtdel= 1.0000 0.000E+00 47 -1 0.70 0.50 ag i d9 5s7f ag i d10 6p 0.000E+00 ( //r2// )= 0.000E+00 a0 0.0000 0.000E+00 0.000 0.000 sqrtdel= 1.0000 0.000E+00 47 -1 0.70 0.50 ag i d9 5s7f ag i d10 7p 0.000E+00 ( //r2// )= 0.000E+00 a0 0.0000 0.000E+00 0.000 0.000 sqrtdel= 1.0000 0.000E+00 47 -1 0.70 0.50 ag i d9 5s7f ag i d10 8p 0.000E+00 ( //r2// )= 0.000E+00 a0 0.0000 0.000E+00 0.000 0.000 sqrtdel= 1.0000 0.000E+00 47 -1 0.70 0.50 ag i d9 5s7f ag i d10 9p 0.000E+00 ( //r2// )= 0.000E+00 a0 0.0000 0.000E+00 0.000 0.000 sqrtdel= 1.0000 0.000E+00 47 -1 0.70 0.50 ag i d9 5s7f ag i d9 5s5p -5.140E+00 ( 7f//r2// 5p)=-6.896E+00 a0 -0.9499 7.549E-01-0.087-0.992 sqrtdel= 1.0000 -6.896E+00 47 -1 0.70 0.50 ag i d9 5s7f ag i d9 5s6p -4.440E-01 ( 7f//r2// 6p)=-5.956E-01 a0 -0.0084 5.632E-03 0.136 0.547 sqrtdel= 1.0000 -5.956E-01 47 -1 0.70 0.50 ag i d9 5s7f ag i d9 5s7p 3.792E+01 ( 7f//r2// 7p)= 5.088E+01 a0 0.1542 4.109E+01 0.211 0.593 sqrtdel= 1.0000 5.088E+01 47 -1 0.70 0.50 ag i d9 5s7f ag i d9 5s8p 2.468E+02 ( 7f//r2// 8p)= 3.312E+02 a0 0.2890 1.741E+03 0.263 0.552 sqrtdel= 1.0000 3.312E+02 47 -1 0.70 0.50 ag i d9 5s7f ag i d9 5s9p 2.006E+03 ( 7f//r2// 9p)= 2.691E+03 a0 0.7655 1.150E+05 0.319 0.473 sqrtdel= 1.0000 2.691E+03 47 -1 0.70 0.50 ag i d9 5s7f ag i d8 5s2 5p 0.000E+00 ( //r2// )= 0.000E+00 a0 0.0000 0.000E+00 0.000 0.000 sqrtdel= 1.0000 0.000E+00 47 -1 0.70 0.50 ag i d9 5s7f ag i d10 4f 0.000E+00 ( //r2// )= 0.000E+00 a0 0.0000 0.000E+00 0.000 0.000 sqrtdel= 1.0000 0.000E+00 47 -1 0.70 0.50 ag i d9 5s7f ag i d10 5f 0.000E+00 ( //r2// )= 0.000E+00 a0 0.0000 0.000E+00 0.000 0.000 sqrtdel= 1.0000 0.000E+00 47 -1 0.70 0.50 ag i d9 5s7f ag i d10 6f 0.000E+00 ( //r2// )= 0.000E+00 a0 0.0000 0.000E+00 0.000 0.000 sqrtdel= 1.0000 0.000E+00 47 -1 0.70 0.50 ag i d9 5s7f ag i d10 7f -3.165E+00 ( 5s//r2// 4d)=-3.165E+00 a0 -0.9614 6.679E-01-0.449-0.676 sqrtdel= 1.0000 -3.165E+00 47 -1 0.70 0.50 ag i d9 5s7f ag i d10 8f 0.000E+00 ( //r2// )= 0.000E+00 a0 0.0000 0.000E+00 0.000 0.000 sqrtdel= 1.0000 0.000E+00 47 -1 0.70 0.50 ag i d9 5s7f ag i d10 9f 0.000E+00 ( //r2// )= 0.000E+00 a0 0.0000 0.000E+00 0.000 0.000 sqrtdel= 1.0000 0.000E+00 47 -1 0.70 0.50 ag i d9 5s7f ag i d9 5s4f -2.600E+01 ( 7f//r2// 4f)= 3.552E+01 a0 -0.1579 1.931E+01-0.001-0.003 sqrtdel= 1.0000 3.552E+01 47 -1 0.70 0.50 ag i d9 5s7f ag i d9 5s5f -1.534E+02 ( 7f//r2// 5f)= 2.096E+02 a0 -0.2228 6.725E+02-0.001-0.002 sqrtdel= 1.0000 2.096E+02 47 -1 0.70 0.50 ag i d9 5s7f ag i d9 5s6f -1.348E+03 ( 7f//r2// 6f)= 1.842E+03 a0 -0.5862 5.195E+04-0.001-0.001 sqrtdel= 1.0000 1.842E+03 47 -1 0.70 0.50 ag i d9 5s7f ag i d9 5s7f 5.116E+03 ( 7f//r2// 7f)=-6.990E+03 a0 1.0000 7.479E+05 1.000 1.000 sqrtdel= 1.0000 -6.990E+03 47 -1 0.70 0.50 ag i d9 5s7f ag i d9 5s8f -2.495E+03 ( 7f//r2// 8f)= 3.409E+03 a0 -0.5594 1.779E+05-0.001-0.001 sqrtdel= 1.0000 3.409E+03 47 -1 0.70 0.50 ag i d9 5s7f ag i d9 5s9f -5.920E+02 ( 7f//r2// 9f)= 8.088E+02 a0 -0.1847 1.001E+04-0.001-0.002 sqrtdel= 1.0000 8.088E+02 47 -1 0.70 0.50 ag i d9 5s7f ag i d8 5s2 4f 0.000E+00 ( //r2// )= 0.000E+00 a0 0.0000 0.000E+00 0.000 0.000 sqrtdel= 1.0000 0.000E+00 47 -1 0.70 0.50 ag i d9 5s7f ag i d10 6h 0.000E+00 ( //r2// )= 0.000E+00 a0 0.0000 0.000E+00 0.000 0.000 sqrtdel= 1.0000 0.000E+00 47 -1 0.70 0.50 ag i d9 5s7f ag i d10 7h 0.000E+00 ( //r2// )= 0.000E+00 a0 0.0000 0.000E+00 0.000 0.000 sqrtdel= 1.0000 0.000E+00 47 -1 0.70 0.50 ag i d9 5s7f ag i d10 8h 0.000E+00 ( //r2// )= 0.000E+00 a0 0.0000 0.000E+00 0.000 0.000 sqrtdel= 1.0000 0.000E+00 47 -1 0.70 0.50 ag i d9 5s7f ag i d10 9h 0.000E+00 ( //r2// )= 0.000E+00 a0 0.0000 0.000E+00 0.000 0.000 sqrtdel= 1.0000 0.000E+00 47 -1 0.70 0.50 ag i d9 5s7f ag i d9 5s6h -2.273E+02 ( 7f//r2// 6h)=-4.151E+02 a0 -0.1792 5.220E+02 0.032 0.058 sqrtdel= 1.0000 -4.151E+02 47 -1 0.70 0.50 ag i d9 5s7f ag i d9 5s7h 3.460E+03 ( 7f//r2// 7h)= 6.317E+03 a0 0.8923 1.209E+05 0.494 0.602 sqrtdel= 1.0000 6.317E+03 47 -1 0.70 0.50 ag i d9 5s7f ag i d9 5s8h -4.731E+03 ( 7f//r2// 8h)=-8.638E+03 a0 -0.9495 2.261E+05-0.699-0.884 sqrtdel= 1.0000 -8.638E+03 47 -1 0.70 0.50 ag i d9 5s7f ag i d9 5s9h -4.033E+02 ( 7f//r2// 9h)=-7.364E+02 a0 -0.1117 1.643E+03-0.327-0.547 sqrtdel= 1.0000 -7.364E+02 47 -1 0.70 0.50 ag i d9 5s7f ag i d10 8k 0.000E+00 ( //r2// )= 0.000E+00 a0 0.0000 0.000E+00 0.000 0.000 sqrtdel= 1.0000 0.000E+00 47 -1 0.70 0.50 ag i d9 5s7f ag i d10 9k 0.000E+00 ( //r2// )= 0.000E+00 a0 0.0000 0.000E+00 0.000 0.000 sqrtdel= 1.0000 0.000E+00 47 -1 0.70 0.50 ag i d9 5s7f ag i d9 5s8k 0.000E+00 ( //r2// )= 0.000E+00 a0 0.0000 0.000E+00 0.000 0.000 sqrtdel= 1.0000 0.000E+00 47 -1 0.70 0.50 ag i d9 5s7f ag i d9 5s9k 0.000E+00 ( //r2// )= 0.000E+00 a0 0.0000 0.000E+00 0.000 0.000 sqrtdel= 1.0000 0.000E+00 47 -1 0.70 0.50 ag i d9 5s8f ag i d10 5p 0.000E+00 ( //r2// )= 0.000E+00 a0 0.0000 0.000E+00 0.000 0.000 sqrtdel= 1.0000 0.000E+00 47 -1 0.70 0.50 ag i d9 5s8f ag i d10 6p 0.000E+00 ( //r2// )= 0.000E+00 a0 0.0000 0.000E+00 0.000 0.000 sqrtdel= 1.0000 0.000E+00 47 -1 0.70 0.50 ag i d9 5s8f ag i d10 7p 0.000E+00 ( //r2// )= 0.000E+00 a0 0.0000 0.000E+00 0.000 0.000 sqrtdel= 1.0000 0.000E+00 47 -1 0.70 0.50 ag i d9 5s8f ag i d10 8p 0.000E+00 ( //r2// )= 0.000E+00 a0 0.0000 0.000E+00 0.000 0.000 sqrtdel= 1.0000 0.000E+00 47 -1 0.70 0.50 ag i d9 5s8f ag i d10 9p 0.000E+00 ( //r2// )= 0.000E+00 a0 0.0000 0.000E+00 0.000 0.000 sqrtdel= 1.0000 0.000E+00 47 -1 0.70 0.50 ag i d9 5s8f ag i d9 5s5p -4.140E+00 ( 8f//r2// 5p)=-5.555E+00 a0 -0.9395 4.898E-01-0.072-0.990 sqrtdel= 1.0000 -5.555E+00 47 -1 0.70 0.50 ag i d9 5s8f ag i d9 5s6p -1.690E+00 ( 8f//r2// 6p)=-2.268E+00 a0 -0.0402 8.161E-02 0.100 0.505 sqrtdel= 1.0000 -2.268E+00 47 -1 0.70 0.50 ag i d9 5s8f ag i d9 5s7p 1.838E+01 ( 8f//r2// 7p)= 2.466E+01 a0 0.0949 9.651E+00 0.155 0.542 sqrtdel= 1.0000 2.466E+01 47 -1 0.70 0.50 ag i d9 5s8f ag i d9 5s8p 1.027E+02 ( 8f//r2// 8p)= 1.378E+02 a0 0.1590 3.014E+02 0.186 0.496 sqrtdel= 1.0000 1.378E+02 47 -1 0.70 0.50 ag i d9 5s8f ag i d9 5s9p 4.827E+02 ( 8f//r2// 9p)= 6.477E+02 a0 0.2640 6.658E+03 0.215 0.438 sqrtdel= 1.0000 6.477E+02 47 -1 0.70 0.50 ag i d9 5s8f ag i d8 5s2 5p 0.000E+00 ( //r2// )= 0.000E+00 a0 0.0000 0.000E+00 0.000 0.000 sqrtdel= 1.0000 0.000E+00 47 -1 0.70 0.50 ag i d9 5s8f ag i d10 4f 0.000E+00 ( //r2// )= 0.000E+00 a0 0.0000 0.000E+00 0.000 0.000 sqrtdel= 1.0000 0.000E+00 47 -1 0.70 0.50 ag i d9 5s8f ag i d10 5f 0.000E+00 ( //r2// )= 0.000E+00 a0 0.0000 0.000E+00 0.000 0.000 sqrtdel= 1.0000 0.000E+00 47 -1 0.70 0.50 ag i d9 5s8f ag i d10 6f 0.000E+00 ( //r2// )= 0.000E+00 a0 0.0000 0.000E+00 0.000 0.000 sqrtdel= 1.0000 0.000E+00 47 -1 0.70 0.50 ag i d9 5s8f ag i d10 7f 0.000E+00 ( //r2// )= 0.000E+00 a0 0.0000 0.000E+00 0.000 0.000 sqrtdel= 1.0000 0.000E+00 47 -1 0.70 0.50 ag i d9 5s8f ag i d10 8f -3.165E+00 ( 5s//r2// 4d)=-3.165E+00 a0 -0.9614 6.679E-01-0.449-0.676 sqrtdel= 1.0000 -3.165E+00 47 -1 0.70 0.50 ag i d9 5s8f ag i d10 9f 0.000E+00 ( //r2// )= 0.000E+00 a0 0.0000 0.000E+00 0.000 0.000 sqrtdel= 1.0000 0.000E+00 47 -1 0.70 0.50 ag i d9 5s8f ag i d9 5s4f -1.566E+01 ( 8f//r2// 4f)= 2.139E+01 a0 -0.1204 7.005E+00-0.001-0.003 sqrtdel= 1.0000 2.139E+01 47 -1 0.70 0.50 ag i d9 5s8f ag i d9 5s5f -7.105E+01 ( 8f//r2// 5f)= 9.707E+01 a0 -0.1361 1.442E+02-0.001-0.003 sqrtdel= 1.0000 9.707E+01 47 -1 0.70 0.50 ag i d9 5s8f ag i d9 5s6f -3.229E+02 ( 8f//r2// 6f)= 4.411E+02 a0 -0.2009 2.978E+03-0.001-0.002 sqrtdel= 1.0000 4.411E+02 47 -1 0.70 0.50 ag i d9 5s8f ag i d9 5s7f -2.495E+03 ( 8f//r2// 7f)= 3.409E+03 a0 -0.5594 1.779E+05-0.001-0.001 sqrtdel= 1.0000 3.409E+03 47 -1 0.70 0.50 ag i d9 5s8f ag i d9 5s8f 9.070E+03 ( 8f//r2// 8f)=-1.239E+04 a0 1.0000 2.350E+06 1.000 1.000 sqrtdel= 1.0000 -1.239E+04 47 -1 0.70 0.50 ag i d9 5s8f ag i d9 5s9f -4.226E+03 ( 8f//r2// 9f)= 5.773E+03 a0 -0.5397 5.102E+05-0.001-0.001 sqrtdel= 1.0000 5.773E+03 47 -1 0.70 0.50 ag i d9 5s8f ag i d8 5s2 4f 0.000E+00 ( //r2// )= 0.000E+00 a0 0.0000 0.000E+00 0.000 0.000 sqrtdel= 1.0000 0.000E+00 47 -1 0.70 0.50 ag i d9 5s8f ag i d10 6h 0.000E+00 ( //r2// )= 0.000E+00 a0 0.0000 0.000E+00 0.000 0.000 sqrtdel= 1.0000 0.000E+00 47 -1 0.70 0.50 ag i d9 5s8f ag i d10 7h 0.000E+00 ( //r2// )= 0.000E+00 a0 0.0000 0.000E+00 0.000 0.000 sqrtdel= 1.0000 0.000E+00 47 -1 0.70 0.50 ag i d9 5s8f ag i d10 8h 0.000E+00 ( //r2// )= 0.000E+00 a0 0.0000 0.000E+00 0.000 0.000 sqrtdel= 1.0000 0.000E+00 47 -1 0.70 0.50 ag i d9 5s8f ag i d10 9h 0.000E+00 ( //r2// )= 0.000E+00 a0 0.0000 0.000E+00 0.000 0.000 sqrtdel= 1.0000 0.000E+00 47 -1 0.70 0.50 ag i d9 5s8f ag i d9 5s6h -5.332E+01 ( 8f//r2// 6h)=-9.734E+01 a0 -0.0577 2.871E+01 0.015 0.035 sqrtdel= 1.0000 -9.734E+01 47 -1 0.70 0.50 ag i d9 5s8f ag i d9 5s7h -6.608E+02 ( 8f//r2// 7h)=-1.206E+03 a0 -0.2163 4.411E+03 0.048 0.080 sqrtdel= 1.0000 -1.206E+03 47 -1 0.70 0.50 ag i d9 5s8f ag i d9 5s8h 6.949E+03 ( 8f//r2// 8h)= 1.269E+04 a0 0.9354 4.878E+05 0.598 0.706 sqrtdel= 1.0000 1.269E+04 47 -1 0.70 0.50 ag i d9 5s8f ag i d9 5s9h -7.612E+03 ( 8f//r2// 9h)=-1.390E+04 a0 -0.9025 5.852E+05-0.610-0.804 sqrtdel= 1.0000 -1.390E+04 47 -1 0.70 0.50 ag i d9 5s8f ag i d10 8k 0.000E+00 ( //r2// )= 0.000E+00 a0 0.0000 0.000E+00 0.000 0.000 sqrtdel= 1.0000 0.000E+00 47 -1 0.70 0.50 ag i d9 5s8f ag i d10 9k 0.000E+00 ( //r2// )= 0.000E+00 a0 0.0000 0.000E+00 0.000 0.000 sqrtdel= 1.0000 0.000E+00 47 -1 0.70 0.50 ag i d9 5s8f ag i d9 5s8k 0.000E+00 ( //r2// )= 0.000E+00 a0 0.0000 0.000E+00 0.000 0.000 sqrtdel= 1.0000 0.000E+00 47 -1 0.70 0.50 ag i d9 5s8f ag i d9 5s9k 0.000E+00 ( //r2// )= 0.000E+00 a0 0.0000 0.000E+00 0.000 0.000 sqrtdel= 1.0000 0.000E+00 47 -1 0.70 0.50 ag i d9 5s9f ag i d10 5p 0.000E+00 ( //r2// )= 0.000E+00 a0 0.0000 0.000E+00 0.000 0.000 sqrtdel= 1.0000 0.000E+00 47 -1 0.70 0.50 ag i d9 5s9f ag i d10 6p 0.000E+00 ( //r2// )= 0.000E+00 a0 0.0000 0.000E+00 0.000 0.000 sqrtdel= 1.0000 0.000E+00 47 -1 0.70 0.50 ag i d9 5s9f ag i d10 7p 0.000E+00 ( //r2// )= 0.000E+00 a0 0.0000 0.000E+00 0.000 0.000 sqrtdel= 1.0000 0.000E+00 47 -1 0.70 0.50 ag i d9 5s9f ag i d10 8p 0.000E+00 ( //r2// )= 0.000E+00 a0 0.0000 0.000E+00 0.000 0.000 sqrtdel= 1.0000 0.000E+00 47 -1 0.70 0.50 ag i d9 5s9f ag i d10 9p 0.000E+00 ( //r2// )= 0.000E+00 a0 0.0000 0.000E+00 0.000 0.000 sqrtdel= 1.0000 0.000E+00 47 -1 0.70 0.50 ag i d9 5s9f ag i d9 5s5p -3.432E+00 ( 9f//r2// 5p)=-4.604E+00 a0 -0.9319 3.364E-01-0.061-0.988 sqrtdel= 1.0000 -4.604E+00 47 -1 0.70 0.50 ag i d9 5s9f ag i d9 5s6p -2.022E+00 ( 9f//r2// 6p)=-2.713E+00 a0 -0.0583 1.168E-01 0.078 0.476 sqrtdel= 1.0000 -2.713E+00 47 -1 0.70 0.50 ag i d9 5s9f ag i d9 5s7p 1.034E+01 ( 9f//r2// 7p)= 1.387E+01 a0 0.0651 3.053E+00 0.120 0.509 sqrtdel= 1.0000 1.387E+01 47 -1 0.70 0.50 ag i d9 5s9f ag i d9 5s8p 5.553E+01 ( 9f//r2// 8p)= 7.450E+01 a0 0.1065 8.810E+01 0.142 0.460 sqrtdel= 1.0000 7.450E+01 47 -1 0.70 0.50 ag i d9 5s9f ag i d9 5s9p 2.094E+02 ( 9f//r2// 9p)= 2.809E+02 a0 0.1475 1.252E+03 0.159 0.401 sqrtdel= 1.0000 2.809E+02 47 -1 0.70 0.50 ag i d9 5s9f ag i d8 5s2 5p 0.000E+00 ( //r2// )= 0.000E+00 a0 0.0000 0.000E+00 0.000 0.000 sqrtdel= 1.0000 0.000E+00 47 -1 0.70 0.50 ag i d9 5s9f ag i d10 4f 0.000E+00 ( //r2// )= 0.000E+00 a0 0.0000 0.000E+00 0.000 0.000 sqrtdel= 1.0000 0.000E+00 47 -1 0.70 0.50 ag i d9 5s9f ag i d10 5f 0.000E+00 ( //r2// )= 0.000E+00 a0 0.0000 0.000E+00 0.000 0.000 sqrtdel= 1.0000 0.000E+00 47 -1 0.70 0.50 ag i d9 5s9f ag i d10 6f 0.000E+00 ( //r2// )= 0.000E+00 a0 0.0000 0.000E+00 0.000 0.000 sqrtdel= 1.0000 0.000E+00 47 -1 0.70 0.50 ag i d9 5s9f ag i d10 7f 0.000E+00 ( //r2// )= 0.000E+00 a0 0.0000 0.000E+00 0.000 0.000 sqrtdel= 1.0000 0.000E+00 47 -1 0.70 0.50 ag i d9 5s9f ag i d10 8f 0.000E+00 ( //r2// )= 0.000E+00 a0 0.0000 0.000E+00 0.000 0.000 sqrtdel= 1.0000 0.000E+00 47 -1 0.70 0.50 ag i d9 5s9f ag i d10 9f -3.165E+00 ( 5s//r2// 4d)=-3.165E+00 a0 -0.9614 6.679E-01-0.449-0.676 sqrtdel= 1.0000 -3.165E+00 47 -1 0.70 0.50 ag i d9 5s9f ag i d9 5s4f -1.079E+01 ( 9f//r2// 4f)= 1.474E+01 a0 -0.1010 3.326E+00-0.001-0.004 sqrtdel= 1.0000 1.474E+01 47 -1 0.70 0.50 ag i d9 5s9f ag i d9 5s5f -4.259E+01 ( 9f//r2// 5f)= 5.819E+01 a0 -0.1011 5.182E+01-0.001-0.003 sqrtdel= 1.0000 5.819E+01 47 -1 0.70 0.50 ag i d9 5s9f ag i d9 5s6f -1.483E+02 ( 9f//r2// 6f)= 2.027E+02 a0 -0.1192 6.288E+02-0.001-0.002 sqrtdel= 1.0000 2.027E+02 47 -1 0.70 0.50 ag i d9 5s9f ag i d9 5s7f -5.920E+02 ( 9f//r2// 7f)= 8.088E+02 a0 -0.1847 1.001E+04-0.001-0.002 sqrtdel= 1.0000 8.088E+02 47 -1 0.70 0.50 ag i d9 5s9f ag i d9 5s8f -4.226E+03 ( 9f//r2// 8f)= 5.773E+03 a0 -0.5397 5.102E+05-0.001-0.001 sqrtdel= 1.0000 5.773E+03 47 -1 0.70 0.50 ag i d9 5s9f ag i d9 5s9f 1.490E+04 ( 9f//r2// 9f)=-2.036E+04 a0 1.0000 6.347E+06 1.000 1.000 sqrtdel= 1.0000 -2.036E+04 47 -1 0.70 0.50 ag i d9 5s9f ag i d8 5s2 4f 0.000E+00 ( //r2// )= 0.000E+00 a0 0.0000 0.000E+00 0.000 0.000 sqrtdel= 1.0000 0.000E+00 47 -1 0.70 0.50 ag i d9 5s9f ag i d10 6h 0.000E+00 ( //r2// )= 0.000E+00 a0 0.0000 0.000E+00 0.000 0.000 sqrtdel= 1.0000 0.000E+00 47 -1 0.70 0.50 ag i d9 5s9f ag i d10 7h 0.000E+00 ( //r2// )= 0.000E+00 a0 0.0000 0.000E+00 0.000 0.000 sqrtdel= 1.0000 0.000E+00 47 -1 0.70 0.50 ag i d9 5s9f ag i d10 8h 0.000E+00 ( //r2// )= 0.000E+00 a0 0.0000 0.000E+00 0.000 0.000 sqrtdel= 1.0000 0.000E+00 47 -1 0.70 0.50 ag i d9 5s9f ag i d10 9h 0.000E+00 ( //r2// )= 0.000E+00 a0 0.0000 0.000E+00 0.000 0.000 sqrtdel= 1.0000 0.000E+00 47 -1 0.70 0.50 ag i d9 5s9f ag i d9 5s6h -2.389E+01 ( 9f//r2// 6h)=-4.361E+01 a0 -0.0326 5.763E+00 0.009 0.027 sqrtdel= 1.0000 -4.361E+01 47 -1 0.70 0.50 ag i d9 5s9f ag i d9 5s7h -1.546E+02 ( 9f//r2// 7h)=-2.823E+02 a0 -0.0680 2.415E+02 0.024 0.050 sqrtdel= 1.0000 -2.823E+02 47 -1 0.70 0.50 ag i d9 5s9f ag i d9 5s8h -1.446E+03 ( 9f//r2// 8h)=-2.639E+03 a0 -0.2396 2.111E+04 0.059 0.091 sqrtdel= 1.0000 -2.639E+03 47 -1 0.70 0.50 ag i d9 5s9f ag i d9 5s9h 1.226E+04 ( 9f//r2// 9h)= 2.239E+04 a0 0.9576 1.519E+06 0.672 0.776 sqrtdel= 1.0000 2.239E+04 47 -1 0.70 0.50 ag i d9 5s9f ag i d10 8k 0.000E+00 ( //r2// )= 0.000E+00 a0 0.0000 0.000E+00 0.000 0.000 sqrtdel= 1.0000 0.000E+00 47 -1 0.70 0.50 ag i d9 5s9f ag i d10 9k 0.000E+00 ( //r2// )= 0.000E+00 a0 0.0000 0.000E+00 0.000 0.000 sqrtdel= 1.0000 0.000E+00 47 -1 0.70 0.50 ag i d9 5s9f ag i d9 5s8k 0.000E+00 ( //r2// )= 0.000E+00 a0 0.0000 0.000E+00 0.000 0.000 sqrtdel= 1.0000 0.000E+00 47 -1 0.70 0.50 ag i d9 5s9f ag i d9 5s9k 0.000E+00 ( //r2// )= 0.000E+00 a0 0.0000 0.000E+00 0.000 0.000 sqrtdel= 1.0000 0.000E+00 47 -1 0.70 0.50 ag i d8 5s2 4f ag i d10 5p 0.000E+00 ( //r2// )= 0.000E+00 a0 0.0000 0.000E+00 0.000 0.000 sqrtdel= 1.0000 0.000E+00 47 -1 0.70 0.50 ag i d8 5s2 4f ag i d10 6p 0.000E+00 ( //r2// )= 0.000E+00 a0 0.0000 0.000E+00 0.000 0.000 sqrtdel= 1.0000 0.000E+00 47 -1 0.70 0.50 ag i d8 5s2 4f ag i d10 7p 0.000E+00 ( //r2// )= 0.000E+00 a0 0.0000 0.000E+00 0.000 0.000 sqrtdel= 1.0000 0.000E+00 47 -1 0.70 0.50 ag i d8 5s2 4f ag i d10 8p 0.000E+00 ( //r2// )= 0.000E+00 a0 0.0000 0.000E+00 0.000 0.000 sqrtdel= 1.0000 0.000E+00 47 -1 0.70 0.50 ag i d8 5s2 4f ag i d10 9p 0.000E+00 ( //r2// )= 0.000E+00 a0 0.0000 0.000E+00 0.000 0.000 sqrtdel= 1.0000 0.000E+00 47 -1 0.70 0.50 ag i d8 5s2 4f ag i d9 5s5p 0.000E+00 ( //r2// )= 0.000E+00 a0 0.0000 0.000E+00 0.000 0.000 sqrtdel= 1.0000 0.000E+00 47 -1 0.70 0.50 ag i d8 5s2 4f ag i d9 5s6p 0.000E+00 ( //r2// )= 0.000E+00 a0 0.0000 0.000E+00 0.000 0.000 sqrtdel= 1.0000 0.000E+00 47 -1 0.70 0.50 ag i d8 5s2 4f ag i d9 5s7p 0.000E+00 ( //r2// )= 0.000E+00 a0 0.0000 0.000E+00 0.000 0.000 sqrtdel= 1.0000 0.000E+00 47 -1 0.70 0.50 ag i d8 5s2 4f ag i d9 5s8p 0.000E+00 ( //r2// )= 0.000E+00 a0 0.0000 0.000E+00 0.000 0.000 sqrtdel= 1.0000 0.000E+00 47 -1 0.70 0.50 ag i d8 5s2 4f ag i d9 5s9p 0.000E+00 ( //r2// )= 0.000E+00 a0 0.0000 0.000E+00 0.000 0.000 sqrtdel= 1.0000 0.000E+00 47 -1 0.70 0.50 ag i d8 5s2 4f ag i d8 5s2 5p -8.645E+00 ( 4f//r2// 5p)=-1.160E+01 a0 -1.0000 2.135E+00-0.131-0.999 sqrtdel= 1.0000 -1.160E+01 47 -1 0.70 0.50 ag i d8 5s2 4f ag i d10 4f 0.000E+00 ( //r2// )= 0.000E+00 a0 0.0000 0.000E+00 0.000 0.000 sqrtdel= 1.0000 0.000E+00 47 -1 0.70 0.50 ag i d8 5s2 4f ag i d10 5f 0.000E+00 ( //r2// )= 0.000E+00 a0 0.0000 0.000E+00 0.000 0.000 sqrtdel= 1.0000 0.000E+00 47 -1 0.70 0.50 ag i d8 5s2 4f ag i d10 6f 0.000E+00 ( //r2// )= 0.000E+00 a0 0.0000 0.000E+00 0.000 0.000 sqrtdel= 1.0000 0.000E+00 47 -1 0.70 0.50 ag i d8 5s2 4f ag i d10 7f 0.000E+00 ( //r2// )= 0.000E+00 a0 0.0000 0.000E+00 0.000 0.000 sqrtdel= 1.0000 0.000E+00 47 -1 0.70 0.50 ag i d8 5s2 4f ag i d10 8f 0.000E+00 ( //r2// )= 0.000E+00 a0 0.0000 0.000E+00 0.000 0.000 sqrtdel= 1.0000 0.000E+00 47 -1 0.70 0.50 ag i d8 5s2 4f ag i d10 9f 0.000E+00 ( //r2// )= 0.000E+00 a0 0.0000 0.000E+00 0.000 0.000 sqrtdel= 1.0000 0.000E+00 47 -1 0.70 0.50 ag i d8 5s2 4f ag i d9 5s4f -2.794E+00 ( 5s//r2// 4d)=-2.794E+00 a0 -0.9543 5.204E-01-0.423-0.647 sqrtdel= 1.0000 -2.794E+00 47 -1 0.70 0.50 ag i d8 5s2 4f ag i d9 5s5f 0.000E+00 ( //r2// )= 0.000E+00 a0 0.0000 0.000E+00 0.000 0.000 sqrtdel= 1.0000 0.000E+00 47 -1 0.70 0.50 ag i d8 5s2 4f ag i d9 5s6f 0.000E+00 ( //r2// )= 0.000E+00 a0 0.0000 0.000E+00 0.000 0.000 sqrtdel= 1.0000 0.000E+00 47 -1 0.70 0.50 ag i d8 5s2 4f ag i d9 5s7f 0.000E+00 ( //r2// )= 0.000E+00 a0 0.0000 0.000E+00 0.000 0.000 sqrtdel= 1.0000 0.000E+00 47 -1 0.70 0.50 ag i d8 5s2 4f ag i d9 5s8f 0.000E+00 ( //r2// )= 0.000E+00 a0 0.0000 0.000E+00 0.000 0.000 sqrtdel= 1.0000 0.000E+00 47 -1 0.70 0.50 ag i d8 5s2 4f ag i d9 5s9f 0.000E+00 ( //r2// )= 0.000E+00 a0 0.0000 0.000E+00 0.000 0.000 sqrtdel= 1.0000 0.000E+00 47 -1 0.70 0.50 ag i d8 5s2 4f ag i d8 5s2 4f 3.580E+02 ( 4f//r2// 4f)=-4.891E+02 a0 1.0000 3.661E+03 1.000 1.000 sqrtdel= 1.0000 -4.891E+02 47 -1 0.70 0.50 ag i d8 5s2 4f ag i d10 6h 0.000E+00 ( //r2// )= 0.000E+00 a0 0.0000 0.000E+00 0.000 0.000 sqrtdel= 1.0000 0.000E+00 47 -1 0.70 0.50 ag i d8 5s2 4f ag i d10 7h 0.000E+00 ( //r2// )= 0.000E+00 a0 0.0000 0.000E+00 0.000 0.000 sqrtdel= 1.0000 0.000E+00 47 -1 0.70 0.50 ag i d8 5s2 4f ag i d10 8h 0.000E+00 ( //r2// )= 0.000E+00 a0 0.0000 0.000E+00 0.000 0.000 sqrtdel= 1.0000 0.000E+00 47 -1 0.70 0.50 ag i d8 5s2 4f ag i d10 9h 0.000E+00 ( //r2// )= 0.000E+00 a0 0.0000 0.000E+00 0.000 0.000 sqrtdel= 1.0000 0.000E+00 47 -1 0.70 0.50 ag i d8 5s2 4f ag i d9 5s6h 0.000E+00 ( //r2// )= 0.000E+00 a0 0.0000 0.000E+00 0.000 0.000 sqrtdel= 1.0000 0.000E+00 47 -1 0.70 0.50 ag i d8 5s2 4f ag i d9 5s7h 0.000E+00 ( //r2// )= 0.000E+00 a0 0.0000 0.000E+00 0.000 0.000 sqrtdel= 1.0000 0.000E+00 47 -1 0.70 0.50 ag i d8 5s2 4f ag i d9 5s8h 0.000E+00 ( //r2// )= 0.000E+00 a0 0.0000 0.000E+00 0.000 0.000 sqrtdel= 1.0000 0.000E+00 47 -1 0.70 0.50 ag i d8 5s2 4f ag i d9 5s9h 0.000E+00 ( //r2// )= 0.000E+00 a0 0.0000 0.000E+00 0.000 0.000 sqrtdel= 1.0000 0.000E+00 47 -1 0.70 0.50 ag i d8 5s2 4f ag i d10 8k 0.000E+00 ( //r2// )= 0.000E+00 a0 0.0000 0.000E+00 0.000 0.000 sqrtdel= 1.0000 0.000E+00 47 -1 0.70 0.50 ag i d8 5s2 4f ag i d10 9k 0.000E+00 ( //r2// )= 0.000E+00 a0 0.0000 0.000E+00 0.000 0.000 sqrtdel= 1.0000 0.000E+00 47 -1 0.70 0.50 ag i d8 5s2 4f ag i d9 5s8k 0.000E+00 ( //r2// )= 0.000E+00 a0 0.0000 0.000E+00 0.000 0.000 sqrtdel= 1.0000 0.000E+00 47 -1 0.70 0.50 ag i d8 5s2 4f ag i d9 5s9k 0.000E+00 ( //r2// )= 0.000E+00 a0 0.0000 0.000E+00 0.000 0.000 sqrtdel= 1.0000 0.000E+00 47 -1 0.70 0.50 ag i d10 6h ag i d10 5p 0.000E+00 ( //r2// )= 0.000E+00 a0 0.0000 0.000E+00 0.000 0.000 sqrtdel= 1.0000 0.000E+00 47 -1 0.70 0.50 ag i d10 6h ag i d10 6p 0.000E+00 ( //r2// )= 0.000E+00 a0 0.0000 0.000E+00 0.000 0.000 sqrtdel= 1.0000 0.000E+00 47 -1 0.70 0.50 ag i d10 6h ag i d10 7p 0.000E+00 ( //r2// )= 0.000E+00 a0 0.0000 0.000E+00 0.000 0.000 sqrtdel= 1.0000 0.000E+00 47 -1 0.70 0.50 ag i d10 6h ag i d10 8p 0.000E+00 ( //r2// )= 0.000E+00 a0 0.0000 0.000E+00 0.000 0.000 sqrtdel= 1.0000 0.000E+00 47 -1 0.70 0.50 ag i d10 6h ag i d10 9p 0.000E+00 ( //r2// )= 0.000E+00 a0 0.0000 0.000E+00 0.000 0.000 sqrtdel= 1.0000 0.000E+00 47 -1 0.70 0.50 ag i d10 6h ag i d9 5s5p 0.000E+00 ( //r2// )= 0.000E+00 a0 0.0000 0.000E+00 0.000 0.000 sqrtdel= 1.0000 0.000E+00 47 -1 0.70 0.50 ag i d10 6h ag i d9 5s6p 0.000E+00 ( //r2// )= 0.000E+00 a0 0.0000 0.000E+00 0.000 0.000 sqrtdel= 1.0000 0.000E+00 47 -1 0.70 0.50 ag i d10 6h ag i d9 5s7p 0.000E+00 ( //r2// )= 0.000E+00 a0 0.0000 0.000E+00 0.000 0.000 sqrtdel= 1.0000 0.000E+00 47 -1 0.70 0.50 ag i d10 6h ag i d9 5s8p 0.000E+00 ( //r2// )= 0.000E+00 a0 0.0000 0.000E+00 0.000 0.000 sqrtdel= 1.0000 0.000E+00 47 -1 0.70 0.50 ag i d10 6h ag i d9 5s9p 0.000E+00 ( //r2// )= 0.000E+00 a0 0.0000 0.000E+00 0.000 0.000 sqrtdel= 1.0000 0.000E+00 47 -1 0.70 0.50 ag i d10 6h ag i d8 5s2 5p 0.000E+00 ( //r2// )= 0.000E+00 a0 0.0000 0.000E+00 0.000 0.000 sqrtdel= 1.0000 0.000E+00 47 -1 0.70 0.50 ag i d10 6h ag i d10 4f 3.338E+02 ( 6h//r2// 4f)= 6.094E+02 a0 1.0000 1.125E+03 0.439 1.000 sqrtdel= 1.0000 6.094E+02 47 -1 0.70 0.50 ag i d10 6h ag i d10 5f -1.260E+03 ( 6h//r2// 5f)=-2.301E+03 a0 -0.9885 1.604E+04-0.831-0.929 sqrtdel= 1.0000 -2.301E+03 47 -1 0.70 0.50 ag i d10 6h ag i d10 6f 1.337E+03 ( 6h//r2// 6f)= 2.440E+03 a0 0.7984 1.805E+04 0.339 0.437 sqrtdel= 1.0000 2.440E+03 47 -1 0.70 0.50 ag i d10 6h ag i d10 7f -2.230E+02 ( 6h//r2// 7f)=-4.071E+02 a0 -0.1761 5.022E+02 0.032 0.059 sqrtdel= 1.0000 -4.071E+02 47 -1 0.70 0.50 ag i d10 6h ag i d10 8f -5.246E+01 ( 6h//r2// 8f)=-9.577E+01 a0 -0.0568 2.779E+01 0.015 0.036 sqrtdel= 1.0000 -9.577E+01 47 -1 0.70 0.50 ag i d10 6h ag i d10 9f -2.349E+01 ( 6h//r2// 9f)=-4.289E+01 a0 -0.0321 5.574E+00 0.009 0.027 sqrtdel= 1.0000 -4.289E+01 47 -1 0.70 0.50 ag i d10 6h ag i d9 5s4f 0.000E+00 ( //r2// )= 0.000E+00 a0 0.0000 0.000E+00 0.000 0.000 sqrtdel= 1.0000 0.000E+00 47 -1 0.70 0.50 ag i d10 6h ag i d9 5s5f 0.000E+00 ( //r2// )= 0.000E+00 a0 0.0000 0.000E+00 0.000 0.000 sqrtdel= 1.0000 0.000E+00 47 -1 0.70 0.50 ag i d10 6h ag i d9 5s6f 0.000E+00 ( //r2// )= 0.000E+00 a0 0.0000 0.000E+00 0.000 0.000 sqrtdel= 1.0000 0.000E+00 47 -1 0.70 0.50 ag i d10 6h ag i d9 5s7f 0.000E+00 ( //r2// )= 0.000E+00 a0 0.0000 0.000E+00 0.000 0.000 sqrtdel= 1.0000 0.000E+00 47 -1 0.70 0.50 ag i d10 6h ag i d9 5s8f 0.000E+00 ( //r2// )= 0.000E+00 a0 0.0000 0.000E+00 0.000 0.000 sqrtdel= 1.0000 0.000E+00 47 -1 0.70 0.50 ag i d10 6h ag i d9 5s9f 0.000E+00 ( //r2// )= 0.000E+00 a0 0.0000 0.000E+00 0.000 0.000 sqrtdel= 1.0000 0.000E+00 47 -1 0.70 0.50 ag i d10 6h ag i d8 5s2 4f 0.000E+00 ( //r2// )= 0.000E+00 a0 0.0000 0.000E+00 0.000 0.000 sqrtdel= 1.0000 0.000E+00 47 -1 0.70 0.50 ag i d10 6h ag i d10 6h 1.638E+03 ( 6h//r2// 6h)=-2.751E+03 a0 1.0000 2.710E+04 1.000 1.000 sqrtdel= 1.0000 -2.751E+03 47 -1 0.70 0.50 ag i d10 6h ag i d10 7h -9.019E+02 ( 6h//r2// 7h)= 1.515E+03 a0 -0.5963 8.216E+03 0.000 0.000 sqrtdel= 1.0000 1.515E+03 47 -1 0.70 0.50 ag i d10 6h ag i d10 8h -1.797E+02 ( 6h//r2// 8h)= 3.018E+02 a0 -0.1712 3.263E+02 0.000 0.000 sqrtdel= 1.0000 3.018E+02 47 -1 0.70 0.50 ag i d10 6h ag i d10 9h -7.432E+01 ( 6h//r2// 9h)= 1.248E+02 a0 -0.0916 5.579E+01 0.000 0.000 sqrtdel= 1.0000 1.248E+02 47 -1 0.70 0.50 ag i d10 6h ag i d9 5s6h -3.165E+00 ( 4d//r2// 5s)=-3.165E+00 a0 -0.9614 6.679E-01-0.449-0.676 sqrtdel= 1.0000 -3.165E+00 47 -1 0.70 0.50 ag i d10 6h ag i d9 5s7h 0.000E+00 ( //r2// )= 0.000E+00 a0 0.0000 0.000E+00 0.000 0.000 sqrtdel= 1.0000 0.000E+00 47 -1 0.70 0.50 ag i d10 6h ag i d9 5s8h 0.000E+00 ( //r2// )= 0.000E+00 a0 0.0000 0.000E+00 0.000 0.000 sqrtdel= 1.0000 0.000E+00 47 -1 0.70 0.50 ag i d10 6h ag i d9 5s9h 0.000E+00 ( //r2// )= 0.000E+00 a0 0.0000 0.000E+00 0.000 0.000 sqrtdel= 1.0000 0.000E+00 47 -1 0.70 0.50 ag i d10 6h ag i d10 8k 1.579E+03 ( 6h//r2// 8k)= 3.475E+03 a0 1.0000 1.278E+04 0.560 1.000 sqrtdel= 1.0000 3.475E+03 47 -1 0.70 0.50 ag i d10 6h ag i d10 9k 7.521E+02 ( 6h//r2// 9k)= 1.656E+03 a0 0.7049 2.901E+03 0.403 0.909 sqrtdel= 1.0000 1.656E+03 47 -1 0.70 0.50 ag i d10 6h ag i d9 5s8k 0.000E+00 ( //r2// )= 0.000E+00 a0 0.0000 0.000E+00 0.000 0.000 sqrtdel= 1.0000 0.000E+00 47 -1 0.70 0.50 ag i d10 6h ag i d9 5s9k 0.000E+00 ( //r2// )= 0.000E+00 a0 0.0000 0.000E+00 0.000 0.000 sqrtdel= 1.0000 0.000E+00 47 -1 0.70 0.50 ag i d10 7h ag i d10 5p 0.000E+00 ( //r2// )= 0.000E+00 a0 0.0000 0.000E+00 0.000 0.000 sqrtdel= 1.0000 0.000E+00 47 -1 0.70 0.50 ag i d10 7h ag i d10 6p 0.000E+00 ( //r2// )= 0.000E+00 a0 0.0000 0.000E+00 0.000 0.000 sqrtdel= 1.0000 0.000E+00 47 -1 0.70 0.50 ag i d10 7h ag i d10 7p 0.000E+00 ( //r2// )= 0.000E+00 a0 0.0000 0.000E+00 0.000 0.000 sqrtdel= 1.0000 0.000E+00 47 -1 0.70 0.50 ag i d10 7h ag i d10 8p 0.000E+00 ( //r2// )= 0.000E+00 a0 0.0000 0.000E+00 0.000 0.000 sqrtdel= 1.0000 0.000E+00 47 -1 0.70 0.50 ag i d10 7h ag i d10 9p 0.000E+00 ( //r2// )= 0.000E+00 a0 0.0000 0.000E+00 0.000 0.000 sqrtdel= 1.0000 0.000E+00 47 -1 0.70 0.50 ag i d10 7h ag i d9 5s5p 0.000E+00 ( //r2// )= 0.000E+00 a0 0.0000 0.000E+00 0.000 0.000 sqrtdel= 1.0000 0.000E+00 47 -1 0.70 0.50 ag i d10 7h ag i d9 5s6p 0.000E+00 ( //r2// )= 0.000E+00 a0 0.0000 0.000E+00 0.000 0.000 sqrtdel= 1.0000 0.000E+00 47 -1 0.70 0.50 ag i d10 7h ag i d9 5s7p 0.000E+00 ( //r2// )= 0.000E+00 a0 0.0000 0.000E+00 0.000 0.000 sqrtdel= 1.0000 0.000E+00 47 -1 0.70 0.50 ag i d10 7h ag i d9 5s8p 0.000E+00 ( //r2// )= 0.000E+00 a0 0.0000 0.000E+00 0.000 0.000 sqrtdel= 1.0000 0.000E+00 47 -1 0.70 0.50 ag i d10 7h ag i d9 5s9p 0.000E+00 ( //r2// )= 0.000E+00 a0 0.0000 0.000E+00 0.000 0.000 sqrtdel= 1.0000 0.000E+00 47 -1 0.70 0.50 ag i d10 7h ag i d8 5s2 5p 0.000E+00 ( //r2// )= 0.000E+00 a0 0.0000 0.000E+00 0.000 0.000 sqrtdel= 1.0000 0.000E+00 47 -1 0.70 0.50 ag i d10 7h ag i d10 4f 1.793E+02 ( 7h//r2// 4f)= 3.273E+02 a0 0.8182 3.246E+02 0.329 0.957 sqrtdel= 1.0000 3.273E+02 47 -1 0.70 0.50 ag i d10 7h ag i d10 5f 2.027E+02 ( 7h//r2// 5f)= 3.702E+02 a0 0.2452 4.152E+02-0.129-0.249 sqrtdel= 1.0000 3.702E+02 47 -1 0.70 0.50 ag i d10 7h ag i d10 6f -2.689E+03 ( 7h//r2// 6f)=-4.909E+03 a0 -0.9871 7.303E+04-0.795-0.940 sqrtdel= 1.0000 -4.909E+03 47 -1 0.70 0.50 ag i d10 7h ag i d10 7f 3.452E+03 ( 7h//r2// 7f)= 6.303E+03 a0 0.8905 1.204E+05 0.490 0.598 sqrtdel= 1.0000 6.303E+03 47 -1 0.70 0.50 ag i d10 7h ag i d10 8f -6.465E+02 ( 7h//r2// 8f)=-1.180E+03 a0 -0.2121 4.222E+03 0.049 0.081 sqrtdel= 1.0000 -1.180E+03 47 -1 0.70 0.50 ag i d10 7h ag i d10 9f -1.520E+02 ( 7h//r2// 9f)=-2.776E+02 a0 -0.0670 2.335E+02 0.024 0.051 sqrtdel= 1.0000 -2.776E+02 47 -1 0.70 0.50 ag i d10 7h ag i d9 5s4f 0.000E+00 ( //r2// )= 0.000E+00 a0 0.0000 0.000E+00 0.000 0.000 sqrtdel= 1.0000 0.000E+00 47 -1 0.70 0.50 ag i d10 7h ag i d9 5s5f 0.000E+00 ( //r2// )= 0.000E+00 a0 0.0000 0.000E+00 0.000 0.000 sqrtdel= 1.0000 0.000E+00 47 -1 0.70 0.50 ag i d10 7h ag i d9 5s6f 0.000E+00 ( //r2// )= 0.000E+00 a0 0.0000 0.000E+00 0.000 0.000 sqrtdel= 1.0000 0.000E+00 47 -1 0.70 0.50 ag i d10 7h ag i d9 5s7f 0.000E+00 ( //r2// )= 0.000E+00 a0 0.0000 0.000E+00 0.000 0.000 sqrtdel= 1.0000 0.000E+00 47 -1 0.70 0.50 ag i d10 7h ag i d9 5s8f 0.000E+00 ( //r2// )= 0.000E+00 a0 0.0000 0.000E+00 0.000 0.000 sqrtdel= 1.0000 0.000E+00 47 -1 0.70 0.50 ag i d10 7h ag i d9 5s9f 0.000E+00 ( //r2// )= 0.000E+00 a0 0.0000 0.000E+00 0.000 0.000 sqrtdel= 1.0000 0.000E+00 47 -1 0.70 0.50 ag i d10 7h ag i d8 5s2 4f 0.000E+00 ( //r2// )= 0.000E+00 a0 0.0000 0.000E+00 0.000 0.000 sqrtdel= 1.0000 0.000E+00 47 -1 0.70 0.50 ag i d10 7h ag i d10 6h -9.019E+02 ( 7h//r2// 6h)= 1.515E+03 a0 -0.5963 8.216E+03 0.000 0.000 sqrtdel= 1.0000 1.515E+03 47 -1 0.70 0.50 ag i d10 7h ag i d10 7h 3.822E+03 ( 7h//r2// 7h)=-6.419E+03 a0 1.0000 1.476E+05 1.000 1.000 sqrtdel= 1.0000 -6.419E+03 47 -1 0.70 0.50 ag i d10 7h ag i d10 8h -2.002E+03 ( 7h//r2// 8h)= 3.363E+03 a0 -0.5844 4.050E+04 0.000 0.000 sqrtdel= 1.0000 3.363E+03 47 -1 0.70 0.50 ag i d10 7h ag i d10 9h -4.230E+02 ( 7h//r2// 9h)= 7.104E+02 a0 -0.1723 1.807E+03 0.000 0.000 sqrtdel= 1.0000 7.104E+02 47 -1 0.70 0.50 ag i d10 7h ag i d9 5s6h 0.000E+00 ( //r2// )= 0.000E+00 a0 0.0000 0.000E+00 0.000 0.000 sqrtdel= 1.0000 0.000E+00 47 -1 0.70 0.50 ag i d10 7h ag i d9 5s7h -3.165E+00 ( 4d//r2// 5s)=-3.165E+00 a0 -0.9614 6.679E-01-0.449-0.676 sqrtdel= 1.0000 -3.165E+00 47 -1 0.70 0.50 ag i d10 7h ag i d9 5s8h 0.000E+00 ( //r2// )= 0.000E+00 a0 0.0000 0.000E+00 0.000 0.000 sqrtdel= 1.0000 0.000E+00 47 -1 0.70 0.50 ag i d10 7h ag i d9 5s9h 0.000E+00 ( //r2// )= 0.000E+00 a0 0.0000 0.000E+00 0.000 0.000 sqrtdel= 1.0000 0.000E+00 47 -1 0.70 0.50 ag i d10 7h ag i d10 8k -4.041E+03 ( 7h//r2// 8k)=-8.895E+03 a0 -0.9720 8.373E+04-0.788-0.880 sqrtdel= 1.0000 -8.895E+03 47 -1 0.70 0.50 ag i d10 7h ag i d10 9k 1.230E+03 ( 7h//r2// 9k)= 2.708E+03 a0 0.4169 7.758E+03 0.028 0.051 sqrtdel= 1.0000 2.708E+03 47 -1 0.70 0.50 ag i d10 7h ag i d9 5s8k 0.000E+00 ( //r2// )= 0.000E+00 a0 0.0000 0.000E+00 0.000 0.000 sqrtdel= 1.0000 0.000E+00 47 -1 0.70 0.50 ag i d10 7h ag i d9 5s9k 0.000E+00 ( //r2// )= 0.000E+00 a0 0.0000 0.000E+00 0.000 0.000 sqrtdel= 1.0000 0.000E+00 47 -1 0.70 0.50 ag i d10 8h ag i d10 5p 0.000E+00 ( //r2// )= 0.000E+00 a0 0.0000 0.000E+00 0.000 0.000 sqrtdel= 1.0000 0.000E+00 47 -1 0.70 0.50 ag i d10 8h ag i d10 6p 0.000E+00 ( //r2// )= 0.000E+00 a0 0.0000 0.000E+00 0.000 0.000 sqrtdel= 1.0000 0.000E+00 47 -1 0.70 0.50 ag i d10 8h ag i d10 7p 0.000E+00 ( //r2// )= 0.000E+00 a0 0.0000 0.000E+00 0.000 0.000 sqrtdel= 1.0000 0.000E+00 47 -1 0.70 0.50 ag i d10 8h ag i d10 8p 0.000E+00 ( //r2// )= 0.000E+00 a0 0.0000 0.000E+00 0.000 0.000 sqrtdel= 1.0000 0.000E+00 47 -1 0.70 0.50 ag i d10 8h ag i d10 9p 0.000E+00 ( //r2// )= 0.000E+00 a0 0.0000 0.000E+00 0.000 0.000 sqrtdel= 1.0000 0.000E+00 47 -1 0.70 0.50 ag i d10 8h ag i d9 5s5p 0.000E+00 ( //r2// )= 0.000E+00 a0 0.0000 0.000E+00 0.000 0.000 sqrtdel= 1.0000 0.000E+00 47 -1 0.70 0.50 ag i d10 8h ag i d9 5s6p 0.000E+00 ( //r2// )= 0.000E+00 a0 0.0000 0.000E+00 0.000 0.000 sqrtdel= 1.0000 0.000E+00 47 -1 0.70 0.50 ag i d10 8h ag i d9 5s7p 0.000E+00 ( //r2// )= 0.000E+00 a0 0.0000 0.000E+00 0.000 0.000 sqrtdel= 1.0000 0.000E+00 47 -1 0.70 0.50 ag i d10 8h ag i d9 5s8p 0.000E+00 ( //r2// )= 0.000E+00 a0 0.0000 0.000E+00 0.000 0.000 sqrtdel= 1.0000 0.000E+00 47 -1 0.70 0.50 ag i d10 8h ag i d9 5s9p 0.000E+00 ( //r2// )= 0.000E+00 a0 0.0000 0.000E+00 0.000 0.000 sqrtdel= 1.0000 0.000E+00 47 -1 0.70 0.50 ag i d10 8h ag i d8 5s2 5p 0.000E+00 ( //r2// )= 0.000E+00 a0 0.0000 0.000E+00 0.000 0.000 sqrtdel= 1.0000 0.000E+00 47 -1 0.70 0.50 ag i d10 8h ag i d10 4f 1.148E+02 ( 8h//r2// 4f)= 2.096E+02 a0 0.6874 1.331E+02 0.254 0.913 sqrtdel= 1.0000 2.096E+02 47 -1 0.70 0.50 ag i d10 8h ag i d10 5f 1.866E+02 ( 8h//r2// 5f)= 3.407E+02 a0 0.3164 3.517E+02 0.001 0.003 sqrtdel= 1.0000 3.407E+02 47 -1 0.70 0.50 ag i d10 8h ag i d10 6f -2.601E+01 ( 8h//r2// 6f)=-4.748E+01 a0 -0.0139 6.831E+00-0.289-0.495 sqrtdel= 1.0000 -4.748E+01 47 -1 0.70 0.50 ag i d10 8h ag i d10 7f -4.761E+03 ( 8h//r2// 7f)=-8.693E+03 a0 -0.9510 2.290E+05-0.704-0.887 sqrtdel= 1.0000 -8.693E+03 47 -1 0.70 0.50 ag i d10 8h ag i d10 8f 6.933E+03 ( 8h//r2// 8f)= 1.266E+04 a0 0.9335 4.855E+05 0.592 0.702 sqrtdel= 1.0000 1.266E+04 47 -1 0.70 0.50 ag i d10 8h ag i d10 9f -1.411E+03 ( 8h//r2// 9f)=-2.577E+03 a0 -0.2343 2.012E+04 0.060 0.093 sqrtdel= 1.0000 -2.577E+03 47 -1 0.70 0.50 ag i d10 8h ag i d9 5s4f 0.000E+00 ( //r2// )= 0.000E+00 a0 0.0000 0.000E+00 0.000 0.000 sqrtdel= 1.0000 0.000E+00 47 -1 0.70 0.50 ag i d10 8h ag i d9 5s5f 0.000E+00 ( //r2// )= 0.000E+00 a0 0.0000 0.000E+00 0.000 0.000 sqrtdel= 1.0000 0.000E+00 47 -1 0.70 0.50 ag i d10 8h ag i d9 5s6f 0.000E+00 ( //r2// )= 0.000E+00 a0 0.0000 0.000E+00 0.000 0.000 sqrtdel= 1.0000 0.000E+00 47 -1 0.70 0.50 ag i d10 8h ag i d9 5s7f 0.000E+00 ( //r2// )= 0.000E+00 a0 0.0000 0.000E+00 0.000 0.000 sqrtdel= 1.0000 0.000E+00 47 -1 0.70 0.50 ag i d10 8h ag i d9 5s8f 0.000E+00 ( //r2// )= 0.000E+00 a0 0.0000 0.000E+00 0.000 0.000 sqrtdel= 1.0000 0.000E+00 47 -1 0.70 0.50 ag i d10 8h ag i d9 5s9f 0.000E+00 ( //r2// )= 0.000E+00 a0 0.0000 0.000E+00 0.000 0.000 sqrtdel= 1.0000 0.000E+00 47 -1 0.70 0.50 ag i d10 8h ag i d8 5s2 4f 0.000E+00 ( //r2// )= 0.000E+00 a0 0.0000 0.000E+00 0.000 0.000 sqrtdel= 1.0000 0.000E+00 47 -1 0.70 0.50 ag i d10 8h ag i d10 6h -1.797E+02 ( 8h//r2// 6h)= 3.018E+02 a0 -0.1712 3.263E+02 0.000 0.000 sqrtdel= 1.0000 3.018E+02 47 -1 0.70 0.50 ag i d10 8h ag i d10 7h -2.002E+03 ( 8h//r2// 7h)= 3.363E+03 a0 -0.5844 4.050E+04 0.000 0.000 sqrtdel= 1.0000 3.363E+03 47 -1 0.70 0.50 ag i d10 8h ag i d10 8h 7.392E+03 ( 8h//r2// 8h)=-1.241E+04 a0 1.0000 5.519E+05 1.000 1.000 sqrtdel= 1.0000 -1.241E+04 47 -1 0.70 0.50 ag i d10 8h ag i d10 9h -3.659E+03 ( 8h//r2// 9h)= 6.146E+03 a0 -0.5631 1.353E+05 0.000 0.000 sqrtdel= 1.0000 6.146E+03 47 -1 0.70 0.50 ag i d10 8h ag i d9 5s6h 0.000E+00 ( //r2// )= 0.000E+00 a0 0.0000 0.000E+00 0.000 0.000 sqrtdel= 1.0000 0.000E+00 47 -1 0.70 0.50 ag i d10 8h ag i d9 5s7h 0.000E+00 ( //r2// )= 0.000E+00 a0 0.0000 0.000E+00 0.000 0.000 sqrtdel= 1.0000 0.000E+00 47 -1 0.70 0.50 ag i d10 8h ag i d9 5s8h -3.165E+00 ( 4d//r2// 5s)=-3.165E+00 a0 -0.9614 6.679E-01-0.449-0.676 sqrtdel= 1.0000 -3.165E+00 47 -1 0.70 0.50 ag i d10 8h ag i d9 5s9h 0.000E+00 ( //r2// )= 0.000E+00 a0 0.0000 0.000E+00 0.000 0.000 sqrtdel= 1.0000 0.000E+00 47 -1 0.70 0.50 ag i d10 8h ag i d10 8k 3.279E+03 ( 8h//r2// 8k)= 7.218E+03 a0 0.7010 5.514E+04 0.256 0.341 sqrtdel= 1.0000 7.218E+03 47 -1 0.70 0.50 ag i d10 8h ag i d10 9k -7.703E+03 ( 8h//r2// 9k)=-1.696E+04 a0 -0.9905 3.043E+05-0.828-0.929 sqrtdel= 1.0000 -1.696E+04 47 -1 0.70 0.50 ag i d10 8h ag i d9 5s8k 0.000E+00 ( //r2// )= 0.000E+00 a0 0.0000 0.000E+00 0.000 0.000 sqrtdel= 1.0000 0.000E+00 47 -1 0.70 0.50 ag i d10 8h ag i d9 5s9k 0.000E+00 ( //r2// )= 0.000E+00 a0 0.0000 0.000E+00 0.000 0.000 sqrtdel= 1.0000 0.000E+00 47 -1 0.70 0.50 ag i d10 9h ag i d10 5p 0.000E+00 ( //r2// )= 0.000E+00 a0 0.0000 0.000E+00 0.000 0.000 sqrtdel= 1.0000 0.000E+00 47 -1 0.70 0.50 ag i d10 9h ag i d10 6p 0.000E+00 ( //r2// )= 0.000E+00 a0 0.0000 0.000E+00 0.000 0.000 sqrtdel= 1.0000 0.000E+00 47 -1 0.70 0.50 ag i d10 9h ag i d10 7p 0.000E+00 ( //r2// )= 0.000E+00 a0 0.0000 0.000E+00 0.000 0.000 sqrtdel= 1.0000 0.000E+00 47 -1 0.70 0.50 ag i d10 9h ag i d10 8p 0.000E+00 ( //r2// )= 0.000E+00 a0 0.0000 0.000E+00 0.000 0.000 sqrtdel= 1.0000 0.000E+00 47 -1 0.70 0.50 ag i d10 9h ag i d10 9p 0.000E+00 ( //r2// )= 0.000E+00 a0 0.0000 0.000E+00 0.000 0.000 sqrtdel= 1.0000 0.000E+00 47 -1 0.70 0.50 ag i d10 9h ag i d9 5s5p 0.000E+00 ( //r2// )= 0.000E+00 a0 0.0000 0.000E+00 0.000 0.000 sqrtdel= 1.0000 0.000E+00 47 -1 0.70 0.50 ag i d10 9h ag i d9 5s6p 0.000E+00 ( //r2// )= 0.000E+00 a0 0.0000 0.000E+00 0.000 0.000 sqrtdel= 1.0000 0.000E+00 47 -1 0.70 0.50 ag i d10 9h ag i d9 5s7p 0.000E+00 ( //r2// )= 0.000E+00 a0 0.0000 0.000E+00 0.000 0.000 sqrtdel= 1.0000 0.000E+00 47 -1 0.70 0.50 ag i d10 9h ag i d9 5s8p 0.000E+00 ( //r2// )= 0.000E+00 a0 0.0000 0.000E+00 0.000 0.000 sqrtdel= 1.0000 0.000E+00 47 -1 0.70 0.50 ag i d10 9h ag i d9 5s9p 0.000E+00 ( //r2// )= 0.000E+00 a0 0.0000 0.000E+00 0.000 0.000 sqrtdel= 1.0000 0.000E+00 47 -1 0.70 0.50 ag i d10 9h ag i d8 5s2 5p 0.000E+00 ( //r2// )= 0.000E+00 a0 0.0000 0.000E+00 0.000 0.000 sqrtdel= 1.0000 0.000E+00 47 -1 0.70 0.50 ag i d10 9h ag i d10 4f 8.186E+01 ( 9h//r2// 4f)= 1.494E+02 a0 0.6088 6.768E+01 0.203 0.881 sqrtdel= 1.0000 1.494E+02 47 -1 0.70 0.50 ag i d10 9h ag i d10 5f 1.416E+02 ( 9h//r2// 5f)= 2.584E+02 a0 0.3032 2.024E+02 0.036 0.119 sqrtdel= 1.0000 2.584E+02 47 -1 0.70 0.50 ag i d10 9h ag i d10 6f 1.348E+02 ( 9h//r2// 6f)= 2.461E+02 a0 0.0968 1.835E+02-0.138-0.307 sqrtdel= 1.0000 2.461E+02 47 -1 0.70 0.50 ag i d10 9h ag i d10 7f -3.889E+02 ( 9h//r2// 7f)=-7.100E+02 a0 -0.1072 1.528E+03-0.326-0.544 sqrtdel= 1.0000 -7.100E+02 47 -1 0.70 0.50 ag i d10 9h ag i d10 8f -7.676E+03 ( 9h//r2// 8f)=-1.401E+04 a0 -0.9054 5.952E+05-0.617-0.809 sqrtdel= 1.0000 -1.401E+04 47 -1 0.70 0.50 ag i d10 9h ag i d10 9f 1.223E+04 ( 9h//r2// 9f)= 2.234E+04 a0 0.9558 1.512E+06 0.667 0.771 sqrtdel= 1.0000 2.234E+04 47 -1 0.70 0.50 ag i d10 9h ag i d9 5s4f 0.000E+00 ( //r2// )= 0.000E+00 a0 0.0000 0.000E+00 0.000 0.000 sqrtdel= 1.0000 0.000E+00 47 -1 0.70 0.50 ag i d10 9h ag i d9 5s5f 0.000E+00 ( //r2// )= 0.000E+00 a0 0.0000 0.000E+00 0.000 0.000 sqrtdel= 1.0000 0.000E+00 47 -1 0.70 0.50 ag i d10 9h ag i d9 5s6f 0.000E+00 ( //r2// )= 0.000E+00 a0 0.0000 0.000E+00 0.000 0.000 sqrtdel= 1.0000 0.000E+00 47 -1 0.70 0.50 ag i d10 9h ag i d9 5s7f 0.000E+00 ( //r2// )= 0.000E+00 a0 0.0000 0.000E+00 0.000 0.000 sqrtdel= 1.0000 0.000E+00 47 -1 0.70 0.50 ag i d10 9h ag i d9 5s8f 0.000E+00 ( //r2// )= 0.000E+00 a0 0.0000 0.000E+00 0.000 0.000 sqrtdel= 1.0000 0.000E+00 47 -1 0.70 0.50 ag i d10 9h ag i d9 5s9f 0.000E+00 ( //r2// )= 0.000E+00 a0 0.0000 0.000E+00 0.000 0.000 sqrtdel= 1.0000 0.000E+00 47 -1 0.70 0.50 ag i d10 9h ag i d8 5s2 4f 0.000E+00 ( //r2// )= 0.000E+00 a0 0.0000 0.000E+00 0.000 0.000 sqrtdel= 1.0000 0.000E+00 47 -1 0.70 0.50 ag i d10 9h ag i d10 6h -7.432E+01 ( 9h//r2// 6h)= 1.248E+02 a0 -0.0916 5.579E+01 0.000 0.000 sqrtdel= 1.0000 1.248E+02 47 -1 0.70 0.50 ag i d10 9h ag i d10 7h -4.230E+02 ( 9h//r2// 7h)= 7.104E+02 a0 -0.1723 1.807E+03 0.000 0.000 sqrtdel= 1.0000 7.104E+02 47 -1 0.70 0.50 ag i d10 9h ag i d10 8h -3.659E+03 ( 9h//r2// 8h)= 6.146E+03 a0 -0.5631 1.353E+05 0.000 0.000 sqrtdel= 1.0000 6.146E+03 47 -1 0.70 0.50 ag i d10 9h ag i d10 9h 1.280E+04 ( 9h//r2// 9h)=-2.149E+04 a0 1.0000 1.654E+06 1.000 1.000 sqrtdel= 1.0000 -2.149E+04 47 -1 0.70 0.50 ag i d10 9h ag i d9 5s6h 0.000E+00 ( //r2// )= 0.000E+00 a0 0.0000 0.000E+00 0.000 0.000 sqrtdel= 1.0000 0.000E+00 47 -1 0.70 0.50 ag i d10 9h ag i d9 5s7h 0.000E+00 ( //r2// )= 0.000E+00 a0 0.0000 0.000E+00 0.000 0.000 sqrtdel= 1.0000 0.000E+00 47 -1 0.70 0.50 ag i d10 9h ag i d9 5s8h 0.000E+00 ( //r2// )= 0.000E+00 a0 0.0000 0.000E+00 0.000 0.000 sqrtdel= 1.0000 0.000E+00 47 -1 0.70 0.50 ag i d10 9h ag i d9 5s9h -3.165E+00 ( 4d//r2// 5s)=-3.165E+00 a0 -0.9614 6.679E-01-0.449-0.676 sqrtdel= 1.0000 -3.165E+00 47 -1 0.70 0.50 ag i d10 9h ag i d10 8k -4.308E+02 ( 9h//r2// 8k)=-9.485E+02 a0 -0.1192 9.519E+02 0.022 0.039 sqrtdel= 1.0000 -9.485E+02 47 -1 0.70 0.50 ag i d10 9h ag i d10 9k 7.684E+03 ( 9h//r2// 9k)= 1.692E+04 a0 0.8181 3.028E+05 0.387 0.484 sqrtdel= 1.0000 1.692E+04 47 -1 0.70 0.50 ag i d10 9h ag i d9 5s8k 0.000E+00 ( //r2// )= 0.000E+00 a0 0.0000 0.000E+00 0.000 0.000 sqrtdel= 1.0000 0.000E+00 47 -1 0.70 0.50 ag i d10 9h ag i d9 5s9k 0.000E+00 ( //r2// )= 0.000E+00 a0 0.0000 0.000E+00 0.000 0.000 sqrtdel= 1.0000 0.000E+00 47 -1 0.70 0.50 ag i d9 5s6h ag i d10 5p 0.000E+00 ( //r2// )= 0.000E+00 a0 0.0000 0.000E+00 0.000 0.000 sqrtdel= 1.0000 0.000E+00 47 -1 0.70 0.50 ag i d9 5s6h ag i d10 6p 0.000E+00 ( //r2// )= 0.000E+00 a0 0.0000 0.000E+00 0.000 0.000 sqrtdel= 1.0000 0.000E+00 47 -1 0.70 0.50 ag i d9 5s6h ag i d10 7p 0.000E+00 ( //r2// )= 0.000E+00 a0 0.0000 0.000E+00 0.000 0.000 sqrtdel= 1.0000 0.000E+00 47 -1 0.70 0.50 ag i d9 5s6h ag i d10 8p 0.000E+00 ( //r2// )= 0.000E+00 a0 0.0000 0.000E+00 0.000 0.000 sqrtdel= 1.0000 0.000E+00 47 -1 0.70 0.50 ag i d9 5s6h ag i d10 9p 0.000E+00 ( //r2// )= 0.000E+00 a0 0.0000 0.000E+00 0.000 0.000 sqrtdel= 1.0000 0.000E+00 47 -1 0.70 0.50 ag i d9 5s6h ag i d9 5s5p 0.000E+00 ( //r2// )= 0.000E+00 a0 0.0000 0.000E+00 0.000 0.000 sqrtdel= 1.0000 0.000E+00 47 -1 0.70 0.50 ag i d9 5s6h ag i d9 5s6p 0.000E+00 ( //r2// )= 0.000E+00 a0 0.0000 0.000E+00 0.000 0.000 sqrtdel= 1.0000 0.000E+00 47 -1 0.70 0.50 ag i d9 5s6h ag i d9 5s7p 0.000E+00 ( //r2// )= 0.000E+00 a0 0.0000 0.000E+00 0.000 0.000 sqrtdel= 1.0000 0.000E+00 47 -1 0.70 0.50 ag i d9 5s6h ag i d9 5s8p 0.000E+00 ( //r2// )= 0.000E+00 a0 0.0000 0.000E+00 0.000 0.000 sqrtdel= 1.0000 0.000E+00 47 -1 0.70 0.50 ag i d9 5s6h ag i d9 5s9p 0.000E+00 ( //r2// )= 0.000E+00 a0 0.0000 0.000E+00 0.000 0.000 sqrtdel= 1.0000 0.000E+00 47 -1 0.70 0.50 ag i d9 5s6h ag i d8 5s2 5p 0.000E+00 ( //r2// )= 0.000E+00 a0 0.0000 0.000E+00 0.000 0.000 sqrtdel= 1.0000 0.000E+00 47 -1 0.70 0.50 ag i d9 5s6h ag i d10 4f 0.000E+00 ( //r2// )= 0.000E+00 a0 0.0000 0.000E+00 0.000 0.000 sqrtdel= 1.0000 0.000E+00 47 -1 0.70 0.50 ag i d9 5s6h ag i d10 5f 0.000E+00 ( //r2// )= 0.000E+00 a0 0.0000 0.000E+00 0.000 0.000 sqrtdel= 1.0000 0.000E+00 47 -1 0.70 0.50 ag i d9 5s6h ag i d10 6f 0.000E+00 ( //r2// )= 0.000E+00 a0 0.0000 0.000E+00 0.000 0.000 sqrtdel= 1.0000 0.000E+00 47 -1 0.70 0.50 ag i d9 5s6h ag i d10 7f 0.000E+00 ( //r2// )= 0.000E+00 a0 0.0000 0.000E+00 0.000 0.000 sqrtdel= 1.0000 0.000E+00 47 -1 0.70 0.50 ag i d9 5s6h ag i d10 8f 0.000E+00 ( //r2// )= 0.000E+00 a0 0.0000 0.000E+00 0.000 0.000 sqrtdel= 1.0000 0.000E+00 47 -1 0.70 0.50 ag i d9 5s6h ag i d10 9f 0.000E+00 ( //r2// )= 0.000E+00 a0 0.0000 0.000E+00 0.000 0.000 sqrtdel= 1.0000 0.000E+00 47 -1 0.70 0.50 ag i d9 5s6h ag i d9 5s4f 3.329E+02 ( 6h//r2// 4f)= 6.078E+02 a0 1.0000 1.120E+03 0.438 1.000 sqrtdel= 1.0000 6.078E+02 47 -1 0.70 0.50 ag i d9 5s6h ag i d9 5s5f -1.258E+03 ( 6h//r2// 5f)=-2.296E+03 a0 -0.9887 1.597E+04-0.831-0.930 sqrtdel= 1.0000 -2.296E+03 47 -1 0.70 0.50 ag i d9 5s6h ag i d9 5s6f 1.339E+03 ( 6h//r2// 6f)= 2.445E+03 a0 0.8001 1.812E+04 0.341 0.440 sqrtdel= 1.0000 2.445E+03 47 -1 0.70 0.50 ag i d9 5s6h ag i d9 5s7f -2.273E+02 ( 6h//r2// 7f)=-4.151E+02 a0 -0.1792 5.220E+02 0.032 0.058 sqrtdel= 1.0000 -4.151E+02 47 -1 0.70 0.50 ag i d9 5s6h ag i d9 5s8f -5.332E+01 ( 6h//r2// 8f)=-9.734E+01 a0 -0.0577 2.871E+01 0.015 0.035 sqrtdel= 1.0000 -9.734E+01 47 -1 0.70 0.50 ag i d9 5s6h ag i d9 5s9f -2.389E+01 ( 6h//r2// 9f)=-4.361E+01 a0 -0.0326 5.763E+00 0.009 0.027 sqrtdel= 1.0000 -4.361E+01 47 -1 0.70 0.50 ag i d9 5s6h ag i d8 5s2 4f 0.000E+00 ( //r2// )= 0.000E+00 a0 0.0000 0.000E+00 0.000 0.000 sqrtdel= 1.0000 0.000E+00 47 -1 0.70 0.50 ag i d9 5s6h ag i d10 6h -3.165E+00 ( 5s//r2// 4d)=-3.165E+00 a0 -0.9614 6.679E-01-0.449-0.676 sqrtdel= 1.0000 -3.165E+00 47 -1 0.70 0.50 ag i d9 5s6h ag i d10 7h 0.000E+00 ( //r2// )= 0.000E+00 a0 0.0000 0.000E+00 0.000 0.000 sqrtdel= 1.0000 0.000E+00 47 -1 0.70 0.50 ag i d9 5s6h ag i d10 8h 0.000E+00 ( //r2// )= 0.000E+00 a0 0.0000 0.000E+00 0.000 0.000 sqrtdel= 1.0000 0.000E+00 47 -1 0.70 0.50 ag i d9 5s6h ag i d10 9h 0.000E+00 ( //r2// )= 0.000E+00 a0 0.0000 0.000E+00 0.000 0.000 sqrtdel= 1.0000 0.000E+00 47 -1 0.70 0.50 ag i d9 5s6h ag i d9 5s6h 1.638E+03 ( 6h//r2// 6h)=-2.751E+03 a0 1.0000 2.710E+04 1.000 1.000 sqrtdel= 1.0000 -2.751E+03 47 -1 0.70 0.50 ag i d9 5s6h ag i d9 5s7h -9.019E+02 ( 6h//r2// 7h)= 1.515E+03 a0 -0.5963 8.216E+03 0.000 0.000 sqrtdel= 1.0000 1.515E+03 47 -1 0.70 0.50 ag i d9 5s6h ag i d9 5s8h -1.797E+02 ( 6h//r2// 8h)= 3.018E+02 a0 -0.1712 3.263E+02 0.000 0.000 sqrtdel= 1.0000 3.018E+02 47 -1 0.70 0.50 ag i d9 5s6h ag i d9 5s9h -7.432E+01 ( 6h//r2// 9h)= 1.248E+02 a0 -0.0916 5.579E+01 0.000 0.000 sqrtdel= 1.0000 1.248E+02 47 -1 0.70 0.50 ag i d9 5s6h ag i d10 8k 0.000E+00 ( //r2// )= 0.000E+00 a0 0.0000 0.000E+00 0.000 0.000 sqrtdel= 1.0000 0.000E+00 47 -1 0.70 0.50 ag i d9 5s6h ag i d10 9k 0.000E+00 ( //r2// )= 0.000E+00 a0 0.0000 0.000E+00 0.000 0.000 sqrtdel= 1.0000 0.000E+00 47 -1 0.70 0.50 ag i d9 5s6h ag i d9 5s8k 1.579E+03 ( 6h//r2// 8k)= 3.475E+03 a0 1.0000 1.278E+04 0.560 1.000 sqrtdel= 1.0000 3.475E+03 47 -1 0.70 0.50 ag i d9 5s6h ag i d9 5s9k 7.521E+02 ( 6h//r2// 9k)= 1.656E+03 a0 0.7049 2.901E+03 0.403 0.909 sqrtdel= 1.0000 1.656E+03 47 -1 0.70 0.50 ag i d9 5s7h ag i d10 5p 0.000E+00 ( //r2// )= 0.000E+00 a0 0.0000 0.000E+00 0.000 0.000 sqrtdel= 1.0000 0.000E+00 47 -1 0.70 0.50 ag i d9 5s7h ag i d10 6p 0.000E+00 ( //r2// )= 0.000E+00 a0 0.0000 0.000E+00 0.000 0.000 sqrtdel= 1.0000 0.000E+00 47 -1 0.70 0.50 ag i d9 5s7h ag i d10 7p 0.000E+00 ( //r2// )= 0.000E+00 a0 0.0000 0.000E+00 0.000 0.000 sqrtdel= 1.0000 0.000E+00 47 -1 0.70 0.50 ag i d9 5s7h ag i d10 8p 0.000E+00 ( //r2// )= 0.000E+00 a0 0.0000 0.000E+00 0.000 0.000 sqrtdel= 1.0000 0.000E+00 47 -1 0.70 0.50 ag i d9 5s7h ag i d10 9p 0.000E+00 ( //r2// )= 0.000E+00 a0 0.0000 0.000E+00 0.000 0.000 sqrtdel= 1.0000 0.000E+00 47 -1 0.70 0.50 ag i d9 5s7h ag i d9 5s5p 0.000E+00 ( //r2// )= 0.000E+00 a0 0.0000 0.000E+00 0.000 0.000 sqrtdel= 1.0000 0.000E+00 47 -1 0.70 0.50 ag i d9 5s7h ag i d9 5s6p 0.000E+00 ( //r2// )= 0.000E+00 a0 0.0000 0.000E+00 0.000 0.000 sqrtdel= 1.0000 0.000E+00 47 -1 0.70 0.50 ag i d9 5s7h ag i d9 5s7p 0.000E+00 ( //r2// )= 0.000E+00 a0 0.0000 0.000E+00 0.000 0.000 sqrtdel= 1.0000 0.000E+00 47 -1 0.70 0.50 ag i d9 5s7h ag i d9 5s8p 0.000E+00 ( //r2// )= 0.000E+00 a0 0.0000 0.000E+00 0.000 0.000 sqrtdel= 1.0000 0.000E+00 47 -1 0.70 0.50 ag i d9 5s7h ag i d9 5s9p 0.000E+00 ( //r2// )= 0.000E+00 a0 0.0000 0.000E+00 0.000 0.000 sqrtdel= 1.0000 0.000E+00 47 -1 0.70 0.50 ag i d9 5s7h ag i d8 5s2 5p 0.000E+00 ( //r2// )= 0.000E+00 a0 0.0000 0.000E+00 0.000 0.000 sqrtdel= 1.0000 0.000E+00 47 -1 0.70 0.50 ag i d9 5s7h ag i d10 4f 0.000E+00 ( //r2// )= 0.000E+00 a0 0.0000 0.000E+00 0.000 0.000 sqrtdel= 1.0000 0.000E+00 47 -1 0.70 0.50 ag i d9 5s7h ag i d10 5f 0.000E+00 ( //r2// )= 0.000E+00 a0 0.0000 0.000E+00 0.000 0.000 sqrtdel= 1.0000 0.000E+00 47 -1 0.70 0.50 ag i d9 5s7h ag i d10 6f 0.000E+00 ( //r2// )= 0.000E+00 a0 0.0000 0.000E+00 0.000 0.000 sqrtdel= 1.0000 0.000E+00 47 -1 0.70 0.50 ag i d9 5s7h ag i d10 7f 0.000E+00 ( //r2// )= 0.000E+00 a0 0.0000 0.000E+00 0.000 0.000 sqrtdel= 1.0000 0.000E+00 47 -1 0.70 0.50 ag i d9 5s7h ag i d10 8f 0.000E+00 ( //r2// )= 0.000E+00 a0 0.0000 0.000E+00 0.000 0.000 sqrtdel= 1.0000 0.000E+00 47 -1 0.70 0.50 ag i d9 5s7h ag i d10 9f 0.000E+00 ( //r2// )= 0.000E+00 a0 0.0000 0.000E+00 0.000 0.000 sqrtdel= 1.0000 0.000E+00 47 -1 0.70 0.50 ag i d9 5s7h ag i d9 5s4f 1.790E+02 ( 7h//r2// 4f)= 3.267E+02 a0 0.8187 3.235E+02 0.329 0.957 sqrtdel= 1.0000 3.267E+02 47 -1 0.70 0.50 ag i d9 5s7h ag i d9 5s5f 1.991E+02 ( 7h//r2// 5f)= 3.635E+02 a0 0.2417 4.005E+02-0.131-0.253 sqrtdel= 1.0000 3.635E+02 47 -1 0.70 0.50 ag i d9 5s7h ag i d9 5s6f -2.678E+03 ( 7h//r2// 6f)=-4.889E+03 a0 -0.9868 7.243E+04-0.793-0.940 sqrtdel= 1.0000 -4.889E+03 47 -1 0.70 0.50 ag i d9 5s7h ag i d9 5s7f 3.460E+03 ( 7h//r2// 7f)= 6.317E+03 a0 0.8923 1.209E+05 0.494 0.602 sqrtdel= 1.0000 6.317E+03 47 -1 0.70 0.50 ag i d9 5s7h ag i d9 5s8f -6.608E+02 ( 7h//r2// 8f)=-1.206E+03 a0 -0.2163 4.411E+03 0.048 0.080 sqrtdel= 1.0000 -1.206E+03 47 -1 0.70 0.50 ag i d9 5s7h ag i d9 5s9f -1.546E+02 ( 7h//r2// 9f)=-2.823E+02 a0 -0.0680 2.415E+02 0.024 0.050 sqrtdel= 1.0000 -2.823E+02 47 -1 0.70 0.50 ag i d9 5s7h ag i d8 5s2 4f 0.000E+00 ( //r2// )= 0.000E+00 a0 0.0000 0.000E+00 0.000 0.000 sqrtdel= 1.0000 0.000E+00 47 -1 0.70 0.50 ag i d9 5s7h ag i d10 6h 0.000E+00 ( //r2// )= 0.000E+00 a0 0.0000 0.000E+00 0.000 0.000 sqrtdel= 1.0000 0.000E+00 47 -1 0.70 0.50 ag i d9 5s7h ag i d10 7h -3.165E+00 ( 5s//r2// 4d)=-3.165E+00 a0 -0.9614 6.679E-01-0.449-0.676 sqrtdel= 1.0000 -3.165E+00 47 -1 0.70 0.50 ag i d9 5s7h ag i d10 8h 0.000E+00 ( //r2// )= 0.000E+00 a0 0.0000 0.000E+00 0.000 0.000 sqrtdel= 1.0000 0.000E+00 47 -1 0.70 0.50 ag i d9 5s7h ag i d10 9h 0.000E+00 ( //r2// )= 0.000E+00 a0 0.0000 0.000E+00 0.000 0.000 sqrtdel= 1.0000 0.000E+00 47 -1 0.70 0.50 ag i d9 5s7h ag i d9 5s6h -9.019E+02 ( 7h//r2// 6h)= 1.515E+03 a0 -0.5963 8.216E+03 0.000 0.000 sqrtdel= 1.0000 1.515E+03 47 -1 0.70 0.50 ag i d9 5s7h ag i d9 5s7h 3.822E+03 ( 7h//r2// 7h)=-6.419E+03 a0 1.0000 1.476E+05 1.000 1.000 sqrtdel= 1.0000 -6.419E+03 47 -1 0.70 0.50 ag i d9 5s7h ag i d9 5s8h -2.002E+03 ( 7h//r2// 8h)= 3.363E+03 a0 -0.5844 4.050E+04 0.000 0.000 sqrtdel= 1.0000 3.363E+03 47 -1 0.70 0.50 ag i d9 5s7h ag i d9 5s9h -4.230E+02 ( 7h//r2// 9h)= 7.104E+02 a0 -0.1723 1.807E+03 0.000 0.000 sqrtdel= 1.0000 7.104E+02 47 -1 0.70 0.50 ag i d9 5s7h ag i d10 8k 0.000E+00 ( //r2// )= 0.000E+00 a0 0.0000 0.000E+00 0.000 0.000 sqrtdel= 1.0000 0.000E+00 47 -1 0.70 0.50 ag i d9 5s7h ag i d10 9k 0.000E+00 ( //r2// )= 0.000E+00 a0 0.0000 0.000E+00 0.000 0.000 sqrtdel= 1.0000 0.000E+00 47 -1 0.70 0.50 ag i d9 5s7h ag i d9 5s8k -4.041E+03 ( 7h//r2// 8k)=-8.895E+03 a0 -0.9720 8.373E+04-0.788-0.880 sqrtdel= 1.0000 -8.895E+03 47 -1 0.70 0.50 ag i d9 5s7h ag i d9 5s9k 1.230E+03 ( 7h//r2// 9k)= 2.708E+03 a0 0.4169 7.758E+03 0.028 0.051 sqrtdel= 1.0000 2.708E+03 47 -1 0.70 0.50 ag i d9 5s8h ag i d10 5p 0.000E+00 ( //r2// )= 0.000E+00 a0 0.0000 0.000E+00 0.000 0.000 sqrtdel= 1.0000 0.000E+00 47 -1 0.70 0.50 ag i d9 5s8h ag i d10 6p 0.000E+00 ( //r2// )= 0.000E+00 a0 0.0000 0.000E+00 0.000 0.000 sqrtdel= 1.0000 0.000E+00 47 -1 0.70 0.50 ag i d9 5s8h ag i d10 7p 0.000E+00 ( //r2// )= 0.000E+00 a0 0.0000 0.000E+00 0.000 0.000 sqrtdel= 1.0000 0.000E+00 47 -1 0.70 0.50 ag i d9 5s8h ag i d10 8p 0.000E+00 ( //r2// )= 0.000E+00 a0 0.0000 0.000E+00 0.000 0.000 sqrtdel= 1.0000 0.000E+00 47 -1 0.70 0.50 ag i d9 5s8h ag i d10 9p 0.000E+00 ( //r2// )= 0.000E+00 a0 0.0000 0.000E+00 0.000 0.000 sqrtdel= 1.0000 0.000E+00 47 -1 0.70 0.50 ag i d9 5s8h ag i d9 5s5p 0.000E+00 ( //r2// )= 0.000E+00 a0 0.0000 0.000E+00 0.000 0.000 sqrtdel= 1.0000 0.000E+00 47 -1 0.70 0.50 ag i d9 5s8h ag i d9 5s6p 0.000E+00 ( //r2// )= 0.000E+00 a0 0.0000 0.000E+00 0.000 0.000 sqrtdel= 1.0000 0.000E+00 47 -1 0.70 0.50 ag i d9 5s8h ag i d9 5s7p 0.000E+00 ( //r2// )= 0.000E+00 a0 0.0000 0.000E+00 0.000 0.000 sqrtdel= 1.0000 0.000E+00 47 -1 0.70 0.50 ag i d9 5s8h ag i d9 5s8p 0.000E+00 ( //r2// )= 0.000E+00 a0 0.0000 0.000E+00 0.000 0.000 sqrtdel= 1.0000 0.000E+00 47 -1 0.70 0.50 ag i d9 5s8h ag i d9 5s9p 0.000E+00 ( //r2// )= 0.000E+00 a0 0.0000 0.000E+00 0.000 0.000 sqrtdel= 1.0000 0.000E+00 47 -1 0.70 0.50 ag i d9 5s8h ag i d8 5s2 5p 0.000E+00 ( //r2// )= 0.000E+00 a0 0.0000 0.000E+00 0.000 0.000 sqrtdel= 1.0000 0.000E+00 47 -1 0.70 0.50 ag i d9 5s8h ag i d10 4f 0.000E+00 ( //r2// )= 0.000E+00 a0 0.0000 0.000E+00 0.000 0.000 sqrtdel= 1.0000 0.000E+00 47 -1 0.70 0.50 ag i d9 5s8h ag i d10 5f 0.000E+00 ( //r2// )= 0.000E+00 a0 0.0000 0.000E+00 0.000 0.000 sqrtdel= 1.0000 0.000E+00 47 -1 0.70 0.50 ag i d9 5s8h ag i d10 6f 0.000E+00 ( //r2// )= 0.000E+00 a0 0.0000 0.000E+00 0.000 0.000 sqrtdel= 1.0000 0.000E+00 47 -1 0.70 0.50 ag i d9 5s8h ag i d10 7f 0.000E+00 ( //r2// )= 0.000E+00 a0 0.0000 0.000E+00 0.000 0.000 sqrtdel= 1.0000 0.000E+00 47 -1 0.70 0.50 ag i d9 5s8h ag i d10 8f 0.000E+00 ( //r2// )= 0.000E+00 a0 0.0000 0.000E+00 0.000 0.000 sqrtdel= 1.0000 0.000E+00 47 -1 0.70 0.50 ag i d9 5s8h ag i d10 9f 0.000E+00 ( //r2// )= 0.000E+00 a0 0.0000 0.000E+00 0.000 0.000 sqrtdel= 1.0000 0.000E+00 47 -1 0.70 0.50 ag i d9 5s8h ag i d9 5s4f 1.147E+02 ( 8h//r2// 4f)= 2.093E+02 a0 0.6881 1.328E+02 0.254 0.913 sqrtdel= 1.0000 2.093E+02 47 -1 0.70 0.50 ag i d9 5s8h ag i d9 5s5f 1.848E+02 ( 8h//r2// 5f)= 3.374E+02 a0 0.3143 3.449E+02 0.000-0.001 sqrtdel= 1.0000 3.374E+02 47 -1 0.70 0.50 ag i d9 5s8h ag i d9 5s6f -3.418E+01 ( 8h//r2// 6f)=-6.240E+01 a0 -0.0183 1.180E+01-0.291-0.498 sqrtdel= 1.0000 -6.240E+01 47 -1 0.70 0.50 ag i d9 5s8h ag i d9 5s7f -4.731E+03 ( 8h//r2// 7f)=-8.638E+03 a0 -0.9495 2.261E+05-0.699-0.884 sqrtdel= 1.0000 -8.638E+03 47 -1 0.70 0.50 ag i d9 5s8h ag i d9 5s8f 6.949E+03 ( 8h//r2// 8f)= 1.269E+04 a0 0.9354 4.878E+05 0.598 0.706 sqrtdel= 1.0000 1.269E+04 47 -1 0.70 0.50 ag i d9 5s8h ag i d9 5s9f -1.446E+03 ( 8h//r2// 9f)=-2.639E+03 a0 -0.2396 2.111E+04 0.059 0.091 sqrtdel= 1.0000 -2.639E+03 47 -1 0.70 0.50 ag i d9 5s8h ag i d8 5s2 4f 0.000E+00 ( //r2// )= 0.000E+00 a0 0.0000 0.000E+00 0.000 0.000 sqrtdel= 1.0000 0.000E+00 47 -1 0.70 0.50 ag i d9 5s8h ag i d10 6h 0.000E+00 ( //r2// )= 0.000E+00 a0 0.0000 0.000E+00 0.000 0.000 sqrtdel= 1.0000 0.000E+00 47 -1 0.70 0.50 ag i d9 5s8h ag i d10 7h 0.000E+00 ( //r2// )= 0.000E+00 a0 0.0000 0.000E+00 0.000 0.000 sqrtdel= 1.0000 0.000E+00 47 -1 0.70 0.50 ag i d9 5s8h ag i d10 8h -3.165E+00 ( 5s//r2// 4d)=-3.165E+00 a0 -0.9614 6.679E-01-0.449-0.676 sqrtdel= 1.0000 -3.165E+00 47 -1 0.70 0.50 ag i d9 5s8h ag i d10 9h 0.000E+00 ( //r2// )= 0.000E+00 a0 0.0000 0.000E+00 0.000 0.000 sqrtdel= 1.0000 0.000E+00 47 -1 0.70 0.50 ag i d9 5s8h ag i d9 5s6h -1.797E+02 ( 8h//r2// 6h)= 3.018E+02 a0 -0.1712 3.263E+02 0.000 0.000 sqrtdel= 1.0000 3.018E+02 47 -1 0.70 0.50 ag i d9 5s8h ag i d9 5s7h -2.002E+03 ( 8h//r2// 7h)= 3.363E+03 a0 -0.5844 4.050E+04 0.000 0.000 sqrtdel= 1.0000 3.363E+03 47 -1 0.70 0.50 ag i d9 5s8h ag i d9 5s8h 7.392E+03 ( 8h//r2// 8h)=-1.241E+04 a0 1.0000 5.519E+05 1.000 1.000 sqrtdel= 1.0000 -1.241E+04 47 -1 0.70 0.50 ag i d9 5s8h ag i d9 5s9h -3.659E+03 ( 8h//r2// 9h)= 6.146E+03 a0 -0.5631 1.353E+05 0.000 0.000 sqrtdel= 1.0000 6.146E+03 47 -1 0.70 0.50 ag i d9 5s8h ag i d10 8k 0.000E+00 ( //r2// )= 0.000E+00 a0 0.0000 0.000E+00 0.000 0.000 sqrtdel= 1.0000 0.000E+00 47 -1 0.70 0.50 ag i d9 5s8h ag i d10 9k 0.000E+00 ( //r2// )= 0.000E+00 a0 0.0000 0.000E+00 0.000 0.000 sqrtdel= 1.0000 0.000E+00 47 -1 0.70 0.50 ag i d9 5s8h ag i d9 5s8k 3.279E+03 ( 8h//r2// 8k)= 7.218E+03 a0 0.7010 5.514E+04 0.256 0.341 sqrtdel= 1.0000 7.218E+03 47 -1 0.70 0.50 ag i d9 5s8h ag i d9 5s9k -7.703E+03 ( 8h//r2// 9k)=-1.696E+04 a0 -0.9905 3.043E+05-0.828-0.929 sqrtdel= 1.0000 -1.696E+04 47 -1 0.70 0.50 ag i d9 5s9h ag i d10 5p 0.000E+00 ( //r2// )= 0.000E+00 a0 0.0000 0.000E+00 0.000 0.000 sqrtdel= 1.0000 0.000E+00 47 -1 0.70 0.50 ag i d9 5s9h ag i d10 6p 0.000E+00 ( //r2// )= 0.000E+00 a0 0.0000 0.000E+00 0.000 0.000 sqrtdel= 1.0000 0.000E+00 47 -1 0.70 0.50 ag i d9 5s9h ag i d10 7p 0.000E+00 ( //r2// )= 0.000E+00 a0 0.0000 0.000E+00 0.000 0.000 sqrtdel= 1.0000 0.000E+00 47 -1 0.70 0.50 ag i d9 5s9h ag i d10 8p 0.000E+00 ( //r2// )= 0.000E+00 a0 0.0000 0.000E+00 0.000 0.000 sqrtdel= 1.0000 0.000E+00 47 -1 0.70 0.50 ag i d9 5s9h ag i d10 9p 0.000E+00 ( //r2// )= 0.000E+00 a0 0.0000 0.000E+00 0.000 0.000 sqrtdel= 1.0000 0.000E+00 47 -1 0.70 0.50 ag i d9 5s9h ag i d9 5s5p 0.000E+00 ( //r2// )= 0.000E+00 a0 0.0000 0.000E+00 0.000 0.000 sqrtdel= 1.0000 0.000E+00 47 -1 0.70 0.50 ag i d9 5s9h ag i d9 5s6p 0.000E+00 ( //r2// )= 0.000E+00 a0 0.0000 0.000E+00 0.000 0.000 sqrtdel= 1.0000 0.000E+00 47 -1 0.70 0.50 ag i d9 5s9h ag i d9 5s7p 0.000E+00 ( //r2// )= 0.000E+00 a0 0.0000 0.000E+00 0.000 0.000 sqrtdel= 1.0000 0.000E+00 47 -1 0.70 0.50 ag i d9 5s9h ag i d9 5s8p 0.000E+00 ( //r2// )= 0.000E+00 a0 0.0000 0.000E+00 0.000 0.000 sqrtdel= 1.0000 0.000E+00 47 -1 0.70 0.50 ag i d9 5s9h ag i d9 5s9p 0.000E+00 ( //r2// )= 0.000E+00 a0 0.0000 0.000E+00 0.000 0.000 sqrtdel= 1.0000 0.000E+00 47 -1 0.70 0.50 ag i d9 5s9h ag i d8 5s2 5p 0.000E+00 ( //r2// )= 0.000E+00 a0 0.0000 0.000E+00 0.000 0.000 sqrtdel= 1.0000 0.000E+00 47 -1 0.70 0.50 ag i d9 5s9h ag i d10 4f 0.000E+00 ( //r2// )= 0.000E+00 a0 0.0000 0.000E+00 0.000 0.000 sqrtdel= 1.0000 0.000E+00 47 -1 0.70 0.50 ag i d9 5s9h ag i d10 5f 0.000E+00 ( //r2// )= 0.000E+00 a0 0.0000 0.000E+00 0.000 0.000 sqrtdel= 1.0000 0.000E+00 47 -1 0.70 0.50 ag i d9 5s9h ag i d10 6f 0.000E+00 ( //r2// )= 0.000E+00 a0 0.0000 0.000E+00 0.000 0.000 sqrtdel= 1.0000 0.000E+00 47 -1 0.70 0.50 ag i d9 5s9h ag i d10 7f 0.000E+00 ( //r2// )= 0.000E+00 a0 0.0000 0.000E+00 0.000 0.000 sqrtdel= 1.0000 0.000E+00 47 -1 0.70 0.50 ag i d9 5s9h ag i d10 8f 0.000E+00 ( //r2// )= 0.000E+00 a0 0.0000 0.000E+00 0.000 0.000 sqrtdel= 1.0000 0.000E+00 47 -1 0.70 0.50 ag i d9 5s9h ag i d10 9f 0.000E+00 ( //r2// )= 0.000E+00 a0 0.0000 0.000E+00 0.000 0.000 sqrtdel= 1.0000 0.000E+00 47 -1 0.70 0.50 ag i d9 5s9h ag i d9 5s4f 8.179E+01 ( 9h//r2// 4f)= 1.493E+02 a0 0.6096 6.757E+01 0.203 0.881 sqrtdel= 1.0000 1.493E+02 47 -1 0.70 0.50 ag i d9 5s9h ag i d9 5s5f 1.405E+02 ( 9h//r2// 5f)= 2.565E+02 a0 0.3019 1.994E+02 0.035 0.115 sqrtdel= 1.0000 2.565E+02 47 -1 0.70 0.50 ag i d9 5s9h ag i d9 5s6f 1.300E+02 ( 9h//r2// 6f)= 2.374E+02 a0 0.0937 1.708E+02-0.140-0.311 sqrtdel= 1.0000 2.374E+02 47 -1 0.70 0.50 ag i d9 5s9h ag i d9 5s7f -4.033E+02 ( 9h//r2// 7f)=-7.364E+02 a0 -0.1117 1.643E+03-0.327-0.547 sqrtdel= 1.0000 -7.364E+02 47 -1 0.70 0.50 ag i d9 5s9h ag i d9 5s8f -7.612E+03 ( 9h//r2// 8f)=-1.390E+04 a0 -0.9025 5.852E+05-0.610-0.804 sqrtdel= 1.0000 -1.390E+04 47 -1 0.70 0.50 ag i d9 5s9h ag i d9 5s9f 1.226E+04 ( 9h//r2// 9f)= 2.239E+04 a0 0.9576 1.519E+06 0.672 0.776 sqrtdel= 1.0000 2.239E+04 47 -1 0.70 0.50 ag i d9 5s9h ag i d8 5s2 4f 0.000E+00 ( //r2// )= 0.000E+00 a0 0.0000 0.000E+00 0.000 0.000 sqrtdel= 1.0000 0.000E+00 47 -1 0.70 0.50 ag i d9 5s9h ag i d10 6h 0.000E+00 ( //r2// )= 0.000E+00 a0 0.0000 0.000E+00 0.000 0.000 sqrtdel= 1.0000 0.000E+00 47 -1 0.70 0.50 ag i d9 5s9h ag i d10 7h 0.000E+00 ( //r2// )= 0.000E+00 a0 0.0000 0.000E+00 0.000 0.000 sqrtdel= 1.0000 0.000E+00 47 -1 0.70 0.50 ag i d9 5s9h ag i d10 8h 0.000E+00 ( //r2// )= 0.000E+00 a0 0.0000 0.000E+00 0.000 0.000 sqrtdel= 1.0000 0.000E+00 47 -1 0.70 0.50 ag i d9 5s9h ag i d10 9h -3.165E+00 ( 5s//r2// 4d)=-3.165E+00 a0 -0.9614 6.679E-01-0.449-0.676 sqrtdel= 1.0000 -3.165E+00 47 -1 0.70 0.50 ag i d9 5s9h ag i d9 5s6h -7.432E+01 ( 9h//r2// 6h)= 1.248E+02 a0 -0.0916 5.579E+01 0.000 0.000 sqrtdel= 1.0000 1.248E+02 47 -1 0.70 0.50 ag i d9 5s9h ag i d9 5s7h -4.230E+02 ( 9h//r2// 7h)= 7.104E+02 a0 -0.1723 1.807E+03 0.000 0.000 sqrtdel= 1.0000 7.104E+02 47 -1 0.70 0.50 ag i d9 5s9h ag i d9 5s8h -3.659E+03 ( 9h//r2// 8h)= 6.146E+03 a0 -0.5631 1.353E+05 0.000 0.000 sqrtdel= 1.0000 6.146E+03 47 -1 0.70 0.50 ag i d9 5s9h ag i d9 5s9h 1.280E+04 ( 9h//r2// 9h)=-2.149E+04 a0 1.0000 1.654E+06 1.000 1.000 sqrtdel= 1.0000 -2.149E+04 47 -1 0.70 0.50 ag i d9 5s9h ag i d10 8k 0.000E+00 ( //r2// )= 0.000E+00 a0 0.0000 0.000E+00 0.000 0.000 sqrtdel= 1.0000 0.000E+00 47 -1 0.70 0.50 ag i d9 5s9h ag i d10 9k 0.000E+00 ( //r2// )= 0.000E+00 a0 0.0000 0.000E+00 0.000 0.000 sqrtdel= 1.0000 0.000E+00 47 -1 0.70 0.50 ag i d9 5s9h ag i d9 5s8k -4.308E+02 ( 9h//r2// 8k)=-9.485E+02 a0 -0.1192 9.519E+02 0.022 0.039 sqrtdel= 1.0000 -9.485E+02 47 -1 0.70 0.50 ag i d9 5s9h ag i d9 5s9k 7.684E+03 ( 9h//r2// 9k)= 1.692E+04 a0 0.8181 3.028E+05 0.387 0.484 sqrtdel= 1.0000 1.692E+04 47 -1 0.70 0.50 ag i d10 8k ag i d10 5p 0.000E+00 ( //r2// )= 0.000E+00 a0 0.0000 0.000E+00 0.000 0.000 sqrtdel= 1.0000 0.000E+00 47 -1 0.70 0.50 ag i d10 8k ag i d10 6p 0.000E+00 ( //r2// )= 0.000E+00 a0 0.0000 0.000E+00 0.000 0.000 sqrtdel= 1.0000 0.000E+00 47 -1 0.70 0.50 ag i d10 8k ag i d10 7p 0.000E+00 ( //r2// )= 0.000E+00 a0 0.0000 0.000E+00 0.000 0.000 sqrtdel= 1.0000 0.000E+00 47 -1 0.70 0.50 ag i d10 8k ag i d10 8p 0.000E+00 ( //r2// )= 0.000E+00 a0 0.0000 0.000E+00 0.000 0.000 sqrtdel= 1.0000 0.000E+00 47 -1 0.70 0.50 ag i d10 8k ag i d10 9p 0.000E+00 ( //r2// )= 0.000E+00 a0 0.0000 0.000E+00 0.000 0.000 sqrtdel= 1.0000 0.000E+00 47 -1 0.70 0.50 ag i d10 8k ag i d9 5s5p 0.000E+00 ( //r2// )= 0.000E+00 a0 0.0000 0.000E+00 0.000 0.000 sqrtdel= 1.0000 0.000E+00 47 -1 0.70 0.50 ag i d10 8k ag i d9 5s6p 0.000E+00 ( //r2// )= 0.000E+00 a0 0.0000 0.000E+00 0.000 0.000 sqrtdel= 1.0000 0.000E+00 47 -1 0.70 0.50 ag i d10 8k ag i d9 5s7p 0.000E+00 ( //r2// )= 0.000E+00 a0 0.0000 0.000E+00 0.000 0.000 sqrtdel= 1.0000 0.000E+00 47 -1 0.70 0.50 ag i d10 8k ag i d9 5s8p 0.000E+00 ( //r2// )= 0.000E+00 a0 0.0000 0.000E+00 0.000 0.000 sqrtdel= 1.0000 0.000E+00 47 -1 0.70 0.50 ag i d10 8k ag i d9 5s9p 0.000E+00 ( //r2// )= 0.000E+00 a0 0.0000 0.000E+00 0.000 0.000 sqrtdel= 1.0000 0.000E+00 47 -1 0.70 0.50 ag i d10 8k ag i d8 5s2 5p 0.000E+00 ( //r2// )= 0.000E+00 a0 0.0000 0.000E+00 0.000 0.000 sqrtdel= 1.0000 0.000E+00 47 -1 0.70 0.50 ag i d10 8k ag i d10 4f 0.000E+00 ( //r2// )= 0.000E+00 a0 0.0000 0.000E+00 0.000 0.000 sqrtdel= 1.0000 0.000E+00 47 -1 0.70 0.50 ag i d10 8k ag i d10 5f 0.000E+00 ( //r2// )= 0.000E+00 a0 0.0000 0.000E+00 0.000 0.000 sqrtdel= 1.0000 0.000E+00 47 -1 0.70 0.50 ag i d10 8k ag i d10 6f 0.000E+00 ( //r2// )= 0.000E+00 a0 0.0000 0.000E+00 0.000 0.000 sqrtdel= 1.0000 0.000E+00 47 -1 0.70 0.50 ag i d10 8k ag i d10 7f 0.000E+00 ( //r2// )= 0.000E+00 a0 0.0000 0.000E+00 0.000 0.000 sqrtdel= 1.0000 0.000E+00 47 -1 0.70 0.50 ag i d10 8k ag i d10 8f 0.000E+00 ( //r2// )= 0.000E+00 a0 0.0000 0.000E+00 0.000 0.000 sqrtdel= 1.0000 0.000E+00 47 -1 0.70 0.50 ag i d10 8k ag i d10 9f 0.000E+00 ( //r2// )= 0.000E+00 a0 0.0000 0.000E+00 0.000 0.000 sqrtdel= 1.0000 0.000E+00 47 -1 0.70 0.50 ag i d10 8k ag i d9 5s4f 0.000E+00 ( //r2// )= 0.000E+00 a0 0.0000 0.000E+00 0.000 0.000 sqrtdel= 1.0000 0.000E+00 47 -1 0.70 0.50 ag i d10 8k ag i d9 5s5f 0.000E+00 ( //r2// )= 0.000E+00 a0 0.0000 0.000E+00 0.000 0.000 sqrtdel= 1.0000 0.000E+00 47 -1 0.70 0.50 ag i d10 8k ag i d9 5s6f 0.000E+00 ( //r2// )= 0.000E+00 a0 0.0000 0.000E+00 0.000 0.000 sqrtdel= 1.0000 0.000E+00 47 -1 0.70 0.50 ag i d10 8k ag i d9 5s7f 0.000E+00 ( //r2// )= 0.000E+00 a0 0.0000 0.000E+00 0.000 0.000 sqrtdel= 1.0000 0.000E+00 47 -1 0.70 0.50 ag i d10 8k ag i d9 5s8f 0.000E+00 ( //r2// )= 0.000E+00 a0 0.0000 0.000E+00 0.000 0.000 sqrtdel= 1.0000 0.000E+00 47 -1 0.70 0.50 ag i d10 8k ag i d9 5s9f 0.000E+00 ( //r2// )= 0.000E+00 a0 0.0000 0.000E+00 0.000 0.000 sqrtdel= 1.0000 0.000E+00 47 -1 0.70 0.50 ag i d10 8k ag i d8 5s2 4f 0.000E+00 ( //r2// )= 0.000E+00 a0 0.0000 0.000E+00 0.000 0.000 sqrtdel= 1.0000 0.000E+00 47 -1 0.70 0.50 ag i d10 8k ag i d10 6h 1.579E+03 ( 8k//r2// 6h)= 3.475E+03 a0 1.0000 1.278E+04 0.560 1.000 sqrtdel= 1.0000 3.475E+03 47 -1 0.70 0.50 ag i d10 8k ag i d10 7h -4.041E+03 ( 8k//r2// 7h)=-8.895E+03 a0 -0.9720 8.373E+04-0.788-0.880 sqrtdel= 1.0000 -8.895E+03 47 -1 0.70 0.50 ag i d10 8k ag i d10 8h 3.279E+03 ( 8k//r2// 8h)= 7.218E+03 a0 0.7010 5.514E+04 0.256 0.341 sqrtdel= 1.0000 7.218E+03 47 -1 0.70 0.50 ag i d10 8k ag i d10 9h -4.308E+02 ( 8k//r2// 9h)=-9.485E+02 a0 -0.1192 9.519E+02 0.022 0.039 sqrtdel= 1.0000 -9.485E+02 47 -1 0.70 0.50 ag i d10 8k ag i d9 5s6h 0.000E+00 ( //r2// )= 0.000E+00 a0 0.0000 0.000E+00 0.000 0.000 sqrtdel= 1.0000 0.000E+00 47 -1 0.70 0.50 ag i d10 8k ag i d9 5s7h 0.000E+00 ( //r2// )= 0.000E+00 a0 0.0000 0.000E+00 0.000 0.000 sqrtdel= 1.0000 0.000E+00 47 -1 0.70 0.50 ag i d10 8k ag i d9 5s8h 0.000E+00 ( //r2// )= 0.000E+00 a0 0.0000 0.000E+00 0.000 0.000 sqrtdel= 1.0000 0.000E+00 47 -1 0.70 0.50 ag i d10 8k ag i d9 5s9h 0.000E+00 ( //r2// )= 0.000E+00 a0 0.0000 0.000E+00 0.000 0.000 sqrtdel= 1.0000 0.000E+00 47 -1 0.70 0.50 ag i d10 8k ag i d10 8k 4.896E+03 ( 8k//r2// 8k)=-9.545E+03 a0 1.0000 1.229E+05 1.000 1.000 sqrtdel= 1.0000 -9.545E+03 47 -1 0.70 0.50 ag i d10 8k ag i d10 9k -2.365E+03 ( 8k//r2// 9k)= 4.610E+03 a0 -0.5388 2.867E+04 0.000 0.000 sqrtdel= 1.0000 4.610E+03 47 -1 0.70 0.50 ag i d10 8k ag i d9 5s8k -3.165E+00 ( 4d//r2// 5s)=-3.165E+00 a0 -0.9614 6.679E-01-0.449-0.676 sqrtdel= 1.0000 -3.165E+00 47 -1 0.70 0.50 ag i d10 8k ag i d9 5s9k 0.000E+00 ( //r2// )= 0.000E+00 a0 0.0000 0.000E+00 0.000 0.000 sqrtdel= 1.0000 0.000E+00 47 -1 0.70 0.50 ag i d10 9k ag i d10 5p 0.000E+00 ( //r2// )= 0.000E+00 a0 0.0000 0.000E+00 0.000 0.000 sqrtdel= 1.0000 0.000E+00 47 -1 0.70 0.50 ag i d10 9k ag i d10 6p 0.000E+00 ( //r2// )= 0.000E+00 a0 0.0000 0.000E+00 0.000 0.000 sqrtdel= 1.0000 0.000E+00 47 -1 0.70 0.50 ag i d10 9k ag i d10 7p 0.000E+00 ( //r2// )= 0.000E+00 a0 0.0000 0.000E+00 0.000 0.000 sqrtdel= 1.0000 0.000E+00 47 -1 0.70 0.50 ag i d10 9k ag i d10 8p 0.000E+00 ( //r2// )= 0.000E+00 a0 0.0000 0.000E+00 0.000 0.000 sqrtdel= 1.0000 0.000E+00 47 -1 0.70 0.50 ag i d10 9k ag i d10 9p 0.000E+00 ( //r2// )= 0.000E+00 a0 0.0000 0.000E+00 0.000 0.000 sqrtdel= 1.0000 0.000E+00 47 -1 0.70 0.50 ag i d10 9k ag i d9 5s5p 0.000E+00 ( //r2// )= 0.000E+00 a0 0.0000 0.000E+00 0.000 0.000 sqrtdel= 1.0000 0.000E+00 47 -1 0.70 0.50 ag i d10 9k ag i d9 5s6p 0.000E+00 ( //r2// )= 0.000E+00 a0 0.0000 0.000E+00 0.000 0.000 sqrtdel= 1.0000 0.000E+00 47 -1 0.70 0.50 ag i d10 9k ag i d9 5s7p 0.000E+00 ( //r2// )= 0.000E+00 a0 0.0000 0.000E+00 0.000 0.000 sqrtdel= 1.0000 0.000E+00 47 -1 0.70 0.50 ag i d10 9k ag i d9 5s8p 0.000E+00 ( //r2// )= 0.000E+00 a0 0.0000 0.000E+00 0.000 0.000 sqrtdel= 1.0000 0.000E+00 47 -1 0.70 0.50 ag i d10 9k ag i d9 5s9p 0.000E+00 ( //r2// )= 0.000E+00 a0 0.0000 0.000E+00 0.000 0.000 sqrtdel= 1.0000 0.000E+00 47 -1 0.70 0.50 ag i d10 9k ag i d8 5s2 5p 0.000E+00 ( //r2// )= 0.000E+00 a0 0.0000 0.000E+00 0.000 0.000 sqrtdel= 1.0000 0.000E+00 47 -1 0.70 0.50 ag i d10 9k ag i d10 4f 0.000E+00 ( //r2// )= 0.000E+00 a0 0.0000 0.000E+00 0.000 0.000 sqrtdel= 1.0000 0.000E+00 47 -1 0.70 0.50 ag i d10 9k ag i d10 5f 0.000E+00 ( //r2// )= 0.000E+00 a0 0.0000 0.000E+00 0.000 0.000 sqrtdel= 1.0000 0.000E+00 47 -1 0.70 0.50 ag i d10 9k ag i d10 6f 0.000E+00 ( //r2// )= 0.000E+00 a0 0.0000 0.000E+00 0.000 0.000 sqrtdel= 1.0000 0.000E+00 47 -1 0.70 0.50 ag i d10 9k ag i d10 7f 0.000E+00 ( //r2// )= 0.000E+00 a0 0.0000 0.000E+00 0.000 0.000 sqrtdel= 1.0000 0.000E+00 47 -1 0.70 0.50 ag i d10 9k ag i d10 8f 0.000E+00 ( //r2// )= 0.000E+00 a0 0.0000 0.000E+00 0.000 0.000 sqrtdel= 1.0000 0.000E+00 47 -1 0.70 0.50 ag i d10 9k ag i d10 9f 0.000E+00 ( //r2// )= 0.000E+00 a0 0.0000 0.000E+00 0.000 0.000 sqrtdel= 1.0000 0.000E+00 47 -1 0.70 0.50 ag i d10 9k ag i d9 5s4f 0.000E+00 ( //r2// )= 0.000E+00 a0 0.0000 0.000E+00 0.000 0.000 sqrtdel= 1.0000 0.000E+00 47 -1 0.70 0.50 ag i d10 9k ag i d9 5s5f 0.000E+00 ( //r2// )= 0.000E+00 a0 0.0000 0.000E+00 0.000 0.000 sqrtdel= 1.0000 0.000E+00 47 -1 0.70 0.50 ag i d10 9k ag i d9 5s6f 0.000E+00 ( //r2// )= 0.000E+00 a0 0.0000 0.000E+00 0.000 0.000 sqrtdel= 1.0000 0.000E+00 47 -1 0.70 0.50 ag i d10 9k ag i d9 5s7f 0.000E+00 ( //r2// )= 0.000E+00 a0 0.0000 0.000E+00 0.000 0.000 sqrtdel= 1.0000 0.000E+00 47 -1 0.70 0.50 ag i d10 9k ag i d9 5s8f 0.000E+00 ( //r2// )= 0.000E+00 a0 0.0000 0.000E+00 0.000 0.000 sqrtdel= 1.0000 0.000E+00 47 -1 0.70 0.50 ag i d10 9k ag i d9 5s9f 0.000E+00 ( //r2// )= 0.000E+00 a0 0.0000 0.000E+00 0.000 0.000 sqrtdel= 1.0000 0.000E+00 47 -1 0.70 0.50 ag i d10 9k ag i d8 5s2 4f 0.000E+00 ( //r2// )= 0.000E+00 a0 0.0000 0.000E+00 0.000 0.000 sqrtdel= 1.0000 0.000E+00 47 -1 0.70 0.50 ag i d10 9k ag i d10 6h 7.521E+02 ( 9k//r2// 6h)= 1.656E+03 a0 0.7049 2.901E+03 0.403 0.909 sqrtdel= 1.0000 1.656E+03 47 -1 0.70 0.50 ag i d10 9k ag i d10 7h 1.230E+03 ( 9k//r2// 7h)= 2.708E+03 a0 0.4169 7.758E+03 0.028 0.051 sqrtdel= 1.0000 2.708E+03 47 -1 0.70 0.50 ag i d10 9k ag i d10 8h -7.703E+03 ( 9k//r2// 8h)=-1.696E+04 a0 -0.9905 3.043E+05-0.828-0.929 sqrtdel= 1.0000 -1.696E+04 47 -1 0.70 0.50 ag i d10 9k ag i d10 9h 7.684E+03 ( 9k//r2// 9h)= 1.692E+04 a0 0.8181 3.028E+05 0.387 0.484 sqrtdel= 1.0000 1.692E+04 47 -1 0.70 0.50 ag i d10 9k ag i d9 5s6h 0.000E+00 ( //r2// )= 0.000E+00 a0 0.0000 0.000E+00 0.000 0.000 sqrtdel= 1.0000 0.000E+00 47 -1 0.70 0.50 ag i d10 9k ag i d9 5s7h 0.000E+00 ( //r2// )= 0.000E+00 a0 0.0000 0.000E+00 0.000 0.000 sqrtdel= 1.0000 0.000E+00 47 -1 0.70 0.50 ag i d10 9k ag i d9 5s8h 0.000E+00 ( //r2// )= 0.000E+00 a0 0.0000 0.000E+00 0.000 0.000 sqrtdel= 1.0000 0.000E+00 47 -1 0.70 0.50 ag i d10 9k ag i d9 5s9h 0.000E+00 ( //r2// )= 0.000E+00 a0 0.0000 0.000E+00 0.000 0.000 sqrtdel= 1.0000 0.000E+00 47 -1 0.70 0.50 ag i d10 9k ag i d10 8k -2.365E+03 ( 9k//r2// 8k)= 4.610E+03 a0 -0.5388 2.867E+04 0.000 0.000 sqrtdel= 1.0000 4.610E+03 47 -1 0.70 0.50 ag i d10 9k ag i d10 9k 9.639E+03 ( 9k//r2// 9k)=-1.879E+04 a0 1.0000 4.765E+05 1.000 1.000 sqrtdel= 1.0000 -1.879E+04 47 -1 0.70 0.50 ag i d10 9k ag i d9 5s8k 0.000E+00 ( //r2// )= 0.000E+00 a0 0.0000 0.000E+00 0.000 0.000 sqrtdel= 1.0000 0.000E+00 47 -1 0.70 0.50 ag i d10 9k ag i d9 5s9k -3.165E+00 ( 4d//r2// 5s)=-3.165E+00 a0 -0.9614 6.679E-01-0.449-0.676 sqrtdel= 1.0000 -3.165E+00 47 -1 0.70 0.50 ag i d9 5s8k ag i d10 5p 0.000E+00 ( //r2// )= 0.000E+00 a0 0.0000 0.000E+00 0.000 0.000 sqrtdel= 1.0000 0.000E+00 47 -1 0.70 0.50 ag i d9 5s8k ag i d10 6p 0.000E+00 ( //r2// )= 0.000E+00 a0 0.0000 0.000E+00 0.000 0.000 sqrtdel= 1.0000 0.000E+00 47 -1 0.70 0.50 ag i d9 5s8k ag i d10 7p 0.000E+00 ( //r2// )= 0.000E+00 a0 0.0000 0.000E+00 0.000 0.000 sqrtdel= 1.0000 0.000E+00 47 -1 0.70 0.50 ag i d9 5s8k ag i d10 8p 0.000E+00 ( //r2// )= 0.000E+00 a0 0.0000 0.000E+00 0.000 0.000 sqrtdel= 1.0000 0.000E+00 47 -1 0.70 0.50 ag i d9 5s8k ag i d10 9p 0.000E+00 ( //r2// )= 0.000E+00 a0 0.0000 0.000E+00 0.000 0.000 sqrtdel= 1.0000 0.000E+00 47 -1 0.70 0.50 ag i d9 5s8k ag i d9 5s5p 0.000E+00 ( //r2// )= 0.000E+00 a0 0.0000 0.000E+00 0.000 0.000 sqrtdel= 1.0000 0.000E+00 47 -1 0.70 0.50 ag i d9 5s8k ag i d9 5s6p 0.000E+00 ( //r2// )= 0.000E+00 a0 0.0000 0.000E+00 0.000 0.000 sqrtdel= 1.0000 0.000E+00 47 -1 0.70 0.50 ag i d9 5s8k ag i d9 5s7p 0.000E+00 ( //r2// )= 0.000E+00 a0 0.0000 0.000E+00 0.000 0.000 sqrtdel= 1.0000 0.000E+00 47 -1 0.70 0.50 ag i d9 5s8k ag i d9 5s8p 0.000E+00 ( //r2// )= 0.000E+00 a0 0.0000 0.000E+00 0.000 0.000 sqrtdel= 1.0000 0.000E+00 47 -1 0.70 0.50 ag i d9 5s8k ag i d9 5s9p 0.000E+00 ( //r2// )= 0.000E+00 a0 0.0000 0.000E+00 0.000 0.000 sqrtdel= 1.0000 0.000E+00 47 -1 0.70 0.50 ag i d9 5s8k ag i d8 5s2 5p 0.000E+00 ( //r2// )= 0.000E+00 a0 0.0000 0.000E+00 0.000 0.000 sqrtdel= 1.0000 0.000E+00 47 -1 0.70 0.50 ag i d9 5s8k ag i d10 4f 0.000E+00 ( //r2// )= 0.000E+00 a0 0.0000 0.000E+00 0.000 0.000 sqrtdel= 1.0000 0.000E+00 47 -1 0.70 0.50 ag i d9 5s8k ag i d10 5f 0.000E+00 ( //r2// )= 0.000E+00 a0 0.0000 0.000E+00 0.000 0.000 sqrtdel= 1.0000 0.000E+00 47 -1 0.70 0.50 ag i d9 5s8k ag i d10 6f 0.000E+00 ( //r2// )= 0.000E+00 a0 0.0000 0.000E+00 0.000 0.000 sqrtdel= 1.0000 0.000E+00 47 -1 0.70 0.50 ag i d9 5s8k ag i d10 7f 0.000E+00 ( //r2// )= 0.000E+00 a0 0.0000 0.000E+00 0.000 0.000 sqrtdel= 1.0000 0.000E+00 47 -1 0.70 0.50 ag i d9 5s8k ag i d10 8f 0.000E+00 ( //r2// )= 0.000E+00 a0 0.0000 0.000E+00 0.000 0.000 sqrtdel= 1.0000 0.000E+00 47 -1 0.70 0.50 ag i d9 5s8k ag i d10 9f 0.000E+00 ( //r2// )= 0.000E+00 a0 0.0000 0.000E+00 0.000 0.000 sqrtdel= 1.0000 0.000E+00 47 -1 0.70 0.50 ag i d9 5s8k ag i d9 5s4f 0.000E+00 ( //r2// )= 0.000E+00 a0 0.0000 0.000E+00 0.000 0.000 sqrtdel= 1.0000 0.000E+00 47 -1 0.70 0.50 ag i d9 5s8k ag i d9 5s5f 0.000E+00 ( //r2// )= 0.000E+00 a0 0.0000 0.000E+00 0.000 0.000 sqrtdel= 1.0000 0.000E+00 47 -1 0.70 0.50 ag i d9 5s8k ag i d9 5s6f 0.000E+00 ( //r2// )= 0.000E+00 a0 0.0000 0.000E+00 0.000 0.000 sqrtdel= 1.0000 0.000E+00 47 -1 0.70 0.50 ag i d9 5s8k ag i d9 5s7f 0.000E+00 ( //r2// )= 0.000E+00 a0 0.0000 0.000E+00 0.000 0.000 sqrtdel= 1.0000 0.000E+00 47 -1 0.70 0.50 ag i d9 5s8k ag i d9 5s8f 0.000E+00 ( //r2// )= 0.000E+00 a0 0.0000 0.000E+00 0.000 0.000 sqrtdel= 1.0000 0.000E+00 47 -1 0.70 0.50 ag i d9 5s8k ag i d9 5s9f 0.000E+00 ( //r2// )= 0.000E+00 a0 0.0000 0.000E+00 0.000 0.000 sqrtdel= 1.0000 0.000E+00 47 -1 0.70 0.50 ag i d9 5s8k ag i d8 5s2 4f 0.000E+00 ( //r2// )= 0.000E+00 a0 0.0000 0.000E+00 0.000 0.000 sqrtdel= 1.0000 0.000E+00 47 -1 0.70 0.50 ag i d9 5s8k ag i d10 6h 0.000E+00 ( //r2// )= 0.000E+00 a0 0.0000 0.000E+00 0.000 0.000 sqrtdel= 1.0000 0.000E+00 47 -1 0.70 0.50 ag i d9 5s8k ag i d10 7h 0.000E+00 ( //r2// )= 0.000E+00 a0 0.0000 0.000E+00 0.000 0.000 sqrtdel= 1.0000 0.000E+00 47 -1 0.70 0.50 ag i d9 5s8k ag i d10 8h 0.000E+00 ( //r2// )= 0.000E+00 a0 0.0000 0.000E+00 0.000 0.000 sqrtdel= 1.0000 0.000E+00 47 -1 0.70 0.50 ag i d9 5s8k ag i d10 9h 0.000E+00 ( //r2// )= 0.000E+00 a0 0.0000 0.000E+00 0.000 0.000 sqrtdel= 1.0000 0.000E+00 47 -1 0.70 0.50 ag i d9 5s8k ag i d9 5s6h 1.579E+03 ( 8k//r2// 6h)= 3.475E+03 a0 1.0000 1.278E+04 0.560 1.000 sqrtdel= 1.0000 3.475E+03 47 -1 0.70 0.50 ag i d9 5s8k ag i d9 5s7h -4.041E+03 ( 8k//r2// 7h)=-8.895E+03 a0 -0.9720 8.373E+04-0.788-0.880 sqrtdel= 1.0000 -8.895E+03 47 -1 0.70 0.50 ag i d9 5s8k ag i d9 5s8h 3.279E+03 ( 8k//r2// 8h)= 7.218E+03 a0 0.7010 5.514E+04 0.256 0.341 sqrtdel= 1.0000 7.218E+03 47 -1 0.70 0.50 ag i d9 5s8k ag i d9 5s9h -4.308E+02 ( 8k//r2// 9h)=-9.485E+02 a0 -0.1192 9.519E+02 0.022 0.039 sqrtdel= 1.0000 -9.485E+02 47 -1 0.70 0.50 ag i d9 5s8k ag i d10 8k -3.165E+00 ( 5s//r2// 4d)=-3.165E+00 a0 -0.9614 6.679E-01-0.449-0.676 sqrtdel= 1.0000 -3.165E+00 47 -1 0.70 0.50 ag i d9 5s8k ag i d10 9k 0.000E+00 ( //r2// )= 0.000E+00 a0 0.0000 0.000E+00 0.000 0.000 sqrtdel= 1.0000 0.000E+00 47 -1 0.70 0.50 ag i d9 5s8k ag i d9 5s8k 4.896E+03 ( 8k//r2// 8k)=-9.545E+03 a0 1.0000 1.229E+05 1.000 1.000 sqrtdel= 1.0000 -9.545E+03 47 -1 0.70 0.50 ag i d9 5s8k ag i d9 5s9k -2.365E+03 ( 8k//r2// 9k)= 4.610E+03 a0 -0.5388 2.867E+04 0.000 0.000 sqrtdel= 1.0000 4.610E+03 47 -1 0.70 0.50 ag i d9 5s9k ag i d10 5p 0.000E+00 ( //r2// )= 0.000E+00 a0 0.0000 0.000E+00 0.000 0.000 sqrtdel= 1.0000 0.000E+00 47 -1 0.70 0.50 ag i d9 5s9k ag i d10 6p 0.000E+00 ( //r2// )= 0.000E+00 a0 0.0000 0.000E+00 0.000 0.000 sqrtdel= 1.0000 0.000E+00 47 -1 0.70 0.50 ag i d9 5s9k ag i d10 7p 0.000E+00 ( //r2// )= 0.000E+00 a0 0.0000 0.000E+00 0.000 0.000 sqrtdel= 1.0000 0.000E+00 47 -1 0.70 0.50 ag i d9 5s9k ag i d10 8p 0.000E+00 ( //r2// )= 0.000E+00 a0 0.0000 0.000E+00 0.000 0.000 sqrtdel= 1.0000 0.000E+00 47 -1 0.70 0.50 ag i d9 5s9k ag i d10 9p 0.000E+00 ( //r2// )= 0.000E+00 a0 0.0000 0.000E+00 0.000 0.000 sqrtdel= 1.0000 0.000E+00 47 -1 0.70 0.50 ag i d9 5s9k ag i d9 5s5p 0.000E+00 ( //r2// )= 0.000E+00 a0 0.0000 0.000E+00 0.000 0.000 sqrtdel= 1.0000 0.000E+00 47 -1 0.70 0.50 ag i d9 5s9k ag i d9 5s6p 0.000E+00 ( //r2// )= 0.000E+00 a0 0.0000 0.000E+00 0.000 0.000 sqrtdel= 1.0000 0.000E+00 47 -1 0.70 0.50 ag i d9 5s9k ag i d9 5s7p 0.000E+00 ( //r2// )= 0.000E+00 a0 0.0000 0.000E+00 0.000 0.000 sqrtdel= 1.0000 0.000E+00 47 -1 0.70 0.50 ag i d9 5s9k ag i d9 5s8p 0.000E+00 ( //r2// )= 0.000E+00 a0 0.0000 0.000E+00 0.000 0.000 sqrtdel= 1.0000 0.000E+00 47 -1 0.70 0.50 ag i d9 5s9k ag i d9 5s9p 0.000E+00 ( //r2// )= 0.000E+00 a0 0.0000 0.000E+00 0.000 0.000 sqrtdel= 1.0000 0.000E+00 47 -1 0.70 0.50 ag i d9 5s9k ag i d8 5s2 5p 0.000E+00 ( //r2// )= 0.000E+00 a0 0.0000 0.000E+00 0.000 0.000 sqrtdel= 1.0000 0.000E+00 47 -1 0.70 0.50 ag i d9 5s9k ag i d10 4f 0.000E+00 ( //r2// )= 0.000E+00 a0 0.0000 0.000E+00 0.000 0.000 sqrtdel= 1.0000 0.000E+00 47 -1 0.70 0.50 ag i d9 5s9k ag i d10 5f 0.000E+00 ( //r2// )= 0.000E+00 a0 0.0000 0.000E+00 0.000 0.000 sqrtdel= 1.0000 0.000E+00 47 -1 0.70 0.50 ag i d9 5s9k ag i d10 6f 0.000E+00 ( //r2// )= 0.000E+00 a0 0.0000 0.000E+00 0.000 0.000 sqrtdel= 1.0000 0.000E+00 47 -1 0.70 0.50 ag i d9 5s9k ag i d10 7f 0.000E+00 ( //r2// )= 0.000E+00 a0 0.0000 0.000E+00 0.000 0.000 sqrtdel= 1.0000 0.000E+00 47 -1 0.70 0.50 ag i d9 5s9k ag i d10 8f 0.000E+00 ( //r2// )= 0.000E+00 a0 0.0000 0.000E+00 0.000 0.000 sqrtdel= 1.0000 0.000E+00 47 -1 0.70 0.50 ag i d9 5s9k ag i d10 9f 0.000E+00 ( //r2// )= 0.000E+00 a0 0.0000 0.000E+00 0.000 0.000 sqrtdel= 1.0000 0.000E+00 47 -1 0.70 0.50 ag i d9 5s9k ag i d9 5s4f 0.000E+00 ( //r2// )= 0.000E+00 a0 0.0000 0.000E+00 0.000 0.000 sqrtdel= 1.0000 0.000E+00 47 -1 0.70 0.50 ag i d9 5s9k ag i d9 5s5f 0.000E+00 ( //r2// )= 0.000E+00 a0 0.0000 0.000E+00 0.000 0.000 sqrtdel= 1.0000 0.000E+00 47 -1 0.70 0.50 ag i d9 5s9k ag i d9 5s6f 0.000E+00 ( //r2// )= 0.000E+00 a0 0.0000 0.000E+00 0.000 0.000 sqrtdel= 1.0000 0.000E+00 47 -1 0.70 0.50 ag i d9 5s9k ag i d9 5s7f 0.000E+00 ( //r2// )= 0.000E+00 a0 0.0000 0.000E+00 0.000 0.000 sqrtdel= 1.0000 0.000E+00 47 -1 0.70 0.50 ag i d9 5s9k ag i d9 5s8f 0.000E+00 ( //r2// )= 0.000E+00 a0 0.0000 0.000E+00 0.000 0.000 sqrtdel= 1.0000 0.000E+00 47 -1 0.70 0.50 ag i d9 5s9k ag i d9 5s9f 0.000E+00 ( //r2// )= 0.000E+00 a0 0.0000 0.000E+00 0.000 0.000 sqrtdel= 1.0000 0.000E+00 47 -1 0.70 0.50 ag i d9 5s9k ag i d8 5s2 4f 0.000E+00 ( //r2// )= 0.000E+00 a0 0.0000 0.000E+00 0.000 0.000 sqrtdel= 1.0000 0.000E+00 47 -1 0.70 0.50 ag i d9 5s9k ag i d10 6h 0.000E+00 ( //r2// )= 0.000E+00 a0 0.0000 0.000E+00 0.000 0.000 sqrtdel= 1.0000 0.000E+00 47 -1 0.70 0.50 ag i d9 5s9k ag i d10 7h 0.000E+00 ( //r2// )= 0.000E+00 a0 0.0000 0.000E+00 0.000 0.000 sqrtdel= 1.0000 0.000E+00 47 -1 0.70 0.50 ag i d9 5s9k ag i d10 8h 0.000E+00 ( //r2// )= 0.000E+00 a0 0.0000 0.000E+00 0.000 0.000 sqrtdel= 1.0000 0.000E+00 47 -1 0.70 0.50 ag i d9 5s9k ag i d10 9h 0.000E+00 ( //r2// )= 0.000E+00 a0 0.0000 0.000E+00 0.000 0.000 sqrtdel= 1.0000 0.000E+00 47 -1 0.70 0.50 ag i d9 5s9k ag i d9 5s6h 7.521E+02 ( 9k//r2// 6h)= 1.656E+03 a0 0.7049 2.901E+03 0.403 0.909 sqrtdel= 1.0000 1.656E+03 47 -1 0.70 0.50 ag i d9 5s9k ag i d9 5s7h 1.230E+03 ( 9k//r2// 7h)= 2.708E+03 a0 0.4169 7.758E+03 0.028 0.051 sqrtdel= 1.0000 2.708E+03 47 -1 0.70 0.50 ag i d9 5s9k ag i d9 5s8h -7.703E+03 ( 9k//r2// 8h)=-1.696E+04 a0 -0.9905 3.043E+05-0.828-0.929 sqrtdel= 1.0000 -1.696E+04 47 -1 0.70 0.50 ag i d9 5s9k ag i d9 5s9h 7.684E+03 ( 9k//r2// 9h)= 1.692E+04 a0 0.8181 3.028E+05 0.387 0.484 sqrtdel= 1.0000 1.692E+04 47 -1 0.70 0.50 ag i d9 5s9k ag i d10 8k 0.000E+00 ( //r2// )= 0.000E+00 a0 0.0000 0.000E+00 0.000 0.000 sqrtdel= 1.0000 0.000E+00 47 -1 0.70 0.50 ag i d9 5s9k ag i d10 9k -3.165E+00 ( 5s//r2// 4d)=-3.165E+00 a0 -0.9614 6.679E-01-0.449-0.676 sqrtdel= 1.0000 -3.165E+00 47 -1 0.70 0.50 ag i d9 5s9k ag i d9 5s8k -2.365E+03 ( 9k//r2// 8k)= 4.610E+03 a0 -0.5388 2.867E+04 0.000 0.000 sqrtdel= 1.0000 4.610E+03 47 -1 0.70 0.50 ag i d9 5s9k ag i d9 5s9k 9.639E+03 ( 9k//r2// 9k)=-1.879E+04 a0 1.0000 4.765E+05 1.000 1.000 sqrtdel= 1.0000 -1.879E+04 z kut ca1 ca0 conf1 conf2 r integral reduced mupole element frac sigma sq over fr1 --- --- ---- ---- ------------------- ------------------- ---------- ---------------------------- ------ --------- ----- ----- 47 -1 0.70 0.50 ag i d10 5s ag i d10 5p -3.356950 ( 5s//r1// 5p)= 3.35695 a0 -0.9998 3.756372-0.873-0.999 sqrtdel= 1.0000 3.35695 47 -1 0.70 0.50 ag i d10 5s ag i d10 6p -0.438313 ( 5s//r1// 6p)= 0.43831 a0 -0.3293 0.064040-0.232-0.690 sqrtdel= 1.0000 0.43831 47 -1 0.70 0.50 ag i d10 5s ag i d10 7p -0.182433 ( 5s//r1// 7p)= 0.18243 a0 -0.2267 0.011094-0.124-0.610 sqrtdel= 1.0000 0.18243 47 -1 0.70 0.50 ag i d10 5s ag i d10 8p -0.105304 ( 5s//r1// 8p)= 0.10530 a0 -0.1881 0.003696-0.082-0.577 sqrtdel= 1.0000 0.10530 47 -1 0.70 0.50 ag i d10 5s ag i d10 9p -0.070520 ( 5s//r1// 9p)= 0.07052 a0 -0.1680 0.001658-0.059-0.559 sqrtdel= 1.0000 0.07052 47 -1 0.70 0.50 ag i d10 5s ag i d9 5s5p 0.932490 ( 4d//r1// 5p)= 1.31874 a0 0.8711 0.057969 0.273 0.618 sqrtdel= 1.0000 1.31874 47 -1 0.70 0.50 ag i d10 5s ag i d9 5s6p 0.258041 ( 4d//r1// 6p)= 0.36492 a0 0.6981 0.004439 0.087 0.534 sqrtdel= 1.0000 0.36492 47 -1 0.70 0.50 ag i d10 5s ag i d9 5s7p 0.146259 ( 4d//r1// 7p)= 0.20684 a0 0.6526 0.001426 0.051 0.511 sqrtdel= 1.0000 0.20684 47 -1 0.70 0.50 ag i d10 5s ag i d9 5s8p 0.098879 ( 4d//r1// 8p)= 0.13984 a0 0.6333 0.000652 0.035 0.501 sqrtdel= 1.0000 0.13984 47 -1 0.70 0.50 ag i d10 5s ag i d9 5s9p 0.072968 ( 4d//r1// 9p)= 0.10319 a0 0.6230 0.000355 0.026 0.496 sqrtdel= 1.0000 0.10319 47 -1 0.70 0.50 ag i d10 5s ag i d8 5s2 5p 0.000000 ( //r1// )= 0.00000 a0 0.0000 0.000000 0.000 0.000 sqrtdel= 1.0000 0.00000 47 -1 0.70 0.50 ag i d10 5s ag i d10 4f 0.000000 ( //r1// )= 0.00000 a0 0.0000 0.000000 0.000 0.000 sqrtdel= 1.0000 0.00000 47 -1 0.70 0.50 ag i d10 5s ag i d10 5f 0.000000 ( //r1// )= 0.00000 a0 0.0000 0.000000 0.000 0.000 sqrtdel= 1.0000 0.00000 47 -1 0.70 0.50 ag i d10 5s ag i d10 6f 0.000000 ( //r1// )= 0.00000 a0 0.0000 0.000000 0.000 0.000 sqrtdel= 1.0000 0.00000 47 -1 0.70 0.50 ag i d10 5s ag i d10 7f 0.000000 ( //r1// )= 0.00000 a0 0.0000 0.000000 0.000 0.000 sqrtdel= 1.0000 0.00000 47 -1 0.70 0.50 ag i d10 5s ag i d10 8f 0.000000 ( //r1// )= 0.00000 a0 0.0000 0.000000 0.000 0.000 sqrtdel= 1.0000 0.00000 47 -1 0.70 0.50 ag i d10 5s ag i d10 9f 0.000000 ( //r1// )= 0.00000 a0 0.0000 0.000000 0.000 0.000 sqrtdel= 1.0000 0.00000 47 -1 0.70 0.50 ag i d10 5s ag i d9 5s4f -0.044915 ( 4d//r1// 4f)= 0.07780 a0 -0.9999 0.000058-0.011-0.999 sqrtdel= 1.0000 0.07780 47 -1 0.70 0.50 ag i d10 5s ag i d9 5s5f -0.041002 ( 4d//r1// 5f)= 0.07102 a0 -0.9999 0.000048-0.010-0.999 sqrtdel= 1.0000 0.07102 47 -1 0.70 0.50 ag i d10 5s ag i d9 5s6f -0.034849 ( 4d//r1// 6f)= 0.06036 a0 -0.9999 0.000035-0.009-0.999 sqrtdel= 1.0000 0.06036 47 -1 0.70 0.50 ag i d10 5s ag i d9 5s7f -0.029482 ( 4d//r1// 7f)= 0.05106 a0 -0.9999 0.000025-0.008-0.999 sqrtdel= 1.0000 0.05106 47 -1 0.70 0.50 ag i d10 5s ag i d9 5s8f -0.025160 ( 4d//r1// 8f)= 0.04358 a0 -0.9999 0.000018-0.007-0.998 sqrtdel= 1.0000 0.04358 47 -1 0.70 0.50 ag i d10 5s ag i d9 5s9f -0.021717 ( 4d//r1// 9f)= 0.03762 a0 -0.9998 0.000013-0.006-0.998 sqrtdel= 1.0000 0.03762 47 -1 0.70 0.50 ag i d10 5s ag i d8 5s2 4f 0.000000 ( //r1// )= 0.00000 a0 0.0000 0.000000 0.000 0.000 sqrtdel= 1.0000 0.00000 47 -1 0.70 0.50 ag i d10 5s ag i d10 6h 0.000000 ( //r1// )= 0.00000 a0 0.0000 0.000000 0.000 0.000 sqrtdel= 1.0000 0.00000 47 -1 0.70 0.50 ag i d10 5s ag i d10 7h 0.000000 ( //r1// )= 0.00000 a0 0.0000 0.000000 0.000 0.000 sqrtdel= 1.0000 0.00000 47 -1 0.70 0.50 ag i d10 5s ag i d10 8h 0.000000 ( //r1// )= 0.00000 a0 0.0000 0.000000 0.000 0.000 sqrtdel= 1.0000 0.00000 47 -1 0.70 0.50 ag i d10 5s ag i d10 9h 0.000000 ( //r1// )= 0.00000 a0 0.0000 0.000000 0.000 0.000 sqrtdel= 1.0000 0.00000 47 -1 0.70 0.50 ag i d10 5s ag i d9 5s6h 0.000000 ( //r1// )= 0.00000 a0 0.0000 0.000000 0.000 0.000 sqrtdel= 1.0000 0.00000 47 -1 0.70 0.50 ag i d10 5s ag i d9 5s7h 0.000000 ( //r1// )= 0.00000 a0 0.0000 0.000000 0.000 0.000 sqrtdel= 1.0000 0.00000 47 -1 0.70 0.50 ag i d10 5s ag i d9 5s8h 0.000000 ( //r1// )= 0.00000 a0 0.0000 0.000000 0.000 0.000 sqrtdel= 1.0000 0.00000 47 -1 0.70 0.50 ag i d10 5s ag i d9 5s9h 0.000000 ( //r1// )= 0.00000 a0 0.0000 0.000000 0.000 0.000 sqrtdel= 1.0000 0.00000 47 -1 0.70 0.50 ag i d10 5s ag i d10 8k 0.000000 ( //r1// )= 0.00000 a0 0.0000 0.000000 0.000 0.000 sqrtdel= 1.0000 0.00000 47 -1 0.70 0.50 ag i d10 5s ag i d10 9k 0.000000 ( //r1// )= 0.00000 a0 0.0000 0.000000 0.000 0.000 sqrtdel= 1.0000 0.00000 47 -1 0.70 0.50 ag i d10 5s ag i d9 5s8k 0.000000 ( //r1// )= 0.00000 a0 0.0000 0.000000 0.000 0.000 sqrtdel= 1.0000 0.00000 47 -1 0.70 0.50 ag i d10 5s ag i d9 5s9k 0.000000 ( //r1// )= 0.00000 a0 0.0000 0.000000 0.000 0.000 sqrtdel= 1.0000 0.00000 47 -1 0.70 0.50 ag i d10 6s ag i d10 5p 3.857376 ( 6s//r1// 5p)= -3.85738 a0 0.8652 4.959784 0.415 0.636 sqrtdel= 1.0000 -3.85738 47 -1 0.70 0.50 ag i d10 6s ag i d10 6p -9.025281 ( 6s//r1// 6p)= 9.02528 a0 -0.9834 27.151899-0.813-0.963 sqrtdel= 1.0000 9.02528 47 -1 0.70 0.50 ag i d10 6s ag i d10 7p -1.124459 ( 6s//r1// 7p)= 1.12446 a0 -0.2274 0.421470-0.245-0.546 sqrtdel= 1.0000 1.12446 47 -1 0.70 0.50 ag i d10 6s ag i d10 8p -0.466699 ( 6s//r1// 8p)= 0.46670 a0 -0.1433 0.072603-0.138-0.457 sqrtdel= 1.0000 0.46670 47 -1 0.70 0.50 ag i d10 6s ag i d10 9p -0.270219 ( 6s//r1// 9p)= 0.27022 a0 -0.1128 0.024339-0.094-0.419 sqrtdel= 1.0000 0.27022 47 -1 0.70 0.50 ag i d10 6s ag i d9 5s5p 0.000000 ( //r1// )= 0.00000 a0 0.0000 0.000000 0.000 0.000 sqrtdel= 1.0000 0.00000 47 -1 0.70 0.50 ag i d10 6s ag i d9 5s6p 0.000000 ( //r1// )= 0.00000 a0 0.0000 0.000000 0.000 0.000 sqrtdel= 1.0000 0.00000 47 -1 0.70 0.50 ag i d10 6s ag i d9 5s7p 0.000000 ( //r1// )= 0.00000 a0 0.0000 0.000000 0.000 0.000 sqrtdel= 1.0000 0.00000 47 -1 0.70 0.50 ag i d10 6s ag i d9 5s8p 0.000000 ( //r1// )= 0.00000 a0 0.0000 0.000000 0.000 0.000 sqrtdel= 1.0000 0.00000 47 -1 0.70 0.50 ag i d10 6s ag i d9 5s9p 0.000000 ( //r1// )= 0.00000 a0 0.0000 0.000000 0.000 0.000 sqrtdel= 1.0000 0.00000 47 -1 0.70 0.50 ag i d10 6s ag i d8 5s2 5p 0.000000 ( //r1// )= 0.00000 a0 0.0000 0.000000 0.000 0.000 sqrtdel= 1.0000 0.00000 47 -1 0.70 0.50 ag i d10 6s ag i d10 4f 0.000000 ( //r1// )= 0.00000 a0 0.0000 0.000000 0.000 0.000 sqrtdel= 1.0000 0.00000 47 -1 0.70 0.50 ag i d10 6s ag i d10 5f 0.000000 ( //r1// )= 0.00000 a0 0.0000 0.000000 0.000 0.000 sqrtdel= 1.0000 0.00000 47 -1 0.70 0.50 ag i d10 6s ag i d10 6f 0.000000 ( //r1// )= 0.00000 a0 0.0000 0.000000 0.000 0.000 sqrtdel= 1.0000 0.00000 47 -1 0.70 0.50 ag i d10 6s ag i d10 7f 0.000000 ( //r1// )= 0.00000 a0 0.0000 0.000000 0.000 0.000 sqrtdel= 1.0000 0.00000 47 -1 0.70 0.50 ag i d10 6s ag i d10 8f 0.000000 ( //r1// )= 0.00000 a0 0.0000 0.000000 0.000 0.000 sqrtdel= 1.0000 0.00000 47 -1 0.70 0.50 ag i d10 6s ag i d10 9f 0.000000 ( //r1// )= 0.00000 a0 0.0000 0.000000 0.000 0.000 sqrtdel= 1.0000 0.00000 47 -1 0.70 0.50 ag i d10 6s ag i d9 5s4f 0.000000 ( //r1// )= 0.00000 a0 0.0000 0.000000 0.000 0.000 sqrtdel= 1.0000 0.00000 47 -1 0.70 0.50 ag i d10 6s ag i d9 5s5f 0.000000 ( //r1// )= 0.00000 a0 0.0000 0.000000 0.000 0.000 sqrtdel= 1.0000 0.00000 47 -1 0.70 0.50 ag i d10 6s ag i d9 5s6f 0.000000 ( //r1// )= 0.00000 a0 0.0000 0.000000 0.000 0.000 sqrtdel= 1.0000 0.00000 47 -1 0.70 0.50 ag i d10 6s ag i d9 5s7f 0.000000 ( //r1// )= 0.00000 a0 0.0000 0.000000 0.000 0.000 sqrtdel= 1.0000 0.00000 47 -1 0.70 0.50 ag i d10 6s ag i d9 5s8f 0.000000 ( //r1// )= 0.00000 a0 0.0000 0.000000 0.000 0.000 sqrtdel= 1.0000 0.00000 47 -1 0.70 0.50 ag i d10 6s ag i d9 5s9f 0.000000 ( //r1// )= 0.00000 a0 0.0000 0.000000 0.000 0.000 sqrtdel= 1.0000 0.00000 47 -1 0.70 0.50 ag i d10 6s ag i d8 5s2 4f 0.000000 ( //r1// )= 0.00000 a0 0.0000 0.000000 0.000 0.000 sqrtdel= 1.0000 0.00000 47 -1 0.70 0.50 ag i d10 6s ag i d10 6h 0.000000 ( //r1// )= 0.00000 a0 0.0000 0.000000 0.000 0.000 sqrtdel= 1.0000 0.00000 47 -1 0.70 0.50 ag i d10 6s ag i d10 7h 0.000000 ( //r1// )= 0.00000 a0 0.0000 0.000000 0.000 0.000 sqrtdel= 1.0000 0.00000 47 -1 0.70 0.50 ag i d10 6s ag i d10 8h 0.000000 ( //r1// )= 0.00000 a0 0.0000 0.000000 0.000 0.000 sqrtdel= 1.0000 0.00000 47 -1 0.70 0.50 ag i d10 6s ag i d10 9h 0.000000 ( //r1// )= 0.00000 a0 0.0000 0.000000 0.000 0.000 sqrtdel= 1.0000 0.00000 47 -1 0.70 0.50 ag i d10 6s ag i d9 5s6h 0.000000 ( //r1// )= 0.00000 a0 0.0000 0.000000 0.000 0.000 sqrtdel= 1.0000 0.00000 47 -1 0.70 0.50 ag i d10 6s ag i d9 5s7h 0.000000 ( //r1// )= 0.00000 a0 0.0000 0.000000 0.000 0.000 sqrtdel= 1.0000 0.00000 47 -1 0.70 0.50 ag i d10 6s ag i d9 5s8h 0.000000 ( //r1// )= 0.00000 a0 0.0000 0.000000 0.000 0.000 sqrtdel= 1.0000 0.00000 47 -1 0.70 0.50 ag i d10 6s ag i d9 5s9h 0.000000 ( //r1// )= 0.00000 a0 0.0000 0.000000 0.000 0.000 sqrtdel= 1.0000 0.00000 47 -1 0.70 0.50 ag i d10 6s ag i d10 8k 0.000000 ( //r1// )= 0.00000 a0 0.0000 0.000000 0.000 0.000 sqrtdel= 1.0000 0.00000 47 -1 0.70 0.50 ag i d10 6s ag i d10 9k 0.000000 ( //r1// )= 0.00000 a0 0.0000 0.000000 0.000 0.000 sqrtdel= 1.0000 0.00000 47 -1 0.70 0.50 ag i d10 6s ag i d9 5s8k 0.000000 ( //r1// )= 0.00000 a0 0.0000 0.000000 0.000 0.000 sqrtdel= 1.0000 0.00000 47 -1 0.70 0.50 ag i d10 6s ag i d9 5s9k 0.000000 ( //r1// )= 0.00000 a0 0.0000 0.000000 0.000 0.000 sqrtdel= 1.0000 0.00000 47 -1 0.70 0.50 ag i d10 7s ag i d10 5p 0.834488 ( 7s//r1// 5p)= -0.83449 a0 0.3785 0.232123 0.132 0.398 sqrtdel= 1.0000 -0.83449 47 -1 0.70 0.50 ag i d10 7s ag i d10 6p 9.370937 ( 7s//r1// 6p)= -9.37094 a0 0.8388 29.271485 0.469 0.644 sqrtdel= 1.0000 -9.37094 47 -1 0.70 0.50 ag i d10 7s ag i d10 7p -16.739174 ( 7s//r1// 7p)= 16.73917 a0 -0.9625 93.399985-0.775-0.930 sqrtdel= 1.0000 16.73917 47 -1 0.70 0.50 ag i d10 7s ag i d10 8p -2.135927 ( 7s//r1// 8p)= 2.13593 a0 -0.2013 1.520729-0.245-0.484 sqrtdel= 1.0000 2.13593 47 -1 0.70 0.50 ag i d10 7s ag i d10 9p -0.892553 ( 7s//r1// 9p)= 0.89255 a0 -0.1209 0.265550-0.142-0.391 sqrtdel= 1.0000 0.89255 47 -1 0.70 0.50 ag i d10 7s ag i d9 5s5p 0.000000 ( //r1// )= 0.00000 a0 0.0000 0.000000 0.000 0.000 sqrtdel= 1.0000 0.00000 47 -1 0.70 0.50 ag i d10 7s ag i d9 5s6p 0.000000 ( //r1// )= 0.00000 a0 0.0000 0.000000 0.000 0.000 sqrtdel= 1.0000 0.00000 47 -1 0.70 0.50 ag i d10 7s ag i d9 5s7p 0.000000 ( //r1// )= 0.00000 a0 0.0000 0.000000 0.000 0.000 sqrtdel= 1.0000 0.00000 47 -1 0.70 0.50 ag i d10 7s ag i d9 5s8p 0.000000 ( //r1// )= 0.00000 a0 0.0000 0.000000 0.000 0.000 sqrtdel= 1.0000 0.00000 47 -1 0.70 0.50 ag i d10 7s ag i d9 5s9p 0.000000 ( //r1// )= 0.00000 a0 0.0000 0.000000 0.000 0.000 sqrtdel= 1.0000 0.00000 47 -1 0.70 0.50 ag i d10 7s ag i d8 5s2 5p 0.000000 ( //r1// )= 0.00000 a0 0.0000 0.000000 0.000 0.000 sqrtdel= 1.0000 0.00000 47 -1 0.70 0.50 ag i d10 7s ag i d10 4f 0.000000 ( //r1// )= 0.00000 a0 0.0000 0.000000 0.000 0.000 sqrtdel= 1.0000 0.00000 47 -1 0.70 0.50 ag i d10 7s ag i d10 5f 0.000000 ( //r1// )= 0.00000 a0 0.0000 0.000000 0.000 0.000 sqrtdel= 1.0000 0.00000 47 -1 0.70 0.50 ag i d10 7s ag i d10 6f 0.000000 ( //r1// )= 0.00000 a0 0.0000 0.000000 0.000 0.000 sqrtdel= 1.0000 0.00000 47 -1 0.70 0.50 ag i d10 7s ag i d10 7f 0.000000 ( //r1// )= 0.00000 a0 0.0000 0.000000 0.000 0.000 sqrtdel= 1.0000 0.00000 47 -1 0.70 0.50 ag i d10 7s ag i d10 8f 0.000000 ( //r1// )= 0.00000 a0 0.0000 0.000000 0.000 0.000 sqrtdel= 1.0000 0.00000 47 -1 0.70 0.50 ag i d10 7s ag i d10 9f 0.000000 ( //r1// )= 0.00000 a0 0.0000 0.000000 0.000 0.000 sqrtdel= 1.0000 0.00000 47 -1 0.70 0.50 ag i d10 7s ag i d9 5s4f 0.000000 ( //r1// )= 0.00000 a0 0.0000 0.000000 0.000 0.000 sqrtdel= 1.0000 0.00000 47 -1 0.70 0.50 ag i d10 7s ag i d9 5s5f 0.000000 ( //r1// )= 0.00000 a0 0.0000 0.000000 0.000 0.000 sqrtdel= 1.0000 0.00000 47 -1 0.70 0.50 ag i d10 7s ag i d9 5s6f 0.000000 ( //r1// )= 0.00000 a0 0.0000 0.000000 0.000 0.000 sqrtdel= 1.0000 0.00000 47 -1 0.70 0.50 ag i d10 7s ag i d9 5s7f 0.000000 ( //r1// )= 0.00000 a0 0.0000 0.000000 0.000 0.000 sqrtdel= 1.0000 0.00000 47 -1 0.70 0.50 ag i d10 7s ag i d9 5s8f 0.000000 ( //r1// )= 0.00000 a0 0.0000 0.000000 0.000 0.000 sqrtdel= 1.0000 0.00000 47 -1 0.70 0.50 ag i d10 7s ag i d9 5s9f 0.000000 ( //r1// )= 0.00000 a0 0.0000 0.000000 0.000 0.000 sqrtdel= 1.0000 0.00000 47 -1 0.70 0.50 ag i d10 7s ag i d8 5s2 4f 0.000000 ( //r1// )= 0.00000 a0 0.0000 0.000000 0.000 0.000 sqrtdel= 1.0000 0.00000 47 -1 0.70 0.50 ag i d10 7s ag i d10 6h 0.000000 ( //r1// )= 0.00000 a0 0.0000 0.000000 0.000 0.000 sqrtdel= 1.0000 0.00000 47 -1 0.70 0.50 ag i d10 7s ag i d10 7h 0.000000 ( //r1// )= 0.00000 a0 0.0000 0.000000 0.000 0.000 sqrtdel= 1.0000 0.00000 47 -1 0.70 0.50 ag i d10 7s ag i d10 8h 0.000000 ( //r1// )= 0.00000 a0 0.0000 0.000000 0.000 0.000 sqrtdel= 1.0000 0.00000 47 -1 0.70 0.50 ag i d10 7s ag i d10 9h 0.000000 ( //r1// )= 0.00000 a0 0.0000 0.000000 0.000 0.000 sqrtdel= 1.0000 0.00000 47 -1 0.70 0.50 ag i d10 7s ag i d9 5s6h 0.000000 ( //r1// )= 0.00000 a0 0.0000 0.000000 0.000 0.000 sqrtdel= 1.0000 0.00000 47 -1 0.70 0.50 ag i d10 7s ag i d9 5s7h 0.000000 ( //r1// )= 0.00000 a0 0.0000 0.000000 0.000 0.000 sqrtdel= 1.0000 0.00000 47 -1 0.70 0.50 ag i d10 7s ag i d9 5s8h 0.000000 ( //r1// )= 0.00000 a0 0.0000 0.000000 0.000 0.000 sqrtdel= 1.0000 0.00000 47 -1 0.70 0.50 ag i d10 7s ag i d9 5s9h 0.000000 ( //r1// )= 0.00000 a0 0.0000 0.000000 0.000 0.000 sqrtdel= 1.0000 0.00000 47 -1 0.70 0.50 ag i d10 7s ag i d10 8k 0.000000 ( //r1// )= 0.00000 a0 0.0000 0.000000 0.000 0.000 sqrtdel= 1.0000 0.00000 47 -1 0.70 0.50 ag i d10 7s ag i d10 9k 0.000000 ( //r1// )= 0.00000 a0 0.0000 0.000000 0.000 0.000 sqrtdel= 1.0000 0.00000 47 -1 0.70 0.50 ag i d10 7s ag i d9 5s8k 0.000000 ( //r1// )= 0.00000 a0 0.0000 0.000000 0.000 0.000 sqrtdel= 1.0000 0.00000 47 -1 0.70 0.50 ag i d10 7s ag i d9 5s9k 0.000000 ( //r1// )= 0.00000 a0 0.0000 0.000000 0.000 0.000 sqrtdel= 1.0000 0.00000 47 -1 0.70 0.50 ag i d10 8s ag i d10 5p 0.438930 ( 8s//r1// 5p)= -0.43893 a0 0.3085 0.064220 0.075 0.346 sqrtdel= 1.0000 -0.43893 47 -1 0.70 0.50 ag i d10 8s ag i d10 6p 1.766182 ( 8s//r1// 6p)= -1.76618 a0 0.2734 1.039799 0.149 0.352 sqrtdel= 1.0000 -1.76618 47 -1 0.70 0.50 ag i d10 8s ag i d10 7p 17.115576 ( 8s//r1// 7p)= -17.11558 a0 0.8404 97.647652 0.505 0.669 sqrtdel= 1.0000 -17.11558 47 -1 0.70 0.50 ag i d10 8s ag i d10 8p -26.646818 ( 8s//r1// 8p)= 26.64682 a0 -0.9464 236.684301-0.749-0.906 sqrtdel= 1.0000 26.64682 47 -1 0.70 0.50 ag i d10 8s ag i d10 9p -3.444589 ( 8s//r1// 9p)= 3.44459 a0 -0.1857 3.955064-0.243-0.443 sqrtdel= 1.0000 3.44459 47 -1 0.70 0.50 ag i d10 8s ag i d9 5s5p 0.000000 ( //r1// )= 0.00000 a0 0.0000 0.000000 0.000 0.000 sqrtdel= 1.0000 0.00000 47 -1 0.70 0.50 ag i d10 8s ag i d9 5s6p 0.000000 ( //r1// )= 0.00000 a0 0.0000 0.000000 0.000 0.000 sqrtdel= 1.0000 0.00000 47 -1 0.70 0.50 ag i d10 8s ag i d9 5s7p 0.000000 ( //r1// )= 0.00000 a0 0.0000 0.000000 0.000 0.000 sqrtdel= 1.0000 0.00000 47 -1 0.70 0.50 ag i d10 8s ag i d9 5s8p 0.000000 ( //r1// )= 0.00000 a0 0.0000 0.000000 0.000 0.000 sqrtdel= 1.0000 0.00000 47 -1 0.70 0.50 ag i d10 8s ag i d9 5s9p 0.000000 ( //r1// )= 0.00000 a0 0.0000 0.000000 0.000 0.000 sqrtdel= 1.0000 0.00000 47 -1 0.70 0.50 ag i d10 8s ag i d8 5s2 5p 0.000000 ( //r1// )= 0.00000 a0 0.0000 0.000000 0.000 0.000 sqrtdel= 1.0000 0.00000 47 -1 0.70 0.50 ag i d10 8s ag i d10 4f 0.000000 ( //r1// )= 0.00000 a0 0.0000 0.000000 0.000 0.000 sqrtdel= 1.0000 0.00000 47 -1 0.70 0.50 ag i d10 8s ag i d10 5f 0.000000 ( //r1// )= 0.00000 a0 0.0000 0.000000 0.000 0.000 sqrtdel= 1.0000 0.00000 47 -1 0.70 0.50 ag i d10 8s ag i d10 6f 0.000000 ( //r1// )= 0.00000 a0 0.0000 0.000000 0.000 0.000 sqrtdel= 1.0000 0.00000 47 -1 0.70 0.50 ag i d10 8s ag i d10 7f 0.000000 ( //r1// )= 0.00000 a0 0.0000 0.000000 0.000 0.000 sqrtdel= 1.0000 0.00000 47 -1 0.70 0.50 ag i d10 8s ag i d10 8f 0.000000 ( //r1// )= 0.00000 a0 0.0000 0.000000 0.000 0.000 sqrtdel= 1.0000 0.00000 47 -1 0.70 0.50 ag i d10 8s ag i d10 9f 0.000000 ( //r1// )= 0.00000 a0 0.0000 0.000000 0.000 0.000 sqrtdel= 1.0000 0.00000 47 -1 0.70 0.50 ag i d10 8s ag i d9 5s4f 0.000000 ( //r1// )= 0.00000 a0 0.0000 0.000000 0.000 0.000 sqrtdel= 1.0000 0.00000 47 -1 0.70 0.50 ag i d10 8s ag i d9 5s5f 0.000000 ( //r1// )= 0.00000 a0 0.0000 0.000000 0.000 0.000 sqrtdel= 1.0000 0.00000 47 -1 0.70 0.50 ag i d10 8s ag i d9 5s6f 0.000000 ( //r1// )= 0.00000 a0 0.0000 0.000000 0.000 0.000 sqrtdel= 1.0000 0.00000 47 -1 0.70 0.50 ag i d10 8s ag i d9 5s7f 0.000000 ( //r1// )= 0.00000 a0 0.0000 0.000000 0.000 0.000 sqrtdel= 1.0000 0.00000 47 -1 0.70 0.50 ag i d10 8s ag i d9 5s8f 0.000000 ( //r1// )= 0.00000 a0 0.0000 0.000000 0.000 0.000 sqrtdel= 1.0000 0.00000 47 -1 0.70 0.50 ag i d10 8s ag i d9 5s9f 0.000000 ( //r1// )= 0.00000 a0 0.0000 0.000000 0.000 0.000 sqrtdel= 1.0000 0.00000 47 -1 0.70 0.50 ag i d10 8s ag i d8 5s2 4f 0.000000 ( //r1// )= 0.00000 a0 0.0000 0.000000 0.000 0.000 sqrtdel= 1.0000 0.00000 47 -1 0.70 0.50 ag i d10 8s ag i d10 6h 0.000000 ( //r1// )= 0.00000 a0 0.0000 0.000000 0.000 0.000 sqrtdel= 1.0000 0.00000 47 -1 0.70 0.50 ag i d10 8s ag i d10 7h 0.000000 ( //r1// )= 0.00000 a0 0.0000 0.000000 0.000 0.000 sqrtdel= 1.0000 0.00000 47 -1 0.70 0.50 ag i d10 8s ag i d10 8h 0.000000 ( //r1// )= 0.00000 a0 0.0000 0.000000 0.000 0.000 sqrtdel= 1.0000 0.00000 47 -1 0.70 0.50 ag i d10 8s ag i d10 9h 0.000000 ( //r1// )= 0.00000 a0 0.0000 0.000000 0.000 0.000 sqrtdel= 1.0000 0.00000 47 -1 0.70 0.50 ag i d10 8s ag i d9 5s6h 0.000000 ( //r1// )= 0.00000 a0 0.0000 0.000000 0.000 0.000 sqrtdel= 1.0000 0.00000 47 -1 0.70 0.50 ag i d10 8s ag i d9 5s7h 0.000000 ( //r1// )= 0.00000 a0 0.0000 0.000000 0.000 0.000 sqrtdel= 1.0000 0.00000 47 -1 0.70 0.50 ag i d10 8s ag i d9 5s8h 0.000000 ( //r1// )= 0.00000 a0 0.0000 0.000000 0.000 0.000 sqrtdel= 1.0000 0.00000 47 -1 0.70 0.50 ag i d10 8s ag i d9 5s9h 0.000000 ( //r1// )= 0.00000 a0 0.0000 0.000000 0.000 0.000 sqrtdel= 1.0000 0.00000 47 -1 0.70 0.50 ag i d10 8s ag i d10 8k 0.000000 ( //r1// )= 0.00000 a0 0.0000 0.000000 0.000 0.000 sqrtdel= 1.0000 0.00000 47 -1 0.70 0.50 ag i d10 8s ag i d10 9k 0.000000 ( //r1// )= 0.00000 a0 0.0000 0.000000 0.000 0.000 sqrtdel= 1.0000 0.00000 47 -1 0.70 0.50 ag i d10 8s ag i d9 5s8k 0.000000 ( //r1// )= 0.00000 a0 0.0000 0.000000 0.000 0.000 sqrtdel= 1.0000 0.00000 47 -1 0.70 0.50 ag i d10 8s ag i d9 5s9k 0.000000 ( //r1// )= 0.00000 a0 0.0000 0.000000 0.000 0.000 sqrtdel= 1.0000 0.00000 47 -1 0.70 0.50 ag i d10 9s ag i d10 5p 0.288981 ( 9s//r1// 5p)= -0.28898 a0 0.2812 0.027837 0.051 0.325 sqrtdel= 1.0000 -0.28898 47 -1 0.70 0.50 ag i d10 9s ag i d10 6p 0.886168 ( 9s//r1// 6p)= -0.88617 a0 0.1997 0.261765 0.086 0.290 sqrtdel= 1.0000 -0.88617 47 -1 0.70 0.50 ag i d10 9s ag i d10 7p 3.004444 ( 9s//r1// 7p)= -3.00444 a0 0.2332 3.008895 0.162 0.337 sqrtdel= 1.0000 -3.00444 47 -1 0.70 0.50 ag i d10 9s ag i d10 8p 27.056532 ( 9s//r1// 8p)= -27.05653 a0 0.8429 244.018640 0.528 0.688 sqrtdel= 1.0000 -27.05653 47 -1 0.70 0.50 ag i d10 9s ag i d10 9p -38.771461 ( 9s//r1// 9p)= 38.77146 a0 -0.9350 501.075404-0.732-0.889 sqrtdel= 1.0000 38.77146 47 -1 0.70 0.50 ag i d10 9s ag i d9 5s5p 0.000000 ( //r1// )= 0.00000 a0 0.0000 0.000000 0.000 0.000 sqrtdel= 1.0000 0.00000 47 -1 0.70 0.50 ag i d10 9s ag i d9 5s6p 0.000000 ( //r1// )= 0.00000 a0 0.0000 0.000000 0.000 0.000 sqrtdel= 1.0000 0.00000 47 -1 0.70 0.50 ag i d10 9s ag i d9 5s7p 0.000000 ( //r1// )= 0.00000 a0 0.0000 0.000000 0.000 0.000 sqrtdel= 1.0000 0.00000 47 -1 0.70 0.50 ag i d10 9s ag i d9 5s8p 0.000000 ( //r1// )= 0.00000 a0 0.0000 0.000000 0.000 0.000 sqrtdel= 1.0000 0.00000 47 -1 0.70 0.50 ag i d10 9s ag i d9 5s9p 0.000000 ( //r1// )= 0.00000 a0 0.0000 0.000000 0.000 0.000 sqrtdel= 1.0000 0.00000 47 -1 0.70 0.50 ag i d10 9s ag i d8 5s2 5p 0.000000 ( //r1// )= 0.00000 a0 0.0000 0.000000 0.000 0.000 sqrtdel= 1.0000 0.00000 47 -1 0.70 0.50 ag i d10 9s ag i d10 4f 0.000000 ( //r1// )= 0.00000 a0 0.0000 0.000000 0.000 0.000 sqrtdel= 1.0000 0.00000 47 -1 0.70 0.50 ag i d10 9s ag i d10 5f 0.000000 ( //r1// )= 0.00000 a0 0.0000 0.000000 0.000 0.000 sqrtdel= 1.0000 0.00000 47 -1 0.70 0.50 ag i d10 9s ag i d10 6f 0.000000 ( //r1// )= 0.00000 a0 0.0000 0.000000 0.000 0.000 sqrtdel= 1.0000 0.00000 47 -1 0.70 0.50 ag i d10 9s ag i d10 7f 0.000000 ( //r1// )= 0.00000 a0 0.0000 0.000000 0.000 0.000 sqrtdel= 1.0000 0.00000 47 -1 0.70 0.50 ag i d10 9s ag i d10 8f 0.000000 ( //r1// )= 0.00000 a0 0.0000 0.000000 0.000 0.000 sqrtdel= 1.0000 0.00000 47 -1 0.70 0.50 ag i d10 9s ag i d10 9f 0.000000 ( //r1// )= 0.00000 a0 0.0000 0.000000 0.000 0.000 sqrtdel= 1.0000 0.00000 47 -1 0.70 0.50 ag i d10 9s ag i d9 5s4f 0.000000 ( //r1// )= 0.00000 a0 0.0000 0.000000 0.000 0.000 sqrtdel= 1.0000 0.00000 47 -1 0.70 0.50 ag i d10 9s ag i d9 5s5f 0.000000 ( //r1// )= 0.00000 a0 0.0000 0.000000 0.000 0.000 sqrtdel= 1.0000 0.00000 47 -1 0.70 0.50 ag i d10 9s ag i d9 5s6f 0.000000 ( //r1// )= 0.00000 a0 0.0000 0.000000 0.000 0.000 sqrtdel= 1.0000 0.00000 47 -1 0.70 0.50 ag i d10 9s ag i d9 5s7f 0.000000 ( //r1// )= 0.00000 a0 0.0000 0.000000 0.000 0.000 sqrtdel= 1.0000 0.00000 47 -1 0.70 0.50 ag i d10 9s ag i d9 5s8f 0.000000 ( //r1// )= 0.00000 a0 0.0000 0.000000 0.000 0.000 sqrtdel= 1.0000 0.00000 47 -1 0.70 0.50 ag i d10 9s ag i d9 5s9f 0.000000 ( //r1// )= 0.00000 a0 0.0000 0.000000 0.000 0.000 sqrtdel= 1.0000 0.00000 47 -1 0.70 0.50 ag i d10 9s ag i d8 5s2 4f 0.000000 ( //r1// )= 0.00000 a0 0.0000 0.000000 0.000 0.000 sqrtdel= 1.0000 0.00000 47 -1 0.70 0.50 ag i d10 9s ag i d10 6h 0.000000 ( //r1// )= 0.00000 a0 0.0000 0.000000 0.000 0.000 sqrtdel= 1.0000 0.00000 47 -1 0.70 0.50 ag i d10 9s ag i d10 7h 0.000000 ( //r1// )= 0.00000 a0 0.0000 0.000000 0.000 0.000 sqrtdel= 1.0000 0.00000 47 -1 0.70 0.50 ag i d10 9s ag i d10 8h 0.000000 ( //r1// )= 0.00000 a0 0.0000 0.000000 0.000 0.000 sqrtdel= 1.0000 0.00000 47 -1 0.70 0.50 ag i d10 9s ag i d10 9h 0.000000 ( //r1// )= 0.00000 a0 0.0000 0.000000 0.000 0.000 sqrtdel= 1.0000 0.00000 47 -1 0.70 0.50 ag i d10 9s ag i d9 5s6h 0.000000 ( //r1// )= 0.00000 a0 0.0000 0.000000 0.000 0.000 sqrtdel= 1.0000 0.00000 47 -1 0.70 0.50 ag i d10 9s ag i d9 5s7h 0.000000 ( //r1// )= 0.00000 a0 0.0000 0.000000 0.000 0.000 sqrtdel= 1.0000 0.00000 47 -1 0.70 0.50 ag i d10 9s ag i d9 5s8h 0.000000 ( //r1// )= 0.00000 a0 0.0000 0.000000 0.000 0.000 sqrtdel= 1.0000 0.00000 47 -1 0.70 0.50 ag i d10 9s ag i d9 5s9h 0.000000 ( //r1// )= 0.00000 a0 0.0000 0.000000 0.000 0.000 sqrtdel= 1.0000 0.00000 47 -1 0.70 0.50 ag i d10 9s ag i d10 8k 0.000000 ( //r1// )= 0.00000 a0 0.0000 0.000000 0.000 0.000 sqrtdel= 1.0000 0.00000 47 -1 0.70 0.50 ag i d10 9s ag i d10 9k 0.000000 ( //r1// )= 0.00000 a0 0.0000 0.000000 0.000 0.000 sqrtdel= 1.0000 0.00000 47 -1 0.70 0.50 ag i d10 9s ag i d9 5s8k 0.000000 ( //r1// )= 0.00000 a0 0.0000 0.000000 0.000 0.000 sqrtdel= 1.0000 0.00000 47 -1 0.70 0.50 ag i d10 9s ag i d9 5s9k 0.000000 ( //r1// )= 0.00000 a0 0.0000 0.000000 0.000 0.000 sqrtdel= 1.0000 0.00000 47 -1 0.70 0.50 ag i d9 5s2 ag i d10 5p 0.000000 ( //r1// )= 0.00000 a0 0.0000 0.000000 0.000 0.000 sqrtdel= 1.0000 0.00000 47 -1 0.70 0.50 ag i d9 5s2 ag i d10 6p 0.000000 ( //r1// )= 0.00000 a0 0.0000 0.000000 0.000 0.000 sqrtdel= 1.0000 0.00000 47 -1 0.70 0.50 ag i d9 5s2 ag i d10 7p 0.000000 ( //r1// )= 0.00000 a0 0.0000 0.000000 0.000 0.000 sqrtdel= 1.0000 0.00000 47 -1 0.70 0.50 ag i d9 5s2 ag i d10 8p 0.000000 ( //r1// )= 0.00000 a0 0.0000 0.000000 0.000 0.000 sqrtdel= 1.0000 0.00000 47 -1 0.70 0.50 ag i d9 5s2 ag i d10 9p 0.000000 ( //r1// )= 0.00000 a0 0.0000 0.000000 0.000 0.000 sqrtdel= 1.0000 0.00000 47 -1 0.70 0.50 ag i d9 5s2 ag i d9 5s5p -3.215594 ( 5s//r1// 5p)= 3.21559 a0 -0.9997 3.446681-0.906-0.999 sqrtdel= 1.0000 3.21559 47 -1 0.70 0.50 ag i d9 5s2 ag i d9 5s6p -0.238557 ( 5s//r1// 6p)= 0.23856 a0 -0.1991 0.018970-0.189-0.607 sqrtdel= 1.0000 0.23856 47 -1 0.70 0.50 ag i d9 5s2 ag i d9 5s7p -0.092115 ( 5s//r1// 7p)= 0.09212 a0 -0.1281 0.002828-0.102-0.541 sqrtdel= 1.0000 0.09212 47 -1 0.70 0.50 ag i d9 5s2 ag i d9 5s8p -0.051321 ( 5s//r1// 8p)= 0.05132 a0 -0.1028 0.000878-0.067-0.515 sqrtdel= 1.0000 0.05132 47 -1 0.70 0.50 ag i d9 5s2 ag i d9 5s9p -0.033659 ( 5s//r1// 9p)= 0.03366 a0 -0.0900 0.000378-0.049-0.501 sqrtdel= 1.0000 0.03366 47 -1 0.70 0.50 ag i d9 5s2 ag i d8 5s2 5p 0.848699 ( 4d//r1// 5p)= 1.20024 a0 0.8443 0.048019 0.259 0.571 sqrtdel= 1.0000 1.20024 47 -1 0.70 0.50 ag i d9 5s2 ag i d10 4f 0.000000 ( //r1// )= 0.00000 a0 0.0000 0.000000 0.000 0.000 sqrtdel= 1.0000 0.00000 47 -1 0.70 0.50 ag i d9 5s2 ag i d10 5f 0.000000 ( //r1// )= 0.00000 a0 0.0000 0.000000 0.000 0.000 sqrtdel= 1.0000 0.00000 47 -1 0.70 0.50 ag i d9 5s2 ag i d10 6f 0.000000 ( //r1// )= 0.00000 a0 0.0000 0.000000 0.000 0.000 sqrtdel= 1.0000 0.00000 47 -1 0.70 0.50 ag i d9 5s2 ag i d10 7f 0.000000 ( //r1// )= 0.00000 a0 0.0000 0.000000 0.000 0.000 sqrtdel= 1.0000 0.00000 47 -1 0.70 0.50 ag i d9 5s2 ag i d10 8f 0.000000 ( //r1// )= 0.00000 a0 0.0000 0.000000 0.000 0.000 sqrtdel= 1.0000 0.00000 47 -1 0.70 0.50 ag i d9 5s2 ag i d10 9f 0.000000 ( //r1// )= 0.00000 a0 0.0000 0.000000 0.000 0.000 sqrtdel= 1.0000 0.00000 47 -1 0.70 0.50 ag i d9 5s2 ag i d9 5s4f 0.000000 ( //r1// )= 0.00000 a0 0.0000 0.000000 0.000 0.000 sqrtdel= 1.0000 0.00000 47 -1 0.70 0.50 ag i d9 5s2 ag i d9 5s5f 0.000000 ( //r1// )= 0.00000 a0 0.0000 0.000000 0.000 0.000 sqrtdel= 1.0000 0.00000 47 -1 0.70 0.50 ag i d9 5s2 ag i d9 5s6f 0.000000 ( //r1// )= 0.00000 a0 0.0000 0.000000 0.000 0.000 sqrtdel= 1.0000 0.00000 47 -1 0.70 0.50 ag i d9 5s2 ag i d9 5s7f 0.000000 ( //r1// )= 0.00000 a0 0.0000 0.000000 0.000 0.000 sqrtdel= 1.0000 0.00000 47 -1 0.70 0.50 ag i d9 5s2 ag i d9 5s8f 0.000000 ( //r1// )= 0.00000 a0 0.0000 0.000000 0.000 0.000 sqrtdel= 1.0000 0.00000 47 -1 0.70 0.50 ag i d9 5s2 ag i d9 5s9f 0.000000 ( //r1// )= 0.00000 a0 0.0000 0.000000 0.000 0.000 sqrtdel= 1.0000 0.00000 47 -1 0.70 0.50 ag i d9 5s2 ag i d8 5s2 4f -0.032172 ( 4d//r1// 4f)= 0.05572 a0 -0.9998 0.000030-0.009-0.998 sqrtdel= 1.0000 0.05572 47 -1 0.70 0.50 ag i d9 5s2 ag i d10 6h 0.000000 ( //r1// )= 0.00000 a0 0.0000 0.000000 0.000 0.000 sqrtdel= 1.0000 0.00000 47 -1 0.70 0.50 ag i d9 5s2 ag i d10 7h 0.000000 ( //r1// )= 0.00000 a0 0.0000 0.000000 0.000 0.000 sqrtdel= 1.0000 0.00000 47 -1 0.70 0.50 ag i d9 5s2 ag i d10 8h 0.000000 ( //r1// )= 0.00000 a0 0.0000 0.000000 0.000 0.000 sqrtdel= 1.0000 0.00000 47 -1 0.70 0.50 ag i d9 5s2 ag i d10 9h 0.000000 ( //r1// )= 0.00000 a0 0.0000 0.000000 0.000 0.000 sqrtdel= 1.0000 0.00000 47 -1 0.70 0.50 ag i d9 5s2 ag i d9 5s6h 0.000000 ( //r1// )= 0.00000 a0 0.0000 0.000000 0.000 0.000 sqrtdel= 1.0000 0.00000 47 -1 0.70 0.50 ag i d9 5s2 ag i d9 5s7h 0.000000 ( //r1// )= 0.00000 a0 0.0000 0.000000 0.000 0.000 sqrtdel= 1.0000 0.00000 47 -1 0.70 0.50 ag i d9 5s2 ag i d9 5s8h 0.000000 ( //r1// )= 0.00000 a0 0.0000 0.000000 0.000 0.000 sqrtdel= 1.0000 0.00000 47 -1 0.70 0.50 ag i d9 5s2 ag i d9 5s9h 0.000000 ( //r1// )= 0.00000 a0 0.0000 0.000000 0.000 0.000 sqrtdel= 1.0000 0.00000 47 -1 0.70 0.50 ag i d9 5s2 ag i d10 8k 0.000000 ( //r1// )= 0.00000 a0 0.0000 0.000000 0.000 0.000 sqrtdel= 1.0000 0.00000 47 -1 0.70 0.50 ag i d9 5s2 ag i d10 9k 0.000000 ( //r1// )= 0.00000 a0 0.0000 0.000000 0.000 0.000 sqrtdel= 1.0000 0.00000 47 -1 0.70 0.50 ag i d9 5s2 ag i d9 5s8k 0.000000 ( //r1// )= 0.00000 a0 0.0000 0.000000 0.000 0.000 sqrtdel= 1.0000 0.00000 47 -1 0.70 0.50 ag i d9 5s2 ag i d9 5s9k 0.000000 ( //r1// )= 0.00000 a0 0.0000 0.000000 0.000 0.000 sqrtdel= 1.0000 0.00000 47 -1 0.70 0.50 ag i d9 5s6s ag i d10 5p 0.000000 ( //r1// )= 0.00000 a0 0.0000 0.000000 0.000 0.000 sqrtdel= 1.0000 0.00000 47 -1 0.70 0.50 ag i d9 5s6s ag i d10 6p 0.000000 ( //r1// )= 0.00000 a0 0.0000 0.000000 0.000 0.000 sqrtdel= 1.0000 0.00000 47 -1 0.70 0.50 ag i d9 5s6s ag i d10 7p 0.000000 ( //r1// )= 0.00000 a0 0.0000 0.000000 0.000 0.000 sqrtdel= 1.0000 0.00000 47 -1 0.70 0.50 ag i d9 5s6s ag i d10 8p 0.000000 ( //r1// )= 0.00000 a0 0.0000 0.000000 0.000 0.000 sqrtdel= 1.0000 0.00000 47 -1 0.70 0.50 ag i d9 5s6s ag i d10 9p 0.000000 ( //r1// )= 0.00000 a0 0.0000 0.000000 0.000 0.000 sqrtdel= 1.0000 0.00000 47 -1 0.70 0.50 ag i d9 5s6s ag i d9 5s5p 3.080950 ( 6s//r1// 5p)= -3.08095 a0 0.8415 3.164084 0.349 0.589 sqrtdel= 1.0000 -3.08095 47 -1 0.70 0.50 ag i d9 5s6s ag i d9 5s6p -8.837933 ( 6s//r1// 6p)= 8.83793 a0 -0.9896 26.036356-0.844-0.976 sqrtdel= 1.0000 8.83793 47 -1 0.70 0.50 ag i d9 5s6s ag i d9 5s7p -0.954999 ( 6s//r1// 7p)= 0.95500 a0 -0.2014 0.304008-0.239-0.534 sqrtdel= 1.0000 0.95500 47 -1 0.70 0.50 ag i d9 5s6s ag i d9 5s8p -0.387912 ( 6s//r1// 8p)= 0.38791 a0 -0.1255 0.050158-0.133-0.447 sqrtdel= 1.0000 0.38791 47 -1 0.70 0.50 ag i d9 5s6s ag i d9 5s9p -0.222917 ( 6s//r1// 9p)= 0.22292 a0 -0.0984 0.016564-0.090-0.410 sqrtdel= 1.0000 0.22292 47 -1 0.70 0.50 ag i d9 5s6s ag i d8 5s2 5p 0.000000 ( //r1// )= 0.00000 a0 0.0000 0.000000 0.000 0.000 sqrtdel= 1.0000 0.00000 47 -1 0.70 0.50 ag i d9 5s6s ag i d10 4f 0.000000 ( //r1// )= 0.00000 a0 0.0000 0.000000 0.000 0.000 sqrtdel= 1.0000 0.00000 47 -1 0.70 0.50 ag i d9 5s6s ag i d10 5f 0.000000 ( //r1// )= 0.00000 a0 0.0000 0.000000 0.000 0.000 sqrtdel= 1.0000 0.00000 47 -1 0.70 0.50 ag i d9 5s6s ag i d10 6f 0.000000 ( //r1// )= 0.00000 a0 0.0000 0.000000 0.000 0.000 sqrtdel= 1.0000 0.00000 47 -1 0.70 0.50 ag i d9 5s6s ag i d10 7f 0.000000 ( //r1// )= 0.00000 a0 0.0000 0.000000 0.000 0.000 sqrtdel= 1.0000 0.00000 47 -1 0.70 0.50 ag i d9 5s6s ag i d10 8f 0.000000 ( //r1// )= 0.00000 a0 0.0000 0.000000 0.000 0.000 sqrtdel= 1.0000 0.00000 47 -1 0.70 0.50 ag i d9 5s6s ag i d10 9f 0.000000 ( //r1// )= 0.00000 a0 0.0000 0.000000 0.000 0.000 sqrtdel= 1.0000 0.00000 47 -1 0.70 0.50 ag i d9 5s6s ag i d9 5s4f 0.000000 ( //r1// )= 0.00000 a0 0.0000 0.000000 0.000 0.000 sqrtdel= 1.0000 0.00000 47 -1 0.70 0.50 ag i d9 5s6s ag i d9 5s5f 0.000000 ( //r1// )= 0.00000 a0 0.0000 0.000000 0.000 0.000 sqrtdel= 1.0000 0.00000 47 -1 0.70 0.50 ag i d9 5s6s ag i d9 5s6f 0.000000 ( //r1// )= 0.00000 a0 0.0000 0.000000 0.000 0.000 sqrtdel= 1.0000 0.00000 47 -1 0.70 0.50 ag i d9 5s6s ag i d9 5s7f 0.000000 ( //r1// )= 0.00000 a0 0.0000 0.000000 0.000 0.000 sqrtdel= 1.0000 0.00000 47 -1 0.70 0.50 ag i d9 5s6s ag i d9 5s8f 0.000000 ( //r1// )= 0.00000 a0 0.0000 0.000000 0.000 0.000 sqrtdel= 1.0000 0.00000 47 -1 0.70 0.50 ag i d9 5s6s ag i d9 5s9f 0.000000 ( //r1// )= 0.00000 a0 0.0000 0.000000 0.000 0.000 sqrtdel= 1.0000 0.00000 47 -1 0.70 0.50 ag i d9 5s6s ag i d8 5s2 4f 0.000000 ( //r1// )= 0.00000 a0 0.0000 0.000000 0.000 0.000 sqrtdel= 1.0000 0.00000 47 -1 0.70 0.50 ag i d9 5s6s ag i d10 6h 0.000000 ( //r1// )= 0.00000 a0 0.0000 0.000000 0.000 0.000 sqrtdel= 1.0000 0.00000 47 -1 0.70 0.50 ag i d9 5s6s ag i d10 7h 0.000000 ( //r1// )= 0.00000 a0 0.0000 0.000000 0.000 0.000 sqrtdel= 1.0000 0.00000 47 -1 0.70 0.50 ag i d9 5s6s ag i d10 8h 0.000000 ( //r1// )= 0.00000 a0 0.0000 0.000000 0.000 0.000 sqrtdel= 1.0000 0.00000 47 -1 0.70 0.50 ag i d9 5s6s ag i d10 9h 0.000000 ( //r1// )= 0.00000 a0 0.0000 0.000000 0.000 0.000 sqrtdel= 1.0000 0.00000 47 -1 0.70 0.50 ag i d9 5s6s ag i d9 5s6h 0.000000 ( //r1// )= 0.00000 a0 0.0000 0.000000 0.000 0.000 sqrtdel= 1.0000 0.00000 47 -1 0.70 0.50 ag i d9 5s6s ag i d9 5s7h 0.000000 ( //r1// )= 0.00000 a0 0.0000 0.000000 0.000 0.000 sqrtdel= 1.0000 0.00000 47 -1 0.70 0.50 ag i d9 5s6s ag i d9 5s8h 0.000000 ( //r1// )= 0.00000 a0 0.0000 0.000000 0.000 0.000 sqrtdel= 1.0000 0.00000 47 -1 0.70 0.50 ag i d9 5s6s ag i d9 5s9h 0.000000 ( //r1// )= 0.00000 a0 0.0000 0.000000 0.000 0.000 sqrtdel= 1.0000 0.00000 47 -1 0.70 0.50 ag i d9 5s6s ag i d10 8k 0.000000 ( //r1// )= 0.00000 a0 0.0000 0.000000 0.000 0.000 sqrtdel= 1.0000 0.00000 47 -1 0.70 0.50 ag i d9 5s6s ag i d10 9k 0.000000 ( //r1// )= 0.00000 a0 0.0000 0.000000 0.000 0.000 sqrtdel= 1.0000 0.00000 47 -1 0.70 0.50 ag i d9 5s6s ag i d9 5s8k 0.000000 ( //r1// )= 0.00000 a0 0.0000 0.000000 0.000 0.000 sqrtdel= 1.0000 0.00000 47 -1 0.70 0.50 ag i d9 5s6s ag i d9 5s9k 0.000000 ( //r1// )= 0.00000 a0 0.0000 0.000000 0.000 0.000 sqrtdel= 1.0000 0.00000 47 -1 0.70 0.50 ag i d9 5s7s ag i d10 5p 0.000000 ( //r1// )= 0.00000 a0 0.0000 0.000000 0.000 0.000 sqrtdel= 1.0000 0.00000 47 -1 0.70 0.50 ag i d9 5s7s ag i d10 6p 0.000000 ( //r1// )= 0.00000 a0 0.0000 0.000000 0.000 0.000 sqrtdel= 1.0000 0.00000 47 -1 0.70 0.50 ag i d9 5s7s ag i d10 7p 0.000000 ( //r1// )= 0.00000 a0 0.0000 0.000000 0.000 0.000 sqrtdel= 1.0000 0.00000 47 -1 0.70 0.50 ag i d9 5s7s ag i d10 8p 0.000000 ( //r1// )= 0.00000 a0 0.0000 0.000000 0.000 0.000 sqrtdel= 1.0000 0.00000 47 -1 0.70 0.50 ag i d9 5s7s ag i d10 9p 0.000000 ( //r1// )= 0.00000 a0 0.0000 0.000000 0.000 0.000 sqrtdel= 1.0000 0.00000 47 -1 0.70 0.50 ag i d9 5s7s ag i d9 5s5p 0.820415 ( 7s//r1// 5p)= -0.82042 a0 0.4621 0.224360 0.122 0.405 sqrtdel= 1.0000 -0.82042 47 -1 0.70 0.50 ag i d9 5s7s ag i d9 5s6p 8.522294 ( 7s//r1// 6p)= -8.52229 a0 0.8187 24.209832 0.434 0.608 sqrtdel= 1.0000 -8.52229 47 -1 0.70 0.50 ag i d9 5s7s ag i d9 5s7p -16.468661 ( 7s//r1// 7p)= 16.46866 a0 -0.9692 90.405604-0.796-0.943 sqrtdel= 1.0000 16.46866 47 -1 0.70 0.50 ag i d9 5s7s ag i d9 5s8p -1.923972 ( 7s//r1// 8p)= 1.92397 a0 -0.1868 1.233890-0.243-0.479 sqrtdel= 1.0000 1.92397 47 -1 0.70 0.50 ag i d9 5s7s ag i d9 5s9p -0.789357 ( 7s//r1// 9p)= 0.78936 a0 -0.1108 0.207695-0.140-0.387 sqrtdel= 1.0000 0.78936 47 -1 0.70 0.50 ag i d9 5s7s ag i d8 5s2 5p 0.000000 ( //r1// )= 0.00000 a0 0.0000 0.000000 0.000 0.000 sqrtdel= 1.0000 0.00000 47 -1 0.70 0.50 ag i d9 5s7s ag i d10 4f 0.000000 ( //r1// )= 0.00000 a0 0.0000 0.000000 0.000 0.000 sqrtdel= 1.0000 0.00000 47 -1 0.70 0.50 ag i d9 5s7s ag i d10 5f 0.000000 ( //r1// )= 0.00000 a0 0.0000 0.000000 0.000 0.000 sqrtdel= 1.0000 0.00000 47 -1 0.70 0.50 ag i d9 5s7s ag i d10 6f 0.000000 ( //r1// )= 0.00000 a0 0.0000 0.000000 0.000 0.000 sqrtdel= 1.0000 0.00000 47 -1 0.70 0.50 ag i d9 5s7s ag i d10 7f 0.000000 ( //r1// )= 0.00000 a0 0.0000 0.000000 0.000 0.000 sqrtdel= 1.0000 0.00000 47 -1 0.70 0.50 ag i d9 5s7s ag i d10 8f 0.000000 ( //r1// )= 0.00000 a0 0.0000 0.000000 0.000 0.000 sqrtdel= 1.0000 0.00000 47 -1 0.70 0.50 ag i d9 5s7s ag i d10 9f 0.000000 ( //r1// )= 0.00000 a0 0.0000 0.000000 0.000 0.000 sqrtdel= 1.0000 0.00000 47 -1 0.70 0.50 ag i d9 5s7s ag i d9 5s4f 0.000000 ( //r1// )= 0.00000 a0 0.0000 0.000000 0.000 0.000 sqrtdel= 1.0000 0.00000 47 -1 0.70 0.50 ag i d9 5s7s ag i d9 5s5f 0.000000 ( //r1// )= 0.00000 a0 0.0000 0.000000 0.000 0.000 sqrtdel= 1.0000 0.00000 47 -1 0.70 0.50 ag i d9 5s7s ag i d9 5s6f 0.000000 ( //r1// )= 0.00000 a0 0.0000 0.000000 0.000 0.000 sqrtdel= 1.0000 0.00000 47 -1 0.70 0.50 ag i d9 5s7s ag i d9 5s7f 0.000000 ( //r1// )= 0.00000 a0 0.0000 0.000000 0.000 0.000 sqrtdel= 1.0000 0.00000 47 -1 0.70 0.50 ag i d9 5s7s ag i d9 5s8f 0.000000 ( //r1// )= 0.00000 a0 0.0000 0.000000 0.000 0.000 sqrtdel= 1.0000 0.00000 47 -1 0.70 0.50 ag i d9 5s7s ag i d9 5s9f 0.000000 ( //r1// )= 0.00000 a0 0.0000 0.000000 0.000 0.000 sqrtdel= 1.0000 0.00000 47 -1 0.70 0.50 ag i d9 5s7s ag i d8 5s2 4f 0.000000 ( //r1// )= 0.00000 a0 0.0000 0.000000 0.000 0.000 sqrtdel= 1.0000 0.00000 47 -1 0.70 0.50 ag i d9 5s7s ag i d10 6h 0.000000 ( //r1// )= 0.00000 a0 0.0000 0.000000 0.000 0.000 sqrtdel= 1.0000 0.00000 47 -1 0.70 0.50 ag i d9 5s7s ag i d10 7h 0.000000 ( //r1// )= 0.00000 a0 0.0000 0.000000 0.000 0.000 sqrtdel= 1.0000 0.00000 47 -1 0.70 0.50 ag i d9 5s7s ag i d10 8h 0.000000 ( //r1// )= 0.00000 a0 0.0000 0.000000 0.000 0.000 sqrtdel= 1.0000 0.00000 47 -1 0.70 0.50 ag i d9 5s7s ag i d10 9h 0.000000 ( //r1// )= 0.00000 a0 0.0000 0.000000 0.000 0.000 sqrtdel= 1.0000 0.00000 47 -1 0.70 0.50 ag i d9 5s7s ag i d9 5s6h 0.000000 ( //r1// )= 0.00000 a0 0.0000 0.000000 0.000 0.000 sqrtdel= 1.0000 0.00000 47 -1 0.70 0.50 ag i d9 5s7s ag i d9 5s7h 0.000000 ( //r1// )= 0.00000 a0 0.0000 0.000000 0.000 0.000 sqrtdel= 1.0000 0.00000 47 -1 0.70 0.50 ag i d9 5s7s ag i d9 5s8h 0.000000 ( //r1// )= 0.00000 a0 0.0000 0.000000 0.000 0.000 sqrtdel= 1.0000 0.00000 47 -1 0.70 0.50 ag i d9 5s7s ag i d9 5s9h 0.000000 ( //r1// )= 0.00000 a0 0.0000 0.000000 0.000 0.000 sqrtdel= 1.0000 0.00000 47 -1 0.70 0.50 ag i d9 5s7s ag i d10 8k 0.000000 ( //r1// )= 0.00000 a0 0.0000 0.000000 0.000 0.000 sqrtdel= 1.0000 0.00000 47 -1 0.70 0.50 ag i d9 5s7s ag i d10 9k 0.000000 ( //r1// )= 0.00000 a0 0.0000 0.000000 0.000 0.000 sqrtdel= 1.0000 0.00000 47 -1 0.70 0.50 ag i d9 5s7s ag i d9 5s8k 0.000000 ( //r1// )= 0.00000 a0 0.0000 0.000000 0.000 0.000 sqrtdel= 1.0000 0.00000 47 -1 0.70 0.50 ag i d9 5s7s ag i d9 5s9k 0.000000 ( //r1// )= 0.00000 a0 0.0000 0.000000 0.000 0.000 sqrtdel= 1.0000 0.00000 47 -1 0.70 0.50 ag i d9 5s8s ag i d10 5p 0.000000 ( //r1// )= 0.00000 a0 0.0000 0.000000 0.000 0.000 sqrtdel= 1.0000 0.00000 47 -1 0.70 0.50 ag i d9 5s8s ag i d10 6p 0.000000 ( //r1// )= 0.00000 a0 0.0000 0.000000 0.000 0.000 sqrtdel= 1.0000 0.00000 47 -1 0.70 0.50 ag i d9 5s8s ag i d10 7p 0.000000 ( //r1// )= 0.00000 a0 0.0000 0.000000 0.000 0.000 sqrtdel= 1.0000 0.00000 47 -1 0.70 0.50 ag i d9 5s8s ag i d10 8p 0.000000 ( //r1// )= 0.00000 a0 0.0000 0.000000 0.000 0.000 sqrtdel= 1.0000 0.00000 47 -1 0.70 0.50 ag i d9 5s8s ag i d10 9p 0.000000 ( //r1// )= 0.00000 a0 0.0000 0.000000 0.000 0.000 sqrtdel= 1.0000 0.00000 47 -1 0.70 0.50 ag i d9 5s8s ag i d9 5s5p 0.444793 ( 8s//r1// 5p)= -0.44479 a0 0.3874 0.065947 0.071 0.357 sqrtdel= 1.0000 -0.44479 47 -1 0.70 0.50 ag i d9 5s8s ag i d9 5s6p 1.737531 ( 8s//r1// 6p)= -1.73753 a0 0.2911 1.006337 0.143 0.344 sqrtdel= 1.0000 -1.73753 47 -1 0.70 0.50 ag i d9 5s8s ag i d9 5s7p 16.118239 ( 8s//r1// 7p)= -16.11824 a0 0.8279 86.599212 0.483 0.646 sqrtdel= 1.0000 -16.11824 47 -1 0.70 0.50 ag i d9 5s8s ag i d9 5s8p -26.281169 ( 8s//r1// 8p)= 26.28117 a0 -0.9524 230.233278-0.765-0.917 sqrtdel= 1.0000 26.28117 47 -1 0.70 0.50 ag i d9 5s8s ag i d9 5s9p -3.198968 ( 8s//r1// 9p)= 3.19897 a0 -0.1767 3.411132-0.242-0.441 sqrtdel= 1.0000 3.19897 47 -1 0.70 0.50 ag i d9 5s8s ag i d8 5s2 5p 0.000000 ( //r1// )= 0.00000 a0 0.0000 0.000000 0.000 0.000 sqrtdel= 1.0000 0.00000 47 -1 0.70 0.50 ag i d9 5s8s ag i d10 4f 0.000000 ( //r1// )= 0.00000 a0 0.0000 0.000000 0.000 0.000 sqrtdel= 1.0000 0.00000 47 -1 0.70 0.50 ag i d9 5s8s ag i d10 5f 0.000000 ( //r1// )= 0.00000 a0 0.0000 0.000000 0.000 0.000 sqrtdel= 1.0000 0.00000 47 -1 0.70 0.50 ag i d9 5s8s ag i d10 6f 0.000000 ( //r1// )= 0.00000 a0 0.0000 0.000000 0.000 0.000 sqrtdel= 1.0000 0.00000 47 -1 0.70 0.50 ag i d9 5s8s ag i d10 7f 0.000000 ( //r1// )= 0.00000 a0 0.0000 0.000000 0.000 0.000 sqrtdel= 1.0000 0.00000 47 -1 0.70 0.50 ag i d9 5s8s ag i d10 8f 0.000000 ( //r1// )= 0.00000 a0 0.0000 0.000000 0.000 0.000 sqrtdel= 1.0000 0.00000 47 -1 0.70 0.50 ag i d9 5s8s ag i d10 9f 0.000000 ( //r1// )= 0.00000 a0 0.0000 0.000000 0.000 0.000 sqrtdel= 1.0000 0.00000 47 -1 0.70 0.50 ag i d9 5s8s ag i d9 5s4f 0.000000 ( //r1// )= 0.00000 a0 0.0000 0.000000 0.000 0.000 sqrtdel= 1.0000 0.00000 47 -1 0.70 0.50 ag i d9 5s8s ag i d9 5s5f 0.000000 ( //r1// )= 0.00000 a0 0.0000 0.000000 0.000 0.000 sqrtdel= 1.0000 0.00000 47 -1 0.70 0.50 ag i d9 5s8s ag i d9 5s6f 0.000000 ( //r1// )= 0.00000 a0 0.0000 0.000000 0.000 0.000 sqrtdel= 1.0000 0.00000 47 -1 0.70 0.50 ag i d9 5s8s ag i d9 5s7f 0.000000 ( //r1// )= 0.00000 a0 0.0000 0.000000 0.000 0.000 sqrtdel= 1.0000 0.00000 47 -1 0.70 0.50 ag i d9 5s8s ag i d9 5s8f 0.000000 ( //r1// )= 0.00000 a0 0.0000 0.000000 0.000 0.000 sqrtdel= 1.0000 0.00000 47 -1 0.70 0.50 ag i d9 5s8s ag i d9 5s9f 0.000000 ( //r1// )= 0.00000 a0 0.0000 0.000000 0.000 0.000 sqrtdel= 1.0000 0.00000 47 -1 0.70 0.50 ag i d9 5s8s ag i d8 5s2 4f 0.000000 ( //r1// )= 0.00000 a0 0.0000 0.000000 0.000 0.000 sqrtdel= 1.0000 0.00000 47 -1 0.70 0.50 ag i d9 5s8s ag i d10 6h 0.000000 ( //r1// )= 0.00000 a0 0.0000 0.000000 0.000 0.000 sqrtdel= 1.0000 0.00000 47 -1 0.70 0.50 ag i d9 5s8s ag i d10 7h 0.000000 ( //r1// )= 0.00000 a0 0.0000 0.000000 0.000 0.000 sqrtdel= 1.0000 0.00000 47 -1 0.70 0.50 ag i d9 5s8s ag i d10 8h 0.000000 ( //r1// )= 0.00000 a0 0.0000 0.000000 0.000 0.000 sqrtdel= 1.0000 0.00000 47 -1 0.70 0.50 ag i d9 5s8s ag i d10 9h 0.000000 ( //r1// )= 0.00000 a0 0.0000 0.000000 0.000 0.000 sqrtdel= 1.0000 0.00000 47 -1 0.70 0.50 ag i d9 5s8s ag i d9 5s6h 0.000000 ( //r1// )= 0.00000 a0 0.0000 0.000000 0.000 0.000 sqrtdel= 1.0000 0.00000 47 -1 0.70 0.50 ag i d9 5s8s ag i d9 5s7h 0.000000 ( //r1// )= 0.00000 a0 0.0000 0.000000 0.000 0.000 sqrtdel= 1.0000 0.00000 47 -1 0.70 0.50 ag i d9 5s8s ag i d9 5s8h 0.000000 ( //r1// )= 0.00000 a0 0.0000 0.000000 0.000 0.000 sqrtdel= 1.0000 0.00000 47 -1 0.70 0.50 ag i d9 5s8s ag i d9 5s9h 0.000000 ( //r1// )= 0.00000 a0 0.0000 0.000000 0.000 0.000 sqrtdel= 1.0000 0.00000 47 -1 0.70 0.50 ag i d9 5s8s ag i d10 8k 0.000000 ( //r1// )= 0.00000 a0 0.0000 0.000000 0.000 0.000 sqrtdel= 1.0000 0.00000 47 -1 0.70 0.50 ag i d9 5s8s ag i d10 9k 0.000000 ( //r1// )= 0.00000 a0 0.0000 0.000000 0.000 0.000 sqrtdel= 1.0000 0.00000 47 -1 0.70 0.50 ag i d9 5s8s ag i d9 5s8k 0.000000 ( //r1// )= 0.00000 a0 0.0000 0.000000 0.000 0.000 sqrtdel= 1.0000 0.00000 47 -1 0.70 0.50 ag i d9 5s8s ag i d9 5s9k 0.000000 ( //r1// )= 0.00000 a0 0.0000 0.000000 0.000 0.000 sqrtdel= 1.0000 0.00000 47 -1 0.70 0.50 ag i d9 5s9s ag i d10 5p 0.000000 ( //r1// )= 0.00000 a0 0.0000 0.000000 0.000 0.000 sqrtdel= 1.0000 0.00000 47 -1 0.70 0.50 ag i d9 5s9s ag i d10 6p 0.000000 ( //r1// )= 0.00000 a0 0.0000 0.000000 0.000 0.000 sqrtdel= 1.0000 0.00000 47 -1 0.70 0.50 ag i d9 5s9s ag i d10 7p 0.000000 ( //r1// )= 0.00000 a0 0.0000 0.000000 0.000 0.000 sqrtdel= 1.0000 0.00000 47 -1 0.70 0.50 ag i d9 5s9s ag i d10 8p 0.000000 ( //r1// )= 0.00000 a0 0.0000 0.000000 0.000 0.000 sqrtdel= 1.0000 0.00000 47 -1 0.70 0.50 ag i d9 5s9s ag i d10 9p 0.000000 ( //r1// )= 0.00000 a0 0.0000 0.000000 0.000 0.000 sqrtdel= 1.0000 0.00000 47 -1 0.70 0.50 ag i d9 5s9s ag i d9 5s5p 0.294998 ( 9s//r1// 5p)= -0.29500 a0 0.3562 0.029008 0.048 0.336 sqrtdel= 1.0000 -0.29500 47 -1 0.70 0.50 ag i d9 5s9s ag i d9 5s6p 0.881755 ( 9s//r1// 6p)= -0.88175 a0 0.2151 0.259164 0.083 0.285 sqrtdel= 1.0000 -0.88175 47 -1 0.70 0.50 ag i d9 5s9s ag i d9 5s7p 2.970772 ( 9s//r1// 7p)= -2.97077 a0 0.2426 2.941829 0.158 0.333 sqrtdel= 1.0000 -2.97077 47 -1 0.70 0.50 ag i d9 5s9s ag i d9 5s8p 25.892861 ( 9s//r1// 8p)= -25.89286 a0 0.8343 223.480086 0.513 0.672 sqrtdel= 1.0000 -25.89286 47 -1 0.70 0.50 ag i d9 5s9s ag i d9 5s9p -38.296349 ( 9s//r1// 9p)= 38.29635 a0 -0.9400 488.870119-0.744-0.898 sqrtdel= 1.0000 38.29635 47 -1 0.70 0.50 ag i d9 5s9s ag i d8 5s2 5p 0.000000 ( //r1// )= 0.00000 a0 0.0000 0.000000 0.000 0.000 sqrtdel= 1.0000 0.00000 47 -1 0.70 0.50 ag i d9 5s9s ag i d10 4f 0.000000 ( //r1// )= 0.00000 a0 0.0000 0.000000 0.000 0.000 sqrtdel= 1.0000 0.00000 47 -1 0.70 0.50 ag i d9 5s9s ag i d10 5f 0.000000 ( //r1// )= 0.00000 a0 0.0000 0.000000 0.000 0.000 sqrtdel= 1.0000 0.00000 47 -1 0.70 0.50 ag i d9 5s9s ag i d10 6f 0.000000 ( //r1// )= 0.00000 a0 0.0000 0.000000 0.000 0.000 sqrtdel= 1.0000 0.00000 47 -1 0.70 0.50 ag i d9 5s9s ag i d10 7f 0.000000 ( //r1// )= 0.00000 a0 0.0000 0.000000 0.000 0.000 sqrtdel= 1.0000 0.00000 47 -1 0.70 0.50 ag i d9 5s9s ag i d10 8f 0.000000 ( //r1// )= 0.00000 a0 0.0000 0.000000 0.000 0.000 sqrtdel= 1.0000 0.00000 47 -1 0.70 0.50 ag i d9 5s9s ag i d10 9f 0.000000 ( //r1// )= 0.00000 a0 0.0000 0.000000 0.000 0.000 sqrtdel= 1.0000 0.00000 47 -1 0.70 0.50 ag i d9 5s9s ag i d9 5s4f 0.000000 ( //r1// )= 0.00000 a0 0.0000 0.000000 0.000 0.000 sqrtdel= 1.0000 0.00000 47 -1 0.70 0.50 ag i d9 5s9s ag i d9 5s5f 0.000000 ( //r1// )= 0.00000 a0 0.0000 0.000000 0.000 0.000 sqrtdel= 1.0000 0.00000 47 -1 0.70 0.50 ag i d9 5s9s ag i d9 5s6f 0.000000 ( //r1// )= 0.00000 a0 0.0000 0.000000 0.000 0.000 sqrtdel= 1.0000 0.00000 47 -1 0.70 0.50 ag i d9 5s9s ag i d9 5s7f 0.000000 ( //r1// )= 0.00000 a0 0.0000 0.000000 0.000 0.000 sqrtdel= 1.0000 0.00000 47 -1 0.70 0.50 ag i d9 5s9s ag i d9 5s8f 0.000000 ( //r1// )= 0.00000 a0 0.0000 0.000000 0.000 0.000 sqrtdel= 1.0000 0.00000 47 -1 0.70 0.50 ag i d9 5s9s ag i d9 5s9f 0.000000 ( //r1// )= 0.00000 a0 0.0000 0.000000 0.000 0.000 sqrtdel= 1.0000 0.00000 47 -1 0.70 0.50 ag i d9 5s9s ag i d8 5s2 4f 0.000000 ( //r1// )= 0.00000 a0 0.0000 0.000000 0.000 0.000 sqrtdel= 1.0000 0.00000 47 -1 0.70 0.50 ag i d9 5s9s ag i d10 6h 0.000000 ( //r1// )= 0.00000 a0 0.0000 0.000000 0.000 0.000 sqrtdel= 1.0000 0.00000 47 -1 0.70 0.50 ag i d9 5s9s ag i d10 7h 0.000000 ( //r1// )= 0.00000 a0 0.0000 0.000000 0.000 0.000 sqrtdel= 1.0000 0.00000 47 -1 0.70 0.50 ag i d9 5s9s ag i d10 8h 0.000000 ( //r1// )= 0.00000 a0 0.0000 0.000000 0.000 0.000 sqrtdel= 1.0000 0.00000 47 -1 0.70 0.50 ag i d9 5s9s ag i d10 9h 0.000000 ( //r1// )= 0.00000 a0 0.0000 0.000000 0.000 0.000 sqrtdel= 1.0000 0.00000 47 -1 0.70 0.50 ag i d9 5s9s ag i d9 5s6h 0.000000 ( //r1// )= 0.00000 a0 0.0000 0.000000 0.000 0.000 sqrtdel= 1.0000 0.00000 47 -1 0.70 0.50 ag i d9 5s9s ag i d9 5s7h 0.000000 ( //r1// )= 0.00000 a0 0.0000 0.000000 0.000 0.000 sqrtdel= 1.0000 0.00000 47 -1 0.70 0.50 ag i d9 5s9s ag i d9 5s8h 0.000000 ( //r1// )= 0.00000 a0 0.0000 0.000000 0.000 0.000 sqrtdel= 1.0000 0.00000 47 -1 0.70 0.50 ag i d9 5s9s ag i d9 5s9h 0.000000 ( //r1// )= 0.00000 a0 0.0000 0.000000 0.000 0.000 sqrtdel= 1.0000 0.00000 47 -1 0.70 0.50 ag i d9 5s9s ag i d10 8k 0.000000 ( //r1// )= 0.00000 a0 0.0000 0.000000 0.000 0.000 sqrtdel= 1.0000 0.00000 47 -1 0.70 0.50 ag i d9 5s9s ag i d10 9k 0.000000 ( //r1// )= 0.00000 a0 0.0000 0.000000 0.000 0.000 sqrtdel= 1.0000 0.00000 47 -1 0.70 0.50 ag i d9 5s9s ag i d9 5s8k 0.000000 ( //r1// )= 0.00000 a0 0.0000 0.000000 0.000 0.000 sqrtdel= 1.0000 0.00000 47 -1 0.70 0.50 ag i d9 5s9s ag i d9 5s9k 0.000000 ( //r1// )= 0.00000 a0 0.0000 0.000000 0.000 0.000 sqrtdel= 1.0000 0.00000 47 -1 0.70 0.50 ag i d8 5s2 6s ag i d10 5p 0.000000 ( //r1// )= 0.00000 a0 0.0000 0.000000 0.000 0.000 sqrtdel= 1.0000 0.00000 47 -1 0.70 0.50 ag i d8 5s2 6s ag i d10 6p 0.000000 ( //r1// )= 0.00000 a0 0.0000 0.000000 0.000 0.000 sqrtdel= 1.0000 0.00000 47 -1 0.70 0.50 ag i d8 5s2 6s ag i d10 7p 0.000000 ( //r1// )= 0.00000 a0 0.0000 0.000000 0.000 0.000 sqrtdel= 1.0000 0.00000 47 -1 0.70 0.50 ag i d8 5s2 6s ag i d10 8p 0.000000 ( //r1// )= 0.00000 a0 0.0000 0.000000 0.000 0.000 sqrtdel= 1.0000 0.00000 47 -1 0.70 0.50 ag i d8 5s2 6s ag i d10 9p 0.000000 ( //r1// )= 0.00000 a0 0.0000 0.000000 0.000 0.000 sqrtdel= 1.0000 0.00000 47 -1 0.70 0.50 ag i d8 5s2 6s ag i d9 5s5p 0.000000 ( //r1// )= 0.00000 a0 0.0000 0.000000 0.000 0.000 sqrtdel= 1.0000 0.00000 47 -1 0.70 0.50 ag i d8 5s2 6s ag i d9 5s6p 0.000000 ( //r1// )= 0.00000 a0 0.0000 0.000000 0.000 0.000 sqrtdel= 1.0000 0.00000 47 -1 0.70 0.50 ag i d8 5s2 6s ag i d9 5s7p 0.000000 ( //r1// )= 0.00000 a0 0.0000 0.000000 0.000 0.000 sqrtdel= 1.0000 0.00000 47 -1 0.70 0.50 ag i d8 5s2 6s ag i d9 5s8p 0.000000 ( //r1// )= 0.00000 a0 0.0000 0.000000 0.000 0.000 sqrtdel= 1.0000 0.00000 47 -1 0.70 0.50 ag i d8 5s2 6s ag i d9 5s9p 0.000000 ( //r1// )= 0.00000 a0 0.0000 0.000000 0.000 0.000 sqrtdel= 1.0000 0.00000 47 -1 0.70 0.50 ag i d8 5s2 6s ag i d8 5s2 5p 2.548515 ( 6s//r1// 5p)= -2.54852 a0 0.8201 2.164977 0.303 0.549 sqrtdel= 1.0000 -2.54852 47 -1 0.70 0.50 ag i d8 5s2 6s ag i d10 4f 0.000000 ( //r1// )= 0.00000 a0 0.0000 0.000000 0.000 0.000 sqrtdel= 1.0000 0.00000 47 -1 0.70 0.50 ag i d8 5s2 6s ag i d10 5f 0.000000 ( //r1// )= 0.00000 a0 0.0000 0.000000 0.000 0.000 sqrtdel= 1.0000 0.00000 47 -1 0.70 0.50 ag i d8 5s2 6s ag i d10 6f 0.000000 ( //r1// )= 0.00000 a0 0.0000 0.000000 0.000 0.000 sqrtdel= 1.0000 0.00000 47 -1 0.70 0.50 ag i d8 5s2 6s ag i d10 7f 0.000000 ( //r1// )= 0.00000 a0 0.0000 0.000000 0.000 0.000 sqrtdel= 1.0000 0.00000 47 -1 0.70 0.50 ag i d8 5s2 6s ag i d10 8f 0.000000 ( //r1// )= 0.00000 a0 0.0000 0.000000 0.000 0.000 sqrtdel= 1.0000 0.00000 47 -1 0.70 0.50 ag i d8 5s2 6s ag i d10 9f 0.000000 ( //r1// )= 0.00000 a0 0.0000 0.000000 0.000 0.000 sqrtdel= 1.0000 0.00000 47 -1 0.70 0.50 ag i d8 5s2 6s ag i d9 5s4f 0.000000 ( //r1// )= 0.00000 a0 0.0000 0.000000 0.000 0.000 sqrtdel= 1.0000 0.00000 47 -1 0.70 0.50 ag i d8 5s2 6s ag i d9 5s5f 0.000000 ( //r1// )= 0.00000 a0 0.0000 0.000000 0.000 0.000 sqrtdel= 1.0000 0.00000 47 -1 0.70 0.50 ag i d8 5s2 6s ag i d9 5s6f 0.000000 ( //r1// )= 0.00000 a0 0.0000 0.000000 0.000 0.000 sqrtdel= 1.0000 0.00000 47 -1 0.70 0.50 ag i d8 5s2 6s ag i d9 5s7f 0.000000 ( //r1// )= 0.00000 a0 0.0000 0.000000 0.000 0.000 sqrtdel= 1.0000 0.00000 47 -1 0.70 0.50 ag i d8 5s2 6s ag i d9 5s8f 0.000000 ( //r1// )= 0.00000 a0 0.0000 0.000000 0.000 0.000 sqrtdel= 1.0000 0.00000 47 -1 0.70 0.50 ag i d8 5s2 6s ag i d9 5s9f 0.000000 ( //r1// )= 0.00000 a0 0.0000 0.000000 0.000 0.000 sqrtdel= 1.0000 0.00000 47 -1 0.70 0.50 ag i d8 5s2 6s ag i d8 5s2 4f 0.000000 ( //r1// )= 0.00000 a0 0.0000 0.000000 0.000 0.000 sqrtdel= 1.0000 0.00000 47 -1 0.70 0.50 ag i d8 5s2 6s ag i d10 6h 0.000000 ( //r1// )= 0.00000 a0 0.0000 0.000000 0.000 0.000 sqrtdel= 1.0000 0.00000 47 -1 0.70 0.50 ag i d8 5s2 6s ag i d10 7h 0.000000 ( //r1// )= 0.00000 a0 0.0000 0.000000 0.000 0.000 sqrtdel= 1.0000 0.00000 47 -1 0.70 0.50 ag i d8 5s2 6s ag i d10 8h 0.000000 ( //r1// )= 0.00000 a0 0.0000 0.000000 0.000 0.000 sqrtdel= 1.0000 0.00000 47 -1 0.70 0.50 ag i d8 5s2 6s ag i d10 9h 0.000000 ( //r1// )= 0.00000 a0 0.0000 0.000000 0.000 0.000 sqrtdel= 1.0000 0.00000 47 -1 0.70 0.50 ag i d8 5s2 6s ag i d9 5s6h 0.000000 ( //r1// )= 0.00000 a0 0.0000 0.000000 0.000 0.000 sqrtdel= 1.0000 0.00000 47 -1 0.70 0.50 ag i d8 5s2 6s ag i d9 5s7h 0.000000 ( //r1// )= 0.00000 a0 0.0000 0.000000 0.000 0.000 sqrtdel= 1.0000 0.00000 47 -1 0.70 0.50 ag i d8 5s2 6s ag i d9 5s8h 0.000000 ( //r1// )= 0.00000 a0 0.0000 0.000000 0.000 0.000 sqrtdel= 1.0000 0.00000 47 -1 0.70 0.50 ag i d8 5s2 6s ag i d9 5s9h 0.000000 ( //r1// )= 0.00000 a0 0.0000 0.000000 0.000 0.000 sqrtdel= 1.0000 0.00000 47 -1 0.70 0.50 ag i d8 5s2 6s ag i d10 8k 0.000000 ( //r1// )= 0.00000 a0 0.0000 0.000000 0.000 0.000 sqrtdel= 1.0000 0.00000 47 -1 0.70 0.50 ag i d8 5s2 6s ag i d10 9k 0.000000 ( //r1// )= 0.00000 a0 0.0000 0.000000 0.000 0.000 sqrtdel= 1.0000 0.00000 47 -1 0.70 0.50 ag i d8 5s2 6s ag i d9 5s8k 0.000000 ( //r1// )= 0.00000 a0 0.0000 0.000000 0.000 0.000 sqrtdel= 1.0000 0.00000 47 -1 0.70 0.50 ag i d8 5s2 6s ag i d9 5s9k 0.000000 ( //r1// )= 0.00000 a0 0.0000 0.000000 0.000 0.000 sqrtdel= 1.0000 0.00000 47 -1 0.70 0.50 ag i d10 5d ag i d10 5p -4.323888 ( 5d//r1// 5p)= -6.11490 a0 -0.9986 1.246400-0.605-0.994 sqrtdel= 1.0000 -6.11490 47 -1 0.70 0.50 ag i d10 5d ag i d10 6p 10.449226 ( 5d//r1// 6p)= 14.77744 a0 0.9606 7.279089 0.801 0.878 sqrtdel= 1.0000 14.77744 47 -1 0.70 0.50 ag i d10 5d ag i d10 7p -1.685574 ( 5d//r1// 7p)= -2.38376 a0 -0.2323 0.189411 0.053 0.101 sqrtdel= 1.0000 -2.38376 47 -1 0.70 0.50 ag i d10 5d ag i d10 8p -0.592407 ( 5d//r1// 8p)= -0.83779 a0 -0.1299 0.023396 0.031 0.091 sqrtdel= 1.0000 -0.83779 47 -1 0.70 0.50 ag i d10 5d ag i d10 9p -0.332137 ( 5d//r1// 9p)= -0.46971 a0 -0.1001 0.007354 0.022 0.085 sqrtdel= 1.0000 -0.46971 47 -1 0.70 0.50 ag i d10 5d ag i d9 5s5p 0.000000 ( //r1// )= 0.00000 a0 0.0000 0.000000 0.000 0.000 sqrtdel= 1.0000 0.00000 47 -1 0.70 0.50 ag i d10 5d ag i d9 5s6p 0.000000 ( //r1// )= 0.00000 a0 0.0000 0.000000 0.000 0.000 sqrtdel= 1.0000 0.00000 47 -1 0.70 0.50 ag i d10 5d ag i d9 5s7p 0.000000 ( //r1// )= 0.00000 a0 0.0000 0.000000 0.000 0.000 sqrtdel= 1.0000 0.00000 47 -1 0.70 0.50 ag i d10 5d ag i d9 5s8p 0.000000 ( //r1// )= 0.00000 a0 0.0000 0.000000 0.000 0.000 sqrtdel= 1.0000 0.00000 47 -1 0.70 0.50 ag i d10 5d ag i d9 5s9p 0.000000 ( //r1// )= 0.00000 a0 0.0000 0.000000 0.000 0.000 sqrtdel= 1.0000 0.00000 47 -1 0.70 0.50 ag i d10 5d ag i d8 5s2 5p 0.000000 ( //r1// )= 0.00000 a0 0.0000 0.000000 0.000 0.000 sqrtdel= 1.0000 0.00000 47 -1 0.70 0.50 ag i d10 5d ag i d10 4f 10.451207 ( 5d//r1// 4f)= -18.10202 a0 1.0000 3.120792 0.758 1.000 sqrtdel= 1.0000 -18.10202 47 -1 0.70 0.50 ag i d10 5d ag i d10 5f 3.296069 ( 5d//r1// 5f)= -5.70896 a0 0.5676 0.310402 0.354 0.791 sqrtdel= 1.0000 -5.70896 47 -1 0.70 0.50 ag i d10 5d ag i d10 6f 1.762603 ( 5d//r1// 6f)= -3.05292 a0 0.4314 0.088765 0.224 0.696 sqrtdel= 1.0000 -3.05292 47 -1 0.70 0.50 ag i d10 5d ag i d10 7f 1.154775 ( 5d//r1// 7f)= -2.00013 a0 0.3696 0.038100 0.160 0.647 sqrtdel= 1.0000 -2.00013 47 -1 0.70 0.50 ag i d10 5d ag i d10 8f 0.840247 ( 5d//r1// 8f)= -1.45535 a0 0.3359 0.020172 0.123 0.618 sqrtdel= 1.0000 -1.45535 47 -1 0.70 0.50 ag i d10 5d ag i d10 9f 0.651291 ( 5d//r1// 9f)= -1.12807 a0 0.3148 0.012119 0.099 0.599 sqrtdel= 1.0000 -1.12807 47 -1 0.70 0.50 ag i d10 5d ag i d9 5s4f 0.000000 ( //r1// )= 0.00000 a0 0.0000 0.000000 0.000 0.000 sqrtdel= 1.0000 0.00000 47 -1 0.70 0.50 ag i d10 5d ag i d9 5s5f 0.000000 ( //r1// )= 0.00000 a0 0.0000 0.000000 0.000 0.000 sqrtdel= 1.0000 0.00000 47 -1 0.70 0.50 ag i d10 5d ag i d9 5s6f 0.000000 ( //r1// )= 0.00000 a0 0.0000 0.000000 0.000 0.000 sqrtdel= 1.0000 0.00000 47 -1 0.70 0.50 ag i d10 5d ag i d9 5s7f 0.000000 ( //r1// )= 0.00000 a0 0.0000 0.000000 0.000 0.000 sqrtdel= 1.0000 0.00000 47 -1 0.70 0.50 ag i d10 5d ag i d9 5s8f 0.000000 ( //r1// )= 0.00000 a0 0.0000 0.000000 0.000 0.000 sqrtdel= 1.0000 0.00000 47 -1 0.70 0.50 ag i d10 5d ag i d9 5s9f 0.000000 ( //r1// )= 0.00000 a0 0.0000 0.000000 0.000 0.000 sqrtdel= 1.0000 0.00000 47 -1 0.70 0.50 ag i d10 5d ag i d8 5s2 4f 0.000000 ( //r1// )= 0.00000 a0 0.0000 0.000000 0.000 0.000 sqrtdel= 1.0000 0.00000 47 -1 0.70 0.50 ag i d10 5d ag i d10 6h 0.000000 ( //r1// )= 0.00000 a0 0.0000 0.000000 0.000 0.000 sqrtdel= 1.0000 0.00000 47 -1 0.70 0.50 ag i d10 5d ag i d10 7h 0.000000 ( //r1// )= 0.00000 a0 0.0000 0.000000 0.000 0.000 sqrtdel= 1.0000 0.00000 47 -1 0.70 0.50 ag i d10 5d ag i d10 8h 0.000000 ( //r1// )= 0.00000 a0 0.0000 0.000000 0.000 0.000 sqrtdel= 1.0000 0.00000 47 -1 0.70 0.50 ag i d10 5d ag i d10 9h 0.000000 ( //r1// )= 0.00000 a0 0.0000 0.000000 0.000 0.000 sqrtdel= 1.0000 0.00000 47 -1 0.70 0.50 ag i d10 5d ag i d9 5s6h 0.000000 ( //r1// )= 0.00000 a0 0.0000 0.000000 0.000 0.000 sqrtdel= 1.0000 0.00000 47 -1 0.70 0.50 ag i d10 5d ag i d9 5s7h 0.000000 ( //r1// )= 0.00000 a0 0.0000 0.000000 0.000 0.000 sqrtdel= 1.0000 0.00000 47 -1 0.70 0.50 ag i d10 5d ag i d9 5s8h 0.000000 ( //r1// )= 0.00000 a0 0.0000 0.000000 0.000 0.000 sqrtdel= 1.0000 0.00000 47 -1 0.70 0.50 ag i d10 5d ag i d9 5s9h 0.000000 ( //r1// )= 0.00000 a0 0.0000 0.000000 0.000 0.000 sqrtdel= 1.0000 0.00000 47 -1 0.70 0.50 ag i d10 5d ag i d10 8k 0.000000 ( //r1// )= 0.00000 a0 0.0000 0.000000 0.000 0.000 sqrtdel= 1.0000 0.00000 47 -1 0.70 0.50 ag i d10 5d ag i d10 9k 0.000000 ( //r1// )= 0.00000 a0 0.0000 0.000000 0.000 0.000 sqrtdel= 1.0000 0.00000 47 -1 0.70 0.50 ag i d10 5d ag i d9 5s8k 0.000000 ( //r1// )= 0.00000 a0 0.0000 0.000000 0.000 0.000 sqrtdel= 1.0000 0.00000 47 -1 0.70 0.50 ag i d10 5d ag i d9 5s9k 0.000000 ( //r1// )= 0.00000 a0 0.0000 0.000000 0.000 0.000 sqrtdel= 1.0000 0.00000 47 -1 0.70 0.50 ag i d10 6d ag i d10 5p -1.708323 ( 6d//r1// 5p)= -2.41593 a0 -0.7679 0.194558-0.309-0.901 sqrtdel= 1.0000 -2.41593 47 -1 0.70 0.50 ag i d10 6d ag i d10 6p -6.761717 ( 6d//r1// 6p)= -9.56251 a0 -0.7226 3.048054-0.305-0.510 sqrtdel= 1.0000 -9.56251 47 -1 0.70 0.50 ag i d10 6d ag i d10 7p 21.175923 ( 6d//r1// 7p)= 29.94728 a0 0.9885 29.894648 0.899 0.949 sqrtdel= 1.0000 29.94728 47 -1 0.70 0.50 ag i d10 6d ag i d10 8p -3.776564 ( 6d//r1// 8p)= -5.34087 a0 -0.2456 0.950829 0.052 0.085 sqrtdel= 1.0000 -5.34087 47 -1 0.70 0.50 ag i d10 6d ag i d10 9p -1.339300 ( 6d//r1// 9p)= -1.89406 a0 -0.1309 0.119582 0.033 0.077 sqrtdel= 1.0000 -1.89406 47 -1 0.70 0.50 ag i d10 6d ag i d9 5s5p 0.000000 ( //r1// )= 0.00000 a0 0.0000 0.000000 0.000 0.000 sqrtdel= 1.0000 0.00000 47 -1 0.70 0.50 ag i d10 6d ag i d9 5s6p 0.000000 ( //r1// )= 0.00000 a0 0.0000 0.000000 0.000 0.000 sqrtdel= 1.0000 0.00000 47 -1 0.70 0.50 ag i d10 6d ag i d9 5s7p 0.000000 ( //r1// )= 0.00000 a0 0.0000 0.000000 0.000 0.000 sqrtdel= 1.0000 0.00000 47 -1 0.70 0.50 ag i d10 6d ag i d9 5s8p 0.000000 ( //r1// )= 0.00000 a0 0.0000 0.000000 0.000 0.000 sqrtdel= 1.0000 0.00000 47 -1 0.70 0.50 ag i d10 6d ag i d9 5s9p 0.000000 ( //r1// )= 0.00000 a0 0.0000 0.000000 0.000 0.000 sqrtdel= 1.0000 0.00000 47 -1 0.70 0.50 ag i d10 6d ag i d8 5s2 5p 0.000000 ( //r1// )= 0.00000 a0 0.0000 0.000000 0.000 0.000 sqrtdel= 1.0000 0.00000 47 -1 0.70 0.50 ag i d10 6d ag i d10 4f -15.766323 ( 6d//r1// 4f)= 27.30807 a0 -0.8980 7.102199-0.650-0.751 sqrtdel= 1.0000 27.30807 47 -1 0.70 0.50 ag i d10 6d ag i d10 5f 14.504714 ( 6d//r1// 5f)= -25.12290 a0 0.8308 6.011049 0.493 0.728 sqrtdel= 1.0000 -25.12290 47 -1 0.70 0.50 ag i d10 6d ag i d10 6f 5.212521 ( 6d//r1// 6f)= -9.02835 a0 0.4682 0.776297 0.276 0.609 sqrtdel= 1.0000 -9.02835 47 -1 0.70 0.50 ag i d10 6d ag i d10 7f 2.918868 ( 6d//r1// 7f)= -5.05563 a0 0.3520 0.243423 0.188 0.546 sqrtdel= 1.0000 -5.05563 47 -1 0.70 0.50 ag i d10 6d ag i d10 8f 1.956418 ( 6d//r1// 8f)= -3.38862 a0 0.2974 0.109359 0.141 0.510 sqrtdel= 1.0000 -3.38862 47 -1 0.70 0.50 ag i d10 6d ag i d10 9f 1.443360 ( 6d//r1// 9f)= -2.49997 a0 0.2667 0.059523 0.111 0.487 sqrtdel= 1.0000 -2.49997 47 -1 0.70 0.50 ag i d10 6d ag i d9 5s4f 0.000000 ( //r1// )= 0.00000 a0 0.0000 0.000000 0.000 0.000 sqrtdel= 1.0000 0.00000 47 -1 0.70 0.50 ag i d10 6d ag i d9 5s5f 0.000000 ( //r1// )= 0.00000 a0 0.0000 0.000000 0.000 0.000 sqrtdel= 1.0000 0.00000 47 -1 0.70 0.50 ag i d10 6d ag i d9 5s6f 0.000000 ( //r1// )= 0.00000 a0 0.0000 0.000000 0.000 0.000 sqrtdel= 1.0000 0.00000 47 -1 0.70 0.50 ag i d10 6d ag i d9 5s7f 0.000000 ( //r1// )= 0.00000 a0 0.0000 0.000000 0.000 0.000 sqrtdel= 1.0000 0.00000 47 -1 0.70 0.50 ag i d10 6d ag i d9 5s8f 0.000000 ( //r1// )= 0.00000 a0 0.0000 0.000000 0.000 0.000 sqrtdel= 1.0000 0.00000 47 -1 0.70 0.50 ag i d10 6d ag i d9 5s9f 0.000000 ( //r1// )= 0.00000 a0 0.0000 0.000000 0.000 0.000 sqrtdel= 1.0000 0.00000 47 -1 0.70 0.50 ag i d10 6d ag i d8 5s2 4f 0.000000 ( //r1// )= 0.00000 a0 0.0000 0.000000 0.000 0.000 sqrtdel= 1.0000 0.00000 47 -1 0.70 0.50 ag i d10 6d ag i d10 6h 0.000000 ( //r1// )= 0.00000 a0 0.0000 0.000000 0.000 0.000 sqrtdel= 1.0000 0.00000 47 -1 0.70 0.50 ag i d10 6d ag i d10 7h 0.000000 ( //r1// )= 0.00000 a0 0.0000 0.000000 0.000 0.000 sqrtdel= 1.0000 0.00000 47 -1 0.70 0.50 ag i d10 6d ag i d10 8h 0.000000 ( //r1// )= 0.00000 a0 0.0000 0.000000 0.000 0.000 sqrtdel= 1.0000 0.00000 47 -1 0.70 0.50 ag i d10 6d ag i d10 9h 0.000000 ( //r1// )= 0.00000 a0 0.0000 0.000000 0.000 0.000 sqrtdel= 1.0000 0.00000 47 -1 0.70 0.50 ag i d10 6d ag i d9 5s6h 0.000000 ( //r1// )= 0.00000 a0 0.0000 0.000000 0.000 0.000 sqrtdel= 1.0000 0.00000 47 -1 0.70 0.50 ag i d10 6d ag i d9 5s7h 0.000000 ( //r1// )= 0.00000 a0 0.0000 0.000000 0.000 0.000 sqrtdel= 1.0000 0.00000 47 -1 0.70 0.50 ag i d10 6d ag i d9 5s8h 0.000000 ( //r1// )= 0.00000 a0 0.0000 0.000000 0.000 0.000 sqrtdel= 1.0000 0.00000 47 -1 0.70 0.50 ag i d10 6d ag i d9 5s9h 0.000000 ( //r1// )= 0.00000 a0 0.0000 0.000000 0.000 0.000 sqrtdel= 1.0000 0.00000 47 -1 0.70 0.50 ag i d10 6d ag i d10 8k 0.000000 ( //r1// )= 0.00000 a0 0.0000 0.000000 0.000 0.000 sqrtdel= 1.0000 0.00000 47 -1 0.70 0.50 ag i d10 6d ag i d10 9k 0.000000 ( //r1// )= 0.00000 a0 0.0000 0.000000 0.000 0.000 sqrtdel= 1.0000 0.00000 47 -1 0.70 0.50 ag i d10 6d ag i d9 5s8k 0.000000 ( //r1// )= 0.00000 a0 0.0000 0.000000 0.000 0.000 sqrtdel= 1.0000 0.00000 47 -1 0.70 0.50 ag i d10 6d ag i d9 5s9k 0.000000 ( //r1// )= 0.00000 a0 0.0000 0.000000 0.000 0.000 sqrtdel= 1.0000 0.00000 47 -1 0.70 0.50 ag i d10 7d ag i d10 5p -1.002596 ( 7d//r1// 5p)= -1.41788 a0 -0.6678 0.067013-0.200-0.849 sqrtdel= 1.0000 -1.41788 47 -1 0.70 0.50 ag i d10 7d ag i d10 6p -2.834871 ( 7d//r1// 6p)= -4.00911 a0 -0.5024 0.535766-0.186-0.492 sqrtdel= 1.0000 -4.00911 47 -1 0.70 0.50 ag i d10 7d ag i d10 7p -9.911502 ( 7d//r1// 7p)= -14.01698 a0 -0.5795 6.549192-0.198-0.314 sqrtdel= 1.0000 -14.01698 47 -1 0.70 0.50 ag i d10 7d ag i d10 8p 34.748067 ( 7d//r1// 8p)= 49.14119 a0 0.9951 80.495209 0.938 0.973 sqrtdel= 1.0000 49.14119 47 -1 0.70 0.50 ag i d10 7d ag i d10 9p -6.526891 ( 7d//r1// 9p)= -9.23042 a0 -0.2508 2.840021 0.048 0.072 sqrtdel= 1.0000 -9.23042 47 -1 0.70 0.50 ag i d10 7d ag i d9 5s5p 0.000000 ( //r1// )= 0.00000 a0 0.0000 0.000000 0.000 0.000 sqrtdel= 1.0000 0.00000 47 -1 0.70 0.50 ag i d10 7d ag i d9 5s6p 0.000000 ( //r1// )= 0.00000 a0 0.0000 0.000000 0.000 0.000 sqrtdel= 1.0000 0.00000 47 -1 0.70 0.50 ag i d10 7d ag i d9 5s7p 0.000000 ( //r1// )= 0.00000 a0 0.0000 0.000000 0.000 0.000 sqrtdel= 1.0000 0.00000 47 -1 0.70 0.50 ag i d10 7d ag i d9 5s8p 0.000000 ( //r1// )= 0.00000 a0 0.0000 0.000000 0.000 0.000 sqrtdel= 1.0000 0.00000 47 -1 0.70 0.50 ag i d10 7d ag i d9 5s9p 0.000000 ( //r1// )= 0.00000 a0 0.0000 0.000000 0.000 0.000 sqrtdel= 1.0000 0.00000 47 -1 0.70 0.50 ag i d10 7d ag i d8 5s2 5p 0.000000 ( //r1// )= 0.00000 a0 0.0000 0.000000 0.000 0.000 sqrtdel= 1.0000 0.00000 47 -1 0.70 0.50 ag i d10 7d ag i d10 4f 1.523652 ( 7d//r1// 4f)= -2.63904 a0 0.1272 0.066329-0.059-0.107 sqrtdel= 1.0000 -2.63904 47 -1 0.70 0.50 ag i d10 7d ag i d10 5f -29.842946 ( 7d//r1// 5f)= 51.68950 a0 -0.9615 25.445755-0.790-0.873 sqrtdel= 1.0000 51.68950 47 -1 0.70 0.50 ag i d10 7d ag i d10 6f 19.204460 ( 7d//r1// 6f)= -33.26310 a0 0.7017 10.537465 0.359 0.534 sqrtdel= 1.0000 -33.26310 47 -1 0.70 0.50 ag i d10 7d ag i d10 7f 7.176820 ( 7d//r1// 7f)= -12.43062 a0 0.3870 1.471621 0.216 0.458 sqrtdel= 1.0000 -12.43062 47 -1 0.70 0.50 ag i d10 7d ag i d10 8f 4.089073 ( 7d//r1// 8f)= -7.08248 a0 0.2869 0.477729 0.153 0.415 sqrtdel= 1.0000 -7.08248 47 -1 0.70 0.50 ag i d10 7d ag i d10 9f 2.767267 ( 7d//r1// 9f)= -4.79305 a0 0.2388 0.218793 0.118 0.389 sqrtdel= 1.0000 -4.79305 47 -1 0.70 0.50 ag i d10 7d ag i d9 5s4f 0.000000 ( //r1// )= 0.00000 a0 0.0000 0.000000 0.000 0.000 sqrtdel= 1.0000 0.00000 47 -1 0.70 0.50 ag i d10 7d ag i d9 5s5f 0.000000 ( //r1// )= 0.00000 a0 0.0000 0.000000 0.000 0.000 sqrtdel= 1.0000 0.00000 47 -1 0.70 0.50 ag i d10 7d ag i d9 5s6f 0.000000 ( //r1// )= 0.00000 a0 0.0000 0.000000 0.000 0.000 sqrtdel= 1.0000 0.00000 47 -1 0.70 0.50 ag i d10 7d ag i d9 5s7f 0.000000 ( //r1// )= 0.00000 a0 0.0000 0.000000 0.000 0.000 sqrtdel= 1.0000 0.00000 47 -1 0.70 0.50 ag i d10 7d ag i d9 5s8f 0.000000 ( //r1// )= 0.00000 a0 0.0000 0.000000 0.000 0.000 sqrtdel= 1.0000 0.00000 47 -1 0.70 0.50 ag i d10 7d ag i d9 5s9f 0.000000 ( //r1// )= 0.00000 a0 0.0000 0.000000 0.000 0.000 sqrtdel= 1.0000 0.00000 47 -1 0.70 0.50 ag i d10 7d ag i d8 5s2 4f 0.000000 ( //r1// )= 0.00000 a0 0.0000 0.000000 0.000 0.000 sqrtdel= 1.0000 0.00000 47 -1 0.70 0.50 ag i d10 7d ag i d10 6h 0.000000 ( //r1// )= 0.00000 a0 0.0000 0.000000 0.000 0.000 sqrtdel= 1.0000 0.00000 47 -1 0.70 0.50 ag i d10 7d ag i d10 7h 0.000000 ( //r1// )= 0.00000 a0 0.0000 0.000000 0.000 0.000 sqrtdel= 1.0000 0.00000 47 -1 0.70 0.50 ag i d10 7d ag i d10 8h 0.000000 ( //r1// )= 0.00000 a0 0.0000 0.000000 0.000 0.000 sqrtdel= 1.0000 0.00000 47 -1 0.70 0.50 ag i d10 7d ag i d10 9h 0.000000 ( //r1// )= 0.00000 a0 0.0000 0.000000 0.000 0.000 sqrtdel= 1.0000 0.00000 47 -1 0.70 0.50 ag i d10 7d ag i d9 5s6h 0.000000 ( //r1// )= 0.00000 a0 0.0000 0.000000 0.000 0.000 sqrtdel= 1.0000 0.00000 47 -1 0.70 0.50 ag i d10 7d ag i d9 5s7h 0.000000 ( //r1// )= 0.00000 a0 0.0000 0.000000 0.000 0.000 sqrtdel= 1.0000 0.00000 47 -1 0.70 0.50 ag i d10 7d ag i d9 5s8h 0.000000 ( //r1// )= 0.00000 a0 0.0000 0.000000 0.000 0.000 sqrtdel= 1.0000 0.00000 47 -1 0.70 0.50 ag i d10 7d ag i d9 5s9h 0.000000 ( //r1// )= 0.00000 a0 0.0000 0.000000 0.000 0.000 sqrtdel= 1.0000 0.00000 47 -1 0.70 0.50 ag i d10 7d ag i d10 8k 0.000000 ( //r1// )= 0.00000 a0 0.0000 0.000000 0.000 0.000 sqrtdel= 1.0000 0.00000 47 -1 0.70 0.50 ag i d10 7d ag i d10 9k 0.000000 ( //r1// )= 0.00000 a0 0.0000 0.000000 0.000 0.000 sqrtdel= 1.0000 0.00000 47 -1 0.70 0.50 ag i d10 7d ag i d9 5s8k 0.000000 ( //r1// )= 0.00000 a0 0.0000 0.000000 0.000 0.000 sqrtdel= 1.0000 0.00000 47 -1 0.70 0.50 ag i d10 7d ag i d9 5s9k 0.000000 ( //r1// )= 0.00000 a0 0.0000 0.000000 0.000 0.000 sqrtdel= 1.0000 0.00000 47 -1 0.70 0.50 ag i d10 8d ag i d10 5p -0.688005 ( 8d//r1// 5p)= -0.97299 a0 -0.6187 0.031557-0.145-0.822 sqrtdel= 1.0000 -0.97299 47 -1 0.70 0.50 ag i d10 8d ag i d10 6p -1.700914 ( 8d//r1// 6p)= -2.40546 a0 -0.4174 0.192874-0.131-0.472 sqrtdel= 1.0000 -2.40546 47 -1 0.70 0.50 ag i d10 8d ag i d10 7p -4.158863 ( 8d//r1// 7p)= -5.88152 a0 -0.3748 1.153076-0.130-0.309 sqrtdel= 1.0000 -5.88152 47 -1 0.70 0.50 ag i d10 8d ag i d10 8p -13.683999 ( 8d//r1// 8p)= -19.35210 a0 -0.4995 12.483455-0.143-0.217 sqrtdel= 1.0000 -19.35210 47 -1 0.70 0.50 ag i d10 8d ag i d10 9p 51.271332 ( 8d//r1// 9p)= 72.50861 a0 0.9975 175.249964 0.959 0.983 sqrtdel= 1.0000 72.50861 47 -1 0.70 0.50 ag i d10 8d ag i d9 5s5p 0.000000 ( //r1// )= 0.00000 a0 0.0000 0.000000 0.000 0.000 sqrtdel= 1.0000 0.00000 47 -1 0.70 0.50 ag i d10 8d ag i d9 5s6p 0.000000 ( //r1// )= 0.00000 a0 0.0000 0.000000 0.000 0.000 sqrtdel= 1.0000 0.00000 47 -1 0.70 0.50 ag i d10 8d ag i d9 5s7p 0.000000 ( //r1// )= 0.00000 a0 0.0000 0.000000 0.000 0.000 sqrtdel= 1.0000 0.00000 47 -1 0.70 0.50 ag i d10 8d ag i d9 5s8p 0.000000 ( //r1// )= 0.00000 a0 0.0000 0.000000 0.000 0.000 sqrtdel= 1.0000 0.00000 47 -1 0.70 0.50 ag i d10 8d ag i d9 5s9p 0.000000 ( //r1// )= 0.00000 a0 0.0000 0.000000 0.000 0.000 sqrtdel= 1.0000 0.00000 47 -1 0.70 0.50 ag i d10 8d ag i d8 5s2 5p 0.000000 ( //r1// )= 0.00000 a0 0.0000 0.000000 0.000 0.000 sqrtdel= 1.0000 0.00000 47 -1 0.70 0.50 ag i d10 8d ag i d10 4f 0.530389 ( 8d//r1// 4f)= -0.91866 a0 0.0653 0.008037-0.030-0.079 sqrtdel= 1.0000 -0.91866 47 -1 0.70 0.50 ag i d10 8d ag i d10 5f 3.403037 ( 8d//r1// 5f)= -5.89423 a0 0.1509 0.330876-0.070-0.114 sqrtdel= 1.0000 -5.89423 47 -1 0.70 0.50 ag i d10 8d ag i d10 6f -46.573045 ( 8d//r1// 6f)= 80.66688 a0 -0.9809 61.972815-0.858-0.924 sqrtdel= 1.0000 80.66688 47 -1 0.70 0.50 ag i d10 8d ag i d10 7f 24.540589 ( 8d//r1// 7f)= -42.50555 a0 0.6147 17.206872 0.279 0.409 sqrtdel= 1.0000 -42.50555 47 -1 0.70 0.50 ag i d10 8d ag i d10 8f 9.293852 ( 8d//r1// 8f)= -16.09742 a0 0.3306 2.467877 0.174 0.354 sqrtdel= 1.0000 -16.09742 47 -1 0.70 0.50 ag i d10 8d ag i d10 9f 5.328377 ( 8d//r1// 9f)= -9.22902 a0 0.2409 0.811188 0.127 0.322 sqrtdel= 1.0000 -9.22902 47 -1 0.70 0.50 ag i d10 8d ag i d9 5s4f 0.000000 ( //r1// )= 0.00000 a0 0.0000 0.000000 0.000 0.000 sqrtdel= 1.0000 0.00000 47 -1 0.70 0.50 ag i d10 8d ag i d9 5s5f 0.000000 ( //r1// )= 0.00000 a0 0.0000 0.000000 0.000 0.000 sqrtdel= 1.0000 0.00000 47 -1 0.70 0.50 ag i d10 8d ag i d9 5s6f 0.000000 ( //r1// )= 0.00000 a0 0.0000 0.000000 0.000 0.000 sqrtdel= 1.0000 0.00000 47 -1 0.70 0.50 ag i d10 8d ag i d9 5s7f 0.000000 ( //r1// )= 0.00000 a0 0.0000 0.000000 0.000 0.000 sqrtdel= 1.0000 0.00000 47 -1 0.70 0.50 ag i d10 8d ag i d9 5s8f 0.000000 ( //r1// )= 0.00000 a0 0.0000 0.000000 0.000 0.000 sqrtdel= 1.0000 0.00000 47 -1 0.70 0.50 ag i d10 8d ag i d9 5s9f 0.000000 ( //r1// )= 0.00000 a0 0.0000 0.000000 0.000 0.000 sqrtdel= 1.0000 0.00000 47 -1 0.70 0.50 ag i d10 8d ag i d8 5s2 4f 0.000000 ( //r1// )= 0.00000 a0 0.0000 0.000000 0.000 0.000 sqrtdel= 1.0000 0.00000 47 -1 0.70 0.50 ag i d10 8d ag i d10 6h 0.000000 ( //r1// )= 0.00000 a0 0.0000 0.000000 0.000 0.000 sqrtdel= 1.0000 0.00000 47 -1 0.70 0.50 ag i d10 8d ag i d10 7h 0.000000 ( //r1// )= 0.00000 a0 0.0000 0.000000 0.000 0.000 sqrtdel= 1.0000 0.00000 47 -1 0.70 0.50 ag i d10 8d ag i d10 8h 0.000000 ( //r1// )= 0.00000 a0 0.0000 0.000000 0.000 0.000 sqrtdel= 1.0000 0.00000 47 -1 0.70 0.50 ag i d10 8d ag i d10 9h 0.000000 ( //r1// )= 0.00000 a0 0.0000 0.000000 0.000 0.000 sqrtdel= 1.0000 0.00000 47 -1 0.70 0.50 ag i d10 8d ag i d9 5s6h 0.000000 ( //r1// )= 0.00000 a0 0.0000 0.000000 0.000 0.000 sqrtdel= 1.0000 0.00000 47 -1 0.70 0.50 ag i d10 8d ag i d9 5s7h 0.000000 ( //r1// )= 0.00000 a0 0.0000 0.000000 0.000 0.000 sqrtdel= 1.0000 0.00000 47 -1 0.70 0.50 ag i d10 8d ag i d9 5s8h 0.000000 ( //r1// )= 0.00000 a0 0.0000 0.000000 0.000 0.000 sqrtdel= 1.0000 0.00000 47 -1 0.70 0.50 ag i d10 8d ag i d9 5s9h 0.000000 ( //r1// )= 0.00000 a0 0.0000 0.000000 0.000 0.000 sqrtdel= 1.0000 0.00000 47 -1 0.70 0.50 ag i d10 8d ag i d10 8k 0.000000 ( //r1// )= 0.00000 a0 0.0000 0.000000 0.000 0.000 sqrtdel= 1.0000 0.00000 47 -1 0.70 0.50 ag i d10 8d ag i d10 9k 0.000000 ( //r1// )= 0.00000 a0 0.0000 0.000000 0.000 0.000 sqrtdel= 1.0000 0.00000 47 -1 0.70 0.50 ag i d10 8d ag i d9 5s8k 0.000000 ( //r1// )= 0.00000 a0 0.0000 0.000000 0.000 0.000 sqrtdel= 1.0000 0.00000 47 -1 0.70 0.50 ag i d10 8d ag i d9 5s9k 0.000000 ( //r1// )= 0.00000 a0 0.0000 0.000000 0.000 0.000 sqrtdel= 1.0000 0.00000 47 -1 0.70 0.50 ag i d10 9d ag i d10 5p -0.513106 ( 9d//r1// 5p)= -0.72564 a0 -0.5899 0.017552-0.112-0.805 sqrtdel= 1.0000 -0.72564 47 -1 0.70 0.50 ag i d10 9d ag i d10 6p -1.184475 ( 9d//r1// 6p)= -1.67510 a0 -0.3756 0.093532-0.099-0.461 sqrtdel= 1.0000 -1.67510 47 -1 0.70 0.50 ag i d10 9d ag i d10 7p -2.500821 ( 9d//r1// 7p)= -3.53670 a0 -0.3008 0.416940-0.096-0.300 sqrtdel= 1.0000 -3.53670 47 -1 0.70 0.50 ag i d10 9d ag i d10 8p -5.685866 ( 9d//r1// 8p)= -8.04103 a0 -0.3054 2.155272-0.099-0.215 sqrtdel= 1.0000 -8.04103 47 -1 0.70 0.50 ag i d10 9d ag i d10 9p -18.087008 ( 9d//r1// 9p)= -25.57889 a0 -0.4505 21.809324-0.110-0.162 sqrtdel= 1.0000 -25.57889 47 -1 0.70 0.50 ag i d10 9d ag i d9 5s5p 0.000000 ( //r1// )= 0.00000 a0 0.0000 0.000000 0.000 0.000 sqrtdel= 1.0000 0.00000 47 -1 0.70 0.50 ag i d10 9d ag i d9 5s6p 0.000000 ( //r1// )= 0.00000 a0 0.0000 0.000000 0.000 0.000 sqrtdel= 1.0000 0.00000 47 -1 0.70 0.50 ag i d10 9d ag i d9 5s7p 0.000000 ( //r1// )= 0.00000 a0 0.0000 0.000000 0.000 0.000 sqrtdel= 1.0000 0.00000 47 -1 0.70 0.50 ag i d10 9d ag i d9 5s8p 0.000000 ( //r1// )= 0.00000 a0 0.0000 0.000000 0.000 0.000 sqrtdel= 1.0000 0.00000 47 -1 0.70 0.50 ag i d10 9d ag i d9 5s9p 0.000000 ( //r1// )= 0.00000 a0 0.0000 0.000000 0.000 0.000 sqrtdel= 1.0000 0.00000 47 -1 0.70 0.50 ag i d10 9d ag i d8 5s2 5p 0.000000 ( //r1// )= 0.00000 a0 0.0000 0.000000 0.000 0.000 sqrtdel= 1.0000 0.00000 47 -1 0.70 0.50 ag i d10 9d ag i d10 4f 0.292748 ( 9d//r1// 4f)= -0.50705 a0 0.0475 0.002449-0.020-0.067 sqrtdel= 1.0000 -0.50705 47 -1 0.70 0.50 ag i d10 9d ag i d10 5f 1.199718 ( 9d//r1// 5f)= -2.07797 a0 0.0756 0.041123-0.038-0.085 sqrtdel= 1.0000 -2.07797 47 -1 0.70 0.50 ag i d10 9d ag i d10 6f 5.926999 ( 9d//r1// 6f)= -10.26586 a0 0.1660 1.003695-0.073-0.110 sqrtdel= 1.0000 -10.26586 47 -1 0.70 0.50 ag i d10 9d ag i d10 7f -66.193358 ( 9d//r1// 7f)= 114.65026 a0 -0.9892 125.187446-0.898-0.951 sqrtdel= 1.0000 114.65026 47 -1 0.70 0.50 ag i d10 9d ag i d10 8f 30.476010 ( 9d//r1// 8f)= -52.78600 a0 0.5544 26.536776 0.226 0.325 sqrtdel= 1.0000 -52.78600 47 -1 0.70 0.50 ag i d10 9d ag i d10 9f 11.590105 ( 9d//r1// 9f)= -20.07465 a0 0.2908 3.838016 0.144 0.282 sqrtdel= 1.0000 -20.07465 47 -1 0.70 0.50 ag i d10 9d ag i d9 5s4f 0.000000 ( //r1// )= 0.00000 a0 0.0000 0.000000 0.000 0.000 sqrtdel= 1.0000 0.00000 47 -1 0.70 0.50 ag i d10 9d ag i d9 5s5f 0.000000 ( //r1// )= 0.00000 a0 0.0000 0.000000 0.000 0.000 sqrtdel= 1.0000 0.00000 47 -1 0.70 0.50 ag i d10 9d ag i d9 5s6f 0.000000 ( //r1// )= 0.00000 a0 0.0000 0.000000 0.000 0.000 sqrtdel= 1.0000 0.00000 47 -1 0.70 0.50 ag i d10 9d ag i d9 5s7f 0.000000 ( //r1// )= 0.00000 a0 0.0000 0.000000 0.000 0.000 sqrtdel= 1.0000 0.00000 47 -1 0.70 0.50 ag i d10 9d ag i d9 5s8f 0.000000 ( //r1// )= 0.00000 a0 0.0000 0.000000 0.000 0.000 sqrtdel= 1.0000 0.00000 47 -1 0.70 0.50 ag i d10 9d ag i d9 5s9f 0.000000 ( //r1// )= 0.00000 a0 0.0000 0.000000 0.000 0.000 sqrtdel= 1.0000 0.00000 47 -1 0.70 0.50 ag i d10 9d ag i d8 5s2 4f 0.000000 ( //r1// )= 0.00000 a0 0.0000 0.000000 0.000 0.000 sqrtdel= 1.0000 0.00000 47 -1 0.70 0.50 ag i d10 9d ag i d10 6h 0.000000 ( //r1// )= 0.00000 a0 0.0000 0.000000 0.000 0.000 sqrtdel= 1.0000 0.00000 47 -1 0.70 0.50 ag i d10 9d ag i d10 7h 0.000000 ( //r1// )= 0.00000 a0 0.0000 0.000000 0.000 0.000 sqrtdel= 1.0000 0.00000 47 -1 0.70 0.50 ag i d10 9d ag i d10 8h 0.000000 ( //r1// )= 0.00000 a0 0.0000 0.000000 0.000 0.000 sqrtdel= 1.0000 0.00000 47 -1 0.70 0.50 ag i d10 9d ag i d10 9h 0.000000 ( //r1// )= 0.00000 a0 0.0000 0.000000 0.000 0.000 sqrtdel= 1.0000 0.00000 47 -1 0.70 0.50 ag i d10 9d ag i d9 5s6h 0.000000 ( //r1// )= 0.00000 a0 0.0000 0.000000 0.000 0.000 sqrtdel= 1.0000 0.00000 47 -1 0.70 0.50 ag i d10 9d ag i d9 5s7h 0.000000 ( //r1// )= 0.00000 a0 0.0000 0.000000 0.000 0.000 sqrtdel= 1.0000 0.00000 47 -1 0.70 0.50 ag i d10 9d ag i d9 5s8h 0.000000 ( //r1// )= 0.00000 a0 0.0000 0.000000 0.000 0.000 sqrtdel= 1.0000 0.00000 47 -1 0.70 0.50 ag i d10 9d ag i d9 5s9h 0.000000 ( //r1// )= 0.00000 a0 0.0000 0.000000 0.000 0.000 sqrtdel= 1.0000 0.00000 47 -1 0.70 0.50 ag i d10 9d ag i d10 8k 0.000000 ( //r1// )= 0.00000 a0 0.0000 0.000000 0.000 0.000 sqrtdel= 1.0000 0.00000 47 -1 0.70 0.50 ag i d10 9d ag i d10 9k 0.000000 ( //r1// )= 0.00000 a0 0.0000 0.000000 0.000 0.000 sqrtdel= 1.0000 0.00000 47 -1 0.70 0.50 ag i d10 9d ag i d9 5s8k 0.000000 ( //r1// )= 0.00000 a0 0.0000 0.000000 0.000 0.000 sqrtdel= 1.0000 0.00000 47 -1 0.70 0.50 ag i d10 9d ag i d9 5s9k 0.000000 ( //r1// )= 0.00000 a0 0.0000 0.000000 0.000 0.000 sqrtdel= 1.0000 0.00000 47 -1 0.70 0.50 ag i d9 5s5d ag i d10 5p 0.000000 ( //r1// )= 0.00000 a0 0.0000 0.000000 0.000 0.000 sqrtdel= 1.0000 0.00000 47 -1 0.70 0.50 ag i d9 5s5d ag i d10 6p 0.000000 ( //r1// )= 0.00000 a0 0.0000 0.000000 0.000 0.000 sqrtdel= 1.0000 0.00000 47 -1 0.70 0.50 ag i d9 5s5d ag i d10 7p 0.000000 ( //r1// )= 0.00000 a0 0.0000 0.000000 0.000 0.000 sqrtdel= 1.0000 0.00000 47 -1 0.70 0.50 ag i d9 5s5d ag i d10 8p 0.000000 ( //r1// )= 0.00000 a0 0.0000 0.000000 0.000 0.000 sqrtdel= 1.0000 0.00000 47 -1 0.70 0.50 ag i d9 5s5d ag i d10 9p 0.000000 ( //r1// )= 0.00000 a0 0.0000 0.000000 0.000 0.000 sqrtdel= 1.0000 0.00000 47 -1 0.70 0.50 ag i d9 5s5d ag i d9 5s5p -3.550722 ( 5d//r1// 5p)= -5.02148 a0 -0.9986 0.840508-0.557-0.994 sqrtdel= 1.0000 -5.02148 47 -1 0.70 0.50 ag i d9 5s5d ag i d9 5s6p 10.157192 ( 5d//r1// 6p)= 14.36444 a0 0.9681 6.877904 0.831 0.896 sqrtdel= 1.0000 14.36444 47 -1 0.70 0.50 ag i d9 5s5d ag i d9 5s7p -1.945388 ( 5d//r1// 7p)= -2.75119 a0 -0.2736 0.252302 0.040 0.074 sqrtdel= 1.0000 -2.75119 47 -1 0.70 0.50 ag i d9 5s5d ag i d9 5s8p -0.649374 ( 5d//r1// 8p)= -0.91835 a0 -0.1472 0.028112 0.027 0.077 sqrtdel= 1.0000 -0.91835 47 -1 0.70 0.50 ag i d9 5s5d ag i d9 5s9p -0.357995 ( 5d//r1// 9p)= -0.50628 a0 -0.1121 0.008544 0.019 0.075 sqrtdel= 1.0000 -0.50628 47 -1 0.70 0.50 ag i d9 5s5d ag i d8 5s2 5p 0.000000 ( //r1// )= 0.00000 a0 0.0000 0.000000 0.000 0.000 sqrtdel= 1.0000 0.00000 47 -1 0.70 0.50 ag i d9 5s5d ag i d10 4f 0.000000 ( //r1// )= 0.00000 a0 0.0000 0.000000 0.000 0.000 sqrtdel= 1.0000 0.00000 47 -1 0.70 0.50 ag i d9 5s5d ag i d10 5f 0.000000 ( //r1// )= 0.00000 a0 0.0000 0.000000 0.000 0.000 sqrtdel= 1.0000 0.00000 47 -1 0.70 0.50 ag i d9 5s5d ag i d10 6f 0.000000 ( //r1// )= 0.00000 a0 0.0000 0.000000 0.000 0.000 sqrtdel= 1.0000 0.00000 47 -1 0.70 0.50 ag i d9 5s5d ag i d10 7f 0.000000 ( //r1// )= 0.00000 a0 0.0000 0.000000 0.000 0.000 sqrtdel= 1.0000 0.00000 47 -1 0.70 0.50 ag i d9 5s5d ag i d10 8f 0.000000 ( //r1// )= 0.00000 a0 0.0000 0.000000 0.000 0.000 sqrtdel= 1.0000 0.00000 47 -1 0.70 0.50 ag i d9 5s5d ag i d10 9f 0.000000 ( //r1// )= 0.00000 a0 0.0000 0.000000 0.000 0.000 sqrtdel= 1.0000 0.00000 47 -1 0.70 0.50 ag i d9 5s5d ag i d9 5s4f 9.850414 ( 5d//r1// 4f)= -17.06142 a0 1.0000 2.772305 0.728 1.000 sqrtdel= 1.0000 -17.06142 47 -1 0.70 0.50 ag i d9 5s5d ag i d9 5s5f 3.332682 ( 5d//r1// 5f)= -5.77237 a0 0.6056 0.317336 0.355 0.814 sqrtdel= 1.0000 -5.77237 47 -1 0.70 0.50 ag i d9 5s5d ag i d9 5s6f 1.830922 ( 5d//r1// 6f)= -3.17125 a0 0.4715 0.095779 0.228 0.725 sqrtdel= 1.0000 -3.17125 47 -1 0.70 0.50 ag i d9 5s5d ag i d9 5s7f 1.215826 ( 5d//r1// 7f)= -2.10587 a0 0.4087 0.042235 0.165 0.677 sqrtdel= 1.0000 -2.10587 47 -1 0.70 0.50 ag i d9 5s5d ag i d9 5s8f 0.891343 ( 5d//r1// 8f)= -1.54385 a0 0.3738 0.022700 0.127 0.649 sqrtdel= 1.0000 -1.54385 47 -1 0.70 0.50 ag i d9 5s5d ag i d9 5s9f 0.693956 ( 5d//r1// 9f)= -1.20197 a0 0.3517 0.013759 0.103 0.631 sqrtdel= 1.0000 -1.20197 47 -1 0.70 0.50 ag i d9 5s5d ag i d8 5s2 4f 0.000000 ( //r1// )= 0.00000 a0 0.0000 0.000000 0.000 0.000 sqrtdel= 1.0000 0.00000 47 -1 0.70 0.50 ag i d9 5s5d ag i d10 6h 0.000000 ( //r1// )= 0.00000 a0 0.0000 0.000000 0.000 0.000 sqrtdel= 1.0000 0.00000 47 -1 0.70 0.50 ag i d9 5s5d ag i d10 7h 0.000000 ( //r1// )= 0.00000 a0 0.0000 0.000000 0.000 0.000 sqrtdel= 1.0000 0.00000 47 -1 0.70 0.50 ag i d9 5s5d ag i d10 8h 0.000000 ( //r1// )= 0.00000 a0 0.0000 0.000000 0.000 0.000 sqrtdel= 1.0000 0.00000 47 -1 0.70 0.50 ag i d9 5s5d ag i d10 9h 0.000000 ( //r1// )= 0.00000 a0 0.0000 0.000000 0.000 0.000 sqrtdel= 1.0000 0.00000 47 -1 0.70 0.50 ag i d9 5s5d ag i d9 5s6h 0.000000 ( //r1// )= 0.00000 a0 0.0000 0.000000 0.000 0.000 sqrtdel= 1.0000 0.00000 47 -1 0.70 0.50 ag i d9 5s5d ag i d9 5s7h 0.000000 ( //r1// )= 0.00000 a0 0.0000 0.000000 0.000 0.000 sqrtdel= 1.0000 0.00000 47 -1 0.70 0.50 ag i d9 5s5d ag i d9 5s8h 0.000000 ( //r1// )= 0.00000 a0 0.0000 0.000000 0.000 0.000 sqrtdel= 1.0000 0.00000 47 -1 0.70 0.50 ag i d9 5s5d ag i d9 5s9h 0.000000 ( //r1// )= 0.00000 a0 0.0000 0.000000 0.000 0.000 sqrtdel= 1.0000 0.00000 47 -1 0.70 0.50 ag i d9 5s5d ag i d10 8k 0.000000 ( //r1// )= 0.00000 a0 0.0000 0.000000 0.000 0.000 sqrtdel= 1.0000 0.00000 47 -1 0.70 0.50 ag i d9 5s5d ag i d10 9k 0.000000 ( //r1// )= 0.00000 a0 0.0000 0.000000 0.000 0.000 sqrtdel= 1.0000 0.00000 47 -1 0.70 0.50 ag i d9 5s5d ag i d9 5s8k 0.000000 ( //r1// )= 0.00000 a0 0.0000 0.000000 0.000 0.000 sqrtdel= 1.0000 0.00000 47 -1 0.70 0.50 ag i d9 5s5d ag i d9 5s9k 0.000000 ( //r1// )= 0.00000 a0 0.0000 0.000000 0.000 0.000 sqrtdel= 1.0000 0.00000 47 -1 0.70 0.50 ag i d9 5s6d ag i d10 5p 0.000000 ( //r1// )= 0.00000 a0 0.0000 0.000000 0.000 0.000 sqrtdel= 1.0000 0.00000 47 -1 0.70 0.50 ag i d9 5s6d ag i d10 6p 0.000000 ( //r1// )= 0.00000 a0 0.0000 0.000000 0.000 0.000 sqrtdel= 1.0000 0.00000 47 -1 0.70 0.50 ag i d9 5s6d ag i d10 7p 0.000000 ( //r1// )= 0.00000 a0 0.0000 0.000000 0.000 0.000 sqrtdel= 1.0000 0.00000 47 -1 0.70 0.50 ag i d9 5s6d ag i d10 8p 0.000000 ( //r1// )= 0.00000 a0 0.0000 0.000000 0.000 0.000 sqrtdel= 1.0000 0.00000 47 -1 0.70 0.50 ag i d9 5s6d ag i d10 9p 0.000000 ( //r1// )= 0.00000 a0 0.0000 0.000000 0.000 0.000 sqrtdel= 1.0000 0.00000 47 -1 0.70 0.50 ag i d9 5s6d ag i d9 5s5p -1.577320 ( 6d//r1// 5p)= -2.23067 a0 -0.8410 0.165863-0.305-0.934 sqrtdel= 1.0000 -2.23067 47 -1 0.70 0.50 ag i d9 5s6d ag i d9 5s6p -5.993831 ( 6d//r1// 6p)= -8.47656 a0 -0.6942 2.395067-0.267-0.457 sqrtdel= 1.0000 -8.47656 47 -1 0.70 0.50 ag i d9 5s6d ag i d9 5s7p 20.569195 ( 6d//r1// 7p)= 29.08923 a0 0.9906 28.206119 0.911 0.955 sqrtdel= 1.0000 29.08923 47 -1 0.70 0.50 ag i d9 5s6d ag i d9 5s8p -4.021918 ( 6d//r1// 8p)= -5.68785 a0 -0.2681 1.078388 0.043 0.069 sqrtdel= 1.0000 -5.68785 47 -1 0.70 0.50 ag i d9 5s6d ag i d9 5s9p -1.388705 ( 6d//r1// 9p)= -1.96393 a0 -0.1400 0.128567 0.029 0.069 sqrtdel= 1.0000 -1.96393 47 -1 0.70 0.50 ag i d9 5s6d ag i d8 5s2 5p 0.000000 ( //r1// )= 0.00000 a0 0.0000 0.000000 0.000 0.000 sqrtdel= 1.0000 0.00000 47 -1 0.70 0.50 ag i d9 5s6d ag i d10 4f 0.000000 ( //r1// )= 0.00000 a0 0.0000 0.000000 0.000 0.000 sqrtdel= 1.0000 0.00000 47 -1 0.70 0.50 ag i d9 5s6d ag i d10 5f 0.000000 ( //r1// )= 0.00000 a0 0.0000 0.000000 0.000 0.000 sqrtdel= 1.0000 0.00000 47 -1 0.70 0.50 ag i d9 5s6d ag i d10 6f 0.000000 ( //r1// )= 0.00000 a0 0.0000 0.000000 0.000 0.000 sqrtdel= 1.0000 0.00000 47 -1 0.70 0.50 ag i d9 5s6d ag i d10 7f 0.000000 ( //r1// )= 0.00000 a0 0.0000 0.000000 0.000 0.000 sqrtdel= 1.0000 0.00000 47 -1 0.70 0.50 ag i d9 5s6d ag i d10 8f 0.000000 ( //r1// )= 0.00000 a0 0.0000 0.000000 0.000 0.000 sqrtdel= 1.0000 0.00000 47 -1 0.70 0.50 ag i d9 5s6d ag i d10 9f 0.000000 ( //r1// )= 0.00000 a0 0.0000 0.000000 0.000 0.000 sqrtdel= 1.0000 0.00000 47 -1 0.70 0.50 ag i d9 5s6d ag i d9 5s4f -16.076736 ( 6d//r1// 4f)= 27.84572 a0 -0.9145 7.384612-0.689-0.784 sqrtdel= 1.0000 27.84572 47 -1 0.70 0.50 ag i d9 5s6d ag i d9 5s5f 12.955458 ( 6d//r1// 5f)= -22.43951 a0 0.7890 4.795539 0.432 0.662 sqrtdel= 1.0000 -22.43951 47 -1 0.70 0.50 ag i d9 5s6d ag i d9 5s6f 5.052834 ( 6d//r1// 6f)= -8.75176 a0 0.4808 0.729461 0.257 0.588 sqrtdel= 1.0000 -8.75176 47 -1 0.70 0.50 ag i d9 5s6d ag i d9 5s7f 2.919969 ( 6d//r1// 7f)= -5.05753 a0 0.3717 0.243606 0.180 0.539 sqrtdel= 1.0000 -5.05753 47 -1 0.70 0.50 ag i d9 5s6d ag i d9 5s8f 1.989680 ( 6d//r1// 8f)= -3.44623 a0 0.3191 0.113109 0.137 0.510 sqrtdel= 1.0000 -3.44623 47 -1 0.70 0.50 ag i d9 5s6d ag i d9 5s9f 1.482420 ( 6d//r1// 9f)= -2.56763 a0 0.2886 0.062788 0.109 0.491 sqrtdel= 1.0000 -2.56763 47 -1 0.70 0.50 ag i d9 5s6d ag i d8 5s2 4f 0.000000 ( //r1// )= 0.00000 a0 0.0000 0.000000 0.000 0.000 sqrtdel= 1.0000 0.00000 47 -1 0.70 0.50 ag i d9 5s6d ag i d10 6h 0.000000 ( //r1// )= 0.00000 a0 0.0000 0.000000 0.000 0.000 sqrtdel= 1.0000 0.00000 47 -1 0.70 0.50 ag i d9 5s6d ag i d10 7h 0.000000 ( //r1// )= 0.00000 a0 0.0000 0.000000 0.000 0.000 sqrtdel= 1.0000 0.00000 47 -1 0.70 0.50 ag i d9 5s6d ag i d10 8h 0.000000 ( //r1// )= 0.00000 a0 0.0000 0.000000 0.000 0.000 sqrtdel= 1.0000 0.00000 47 -1 0.70 0.50 ag i d9 5s6d ag i d10 9h 0.000000 ( //r1// )= 0.00000 a0 0.0000 0.000000 0.000 0.000 sqrtdel= 1.0000 0.00000 47 -1 0.70 0.50 ag i d9 5s6d ag i d9 5s6h 0.000000 ( //r1// )= 0.00000 a0 0.0000 0.000000 0.000 0.000 sqrtdel= 1.0000 0.00000 47 -1 0.70 0.50 ag i d9 5s6d ag i d9 5s7h 0.000000 ( //r1// )= 0.00000 a0 0.0000 0.000000 0.000 0.000 sqrtdel= 1.0000 0.00000 47 -1 0.70 0.50 ag i d9 5s6d ag i d9 5s8h 0.000000 ( //r1// )= 0.00000 a0 0.0000 0.000000 0.000 0.000 sqrtdel= 1.0000 0.00000 47 -1 0.70 0.50 ag i d9 5s6d ag i d9 5s9h 0.000000 ( //r1// )= 0.00000 a0 0.0000 0.000000 0.000 0.000 sqrtdel= 1.0000 0.00000 47 -1 0.70 0.50 ag i d9 5s6d ag i d10 8k 0.000000 ( //r1// )= 0.00000 a0 0.0000 0.000000 0.000 0.000 sqrtdel= 1.0000 0.00000 47 -1 0.70 0.50 ag i d9 5s6d ag i d10 9k 0.000000 ( //r1// )= 0.00000 a0 0.0000 0.000000 0.000 0.000 sqrtdel= 1.0000 0.00000 47 -1 0.70 0.50 ag i d9 5s6d ag i d9 5s8k 0.000000 ( //r1// )= 0.00000 a0 0.0000 0.000000 0.000 0.000 sqrtdel= 1.0000 0.00000 47 -1 0.70 0.50 ag i d9 5s6d ag i d9 5s9k 0.000000 ( //r1// )= 0.00000 a0 0.0000 0.000000 0.000 0.000 sqrtdel= 1.0000 0.00000 47 -1 0.70 0.50 ag i d9 5s7d ag i d10 5p 0.000000 ( //r1// )= 0.00000 a0 0.0000 0.000000 0.000 0.000 sqrtdel= 1.0000 0.00000 47 -1 0.70 0.50 ag i d9 5s7d ag i d10 6p 0.000000 ( //r1// )= 0.00000 a0 0.0000 0.000000 0.000 0.000 sqrtdel= 1.0000 0.00000 47 -1 0.70 0.50 ag i d9 5s7d ag i d10 7p 0.000000 ( //r1// )= 0.00000 a0 0.0000 0.000000 0.000 0.000 sqrtdel= 1.0000 0.00000 47 -1 0.70 0.50 ag i d9 5s7d ag i d10 8p 0.000000 ( //r1// )= 0.00000 a0 0.0000 0.000000 0.000 0.000 sqrtdel= 1.0000 0.00000 47 -1 0.70 0.50 ag i d9 5s7d ag i d10 9p 0.000000 ( //r1// )= 0.00000 a0 0.0000 0.000000 0.000 0.000 sqrtdel= 1.0000 0.00000 47 -1 0.70 0.50 ag i d9 5s7d ag i d9 5s5p -0.950747 ( 7d//r1// 5p)= -1.34456 a0 -0.7515 0.060261-0.202-0.893 sqrtdel= 1.0000 -1.34456 47 -1 0.70 0.50 ag i d9 5s7d ag i d9 5s6p -2.654548 ( 7d//r1// 6p)= -3.75410 a0 -0.5075 0.469775-0.174-0.470 sqrtdel= 1.0000 -3.75410 47 -1 0.70 0.50 ag i d9 5s7d ag i d9 5s7p -9.237103 ( 7d//r1// 7p)= -13.06324 a0 -0.5660 5.688272-0.181-0.290 sqrtdel= 1.0000 -13.06324 47 -1 0.70 0.50 ag i d9 5s7d ag i d9 5s8p 33.839020 ( 7d//r1// 8p)= 47.85560 a0 0.9957 76.338616 0.943 0.975 sqrtdel= 1.0000 47.85560 47 -1 0.70 0.50 ag i d9 5s7d ag i d9 5s9p -6.628240 ( 7d//r1// 9p)= -9.37375 a0 -0.2614 2.928905 0.043 0.065 sqrtdel= 1.0000 -9.37375 47 -1 0.70 0.50 ag i d9 5s7d ag i d8 5s2 5p 0.000000 ( //r1// )= 0.00000 a0 0.0000 0.000000 0.000 0.000 sqrtdel= 1.0000 0.00000 47 -1 0.70 0.50 ag i d9 5s7d ag i d10 4f 0.000000 ( //r1// )= 0.00000 a0 0.0000 0.000000 0.000 0.000 sqrtdel= 1.0000 0.00000 47 -1 0.70 0.50 ag i d9 5s7d ag i d10 5f 0.000000 ( //r1// )= 0.00000 a0 0.0000 0.000000 0.000 0.000 sqrtdel= 1.0000 0.00000 47 -1 0.70 0.50 ag i d9 5s7d ag i d10 6f 0.000000 ( //r1// )= 0.00000 a0 0.0000 0.000000 0.000 0.000 sqrtdel= 1.0000 0.00000 47 -1 0.70 0.50 ag i d9 5s7d ag i d10 7f 0.000000 ( //r1// )= 0.00000 a0 0.0000 0.000000 0.000 0.000 sqrtdel= 1.0000 0.00000 47 -1 0.70 0.50 ag i d9 5s7d ag i d10 8f 0.000000 ( //r1// )= 0.00000 a0 0.0000 0.000000 0.000 0.000 sqrtdel= 1.0000 0.00000 47 -1 0.70 0.50 ag i d9 5s7d ag i d10 9f 0.000000 ( //r1// )= 0.00000 a0 0.0000 0.000000 0.000 0.000 sqrtdel= 1.0000 0.00000 47 -1 0.70 0.50 ag i d9 5s7d ag i d9 5s4f 2.267962 ( 7d//r1// 4f)= -3.92823 a0 0.1844 0.146961-0.042-0.075 sqrtdel= 1.0000 -3.92823 47 -1 0.70 0.50 ag i d9 5s7d ag i d9 5s5f -30.312894 ( 7d//r1// 5f)= 52.50347 a0 -0.9728 26.253472-0.832-0.899 sqrtdel= 1.0000 52.50347 47 -1 0.70 0.50 ag i d9 5s7d ag i d9 5s6f 16.440201 ( 7d//r1// 6f)= -28.47526 a0 0.6334 7.722292 0.283 0.432 sqrtdel= 1.0000 -28.47526 47 -1 0.70 0.50 ag i d9 5s7d ag i d9 5s7f 6.719188 ( 7d//r1// 7f)= -11.63797 a0 0.3815 1.289928 0.186 0.406 sqrtdel= 1.0000 -11.63797 47 -1 0.70 0.50 ag i d9 5s7d ag i d9 5s8f 3.963675 ( 7d//r1// 8f)= -6.86529 a0 0.2925 0.448878 0.137 0.382 sqrtdel= 1.0000 -6.86529 47 -1 0.70 0.50 ag i d9 5s7d ag i d9 5s9f 2.732834 ( 7d//r1// 9f)= -4.73341 a0 0.2479 0.213382 0.107 0.365 sqrtdel= 1.0000 -4.73341 47 -1 0.70 0.50 ag i d9 5s7d ag i d8 5s2 4f 0.000000 ( //r1// )= 0.00000 a0 0.0000 0.000000 0.000 0.000 sqrtdel= 1.0000 0.00000 47 -1 0.70 0.50 ag i d9 5s7d ag i d10 6h 0.000000 ( //r1// )= 0.00000 a0 0.0000 0.000000 0.000 0.000 sqrtdel= 1.0000 0.00000 47 -1 0.70 0.50 ag i d9 5s7d ag i d10 7h 0.000000 ( //r1// )= 0.00000 a0 0.0000 0.000000 0.000 0.000 sqrtdel= 1.0000 0.00000 47 -1 0.70 0.50 ag i d9 5s7d ag i d10 8h 0.000000 ( //r1// )= 0.00000 a0 0.0000 0.000000 0.000 0.000 sqrtdel= 1.0000 0.00000 47 -1 0.70 0.50 ag i d9 5s7d ag i d10 9h 0.000000 ( //r1// )= 0.00000 a0 0.0000 0.000000 0.000 0.000 sqrtdel= 1.0000 0.00000 47 -1 0.70 0.50 ag i d9 5s7d ag i d9 5s6h 0.000000 ( //r1// )= 0.00000 a0 0.0000 0.000000 0.000 0.000 sqrtdel= 1.0000 0.00000 47 -1 0.70 0.50 ag i d9 5s7d ag i d9 5s7h 0.000000 ( //r1// )= 0.00000 a0 0.0000 0.000000 0.000 0.000 sqrtdel= 1.0000 0.00000 47 -1 0.70 0.50 ag i d9 5s7d ag i d9 5s8h 0.000000 ( //r1// )= 0.00000 a0 0.0000 0.000000 0.000 0.000 sqrtdel= 1.0000 0.00000 47 -1 0.70 0.50 ag i d9 5s7d ag i d9 5s9h 0.000000 ( //r1// )= 0.00000 a0 0.0000 0.000000 0.000 0.000 sqrtdel= 1.0000 0.00000 47 -1 0.70 0.50 ag i d9 5s7d ag i d10 8k 0.000000 ( //r1// )= 0.00000 a0 0.0000 0.000000 0.000 0.000 sqrtdel= 1.0000 0.00000 47 -1 0.70 0.50 ag i d9 5s7d ag i d10 9k 0.000000 ( //r1// )= 0.00000 a0 0.0000 0.000000 0.000 0.000 sqrtdel= 1.0000 0.00000 47 -1 0.70 0.50 ag i d9 5s7d ag i d9 5s8k 0.000000 ( //r1// )= 0.00000 a0 0.0000 0.000000 0.000 0.000 sqrtdel= 1.0000 0.00000 47 -1 0.70 0.50 ag i d9 5s7d ag i d9 5s9k 0.000000 ( //r1// )= 0.00000 a0 0.0000 0.000000 0.000 0.000 sqrtdel= 1.0000 0.00000 47 -1 0.70 0.50 ag i d9 5s8d ag i d10 5p 0.000000 ( //r1// )= 0.00000 a0 0.0000 0.000000 0.000 0.000 sqrtdel= 1.0000 0.00000 47 -1 0.70 0.50 ag i d9 5s8d ag i d10 6p 0.000000 ( //r1// )= 0.00000 a0 0.0000 0.000000 0.000 0.000 sqrtdel= 1.0000 0.00000 47 -1 0.70 0.50 ag i d9 5s8d ag i d10 7p 0.000000 ( //r1// )= 0.00000 a0 0.0000 0.000000 0.000 0.000 sqrtdel= 1.0000 0.00000 47 -1 0.70 0.50 ag i d9 5s8d ag i d10 8p 0.000000 ( //r1// )= 0.00000 a0 0.0000 0.000000 0.000 0.000 sqrtdel= 1.0000 0.00000 47 -1 0.70 0.50 ag i d9 5s8d ag i d10 9p 0.000000 ( //r1// )= 0.00000 a0 0.0000 0.000000 0.000 0.000 sqrtdel= 1.0000 0.00000 47 -1 0.70 0.50 ag i d9 5s8d ag i d9 5s5p -0.656175 ( 8d//r1// 5p)= -0.92797 a0 -0.7025 0.028704-0.146-0.868 sqrtdel= 1.0000 -0.92797 47 -1 0.70 0.50 ag i d9 5s8d ag i d9 5s6p -1.616221 ( 8d//r1// 6p)= -2.28568 a0 -0.4276 0.174145-0.126-0.462 sqrtdel= 1.0000 -2.28568 47 -1 0.70 0.50 ag i d9 5s8d ag i d9 5s7p -3.995715 ( 8d//r1// 7p)= -5.65079 a0 -0.3774 1.064383-0.126-0.302 sqrtdel= 1.0000 -5.65079 47 -1 0.70 0.50 ag i d9 5s8d ag i d9 5s8p -13.174065 ( 8d//r1// 8p)= -18.63094 a0 -0.4967 11.570400-0.138-0.210 sqrtdel= 1.0000 -18.63094 47 -1 0.70 0.50 ag i d9 5s8d ag i d9 5s9p 50.059095 ( 8d//r1// 9p)= 70.79425 a0 0.9976 167.060864 0.960 0.984 sqrtdel= 1.0000 70.79425 47 -1 0.70 0.50 ag i d9 5s8d ag i d8 5s2 5p 0.000000 ( //r1// )= 0.00000 a0 0.0000 0.000000 0.000 0.000 sqrtdel= 1.0000 0.00000 47 -1 0.70 0.50 ag i d9 5s8d ag i d10 4f 0.000000 ( //r1// )= 0.00000 a0 0.0000 0.000000 0.000 0.000 sqrtdel= 1.0000 0.00000 47 -1 0.70 0.50 ag i d9 5s8d ag i d10 5f 0.000000 ( //r1// )= 0.00000 a0 0.0000 0.000000 0.000 0.000 sqrtdel= 1.0000 0.00000 47 -1 0.70 0.50 ag i d9 5s8d ag i d10 6f 0.000000 ( //r1// )= 0.00000 a0 0.0000 0.000000 0.000 0.000 sqrtdel= 1.0000 0.00000 47 -1 0.70 0.50 ag i d9 5s8d ag i d10 7f 0.000000 ( //r1// )= 0.00000 a0 0.0000 0.000000 0.000 0.000 sqrtdel= 1.0000 0.00000 47 -1 0.70 0.50 ag i d9 5s8d ag i d10 8f 0.000000 ( //r1// )= 0.00000 a0 0.0000 0.000000 0.000 0.000 sqrtdel= 1.0000 0.00000 47 -1 0.70 0.50 ag i d9 5s8d ag i d10 9f 0.000000 ( //r1// )= 0.00000 a0 0.0000 0.000000 0.000 0.000 sqrtdel= 1.0000 0.00000 47 -1 0.70 0.50 ag i d9 5s8d ag i d9 5s4f 0.775109 ( 8d//r1// 4f)= -1.34253 a0 0.0935 0.017166-0.022-0.058 sqrtdel= 1.0000 -1.34253 47 -1 0.70 0.50 ag i d9 5s8d ag i d9 5s5f 5.025162 ( 8d//r1// 5f)= -8.70384 a0 0.2169 0.721493-0.044-0.068 sqrtdel= 1.0000 -8.70384 47 -1 0.70 0.50 ag i d9 5s8d ag i d9 5s6f -47.154731 ( 8d//r1// 6f)= 81.67439 a0 -0.9887 63.530534-0.897-0.944 sqrtdel= 1.0000 81.67439 47 -1 0.70 0.50 ag i d9 5s8d ag i d9 5s7f 20.314966 ( 8d//r1// 7f)= -35.18655 a0 0.5318 11.791366 0.196 0.291 sqrtdel= 1.0000 -35.18655 47 -1 0.70 0.50 ag i d9 5s8d ag i d9 5s8f 8.457012 ( 8d//r1// 8f)= -14.64797 a0 0.3150 2.043459 0.138 0.286 sqrtdel= 1.0000 -14.64797 47 -1 0.70 0.50 ag i d9 5s8d ag i d9 5s9f 5.031104 ( 8d//r1// 9f)= -8.71413 a0 0.2380 0.723200 0.105 0.274 sqrtdel= 1.0000 -8.71413 47 -1 0.70 0.50 ag i d9 5s8d ag i d8 5s2 4f 0.000000 ( //r1// )= 0.00000 a0 0.0000 0.000000 0.000 0.000 sqrtdel= 1.0000 0.00000 47 -1 0.70 0.50 ag i d9 5s8d ag i d10 6h 0.000000 ( //r1// )= 0.00000 a0 0.0000 0.000000 0.000 0.000 sqrtdel= 1.0000 0.00000 47 -1 0.70 0.50 ag i d9 5s8d ag i d10 7h 0.000000 ( //r1// )= 0.00000 a0 0.0000 0.000000 0.000 0.000 sqrtdel= 1.0000 0.00000 47 -1 0.70 0.50 ag i d9 5s8d ag i d10 8h 0.000000 ( //r1// )= 0.00000 a0 0.0000 0.000000 0.000 0.000 sqrtdel= 1.0000 0.00000 47 -1 0.70 0.50 ag i d9 5s8d ag i d10 9h 0.000000 ( //r1// )= 0.00000 a0 0.0000 0.000000 0.000 0.000 sqrtdel= 1.0000 0.00000 47 -1 0.70 0.50 ag i d9 5s8d ag i d9 5s6h 0.000000 ( //r1// )= 0.00000 a0 0.0000 0.000000 0.000 0.000 sqrtdel= 1.0000 0.00000 47 -1 0.70 0.50 ag i d9 5s8d ag i d9 5s7h 0.000000 ( //r1// )= 0.00000 a0 0.0000 0.000000 0.000 0.000 sqrtdel= 1.0000 0.00000 47 -1 0.70 0.50 ag i d9 5s8d ag i d9 5s8h 0.000000 ( //r1// )= 0.00000 a0 0.0000 0.000000 0.000 0.000 sqrtdel= 1.0000 0.00000 47 -1 0.70 0.50 ag i d9 5s8d ag i d9 5s9h 0.000000 ( //r1// )= 0.00000 a0 0.0000 0.000000 0.000 0.000 sqrtdel= 1.0000 0.00000 47 -1 0.70 0.50 ag i d9 5s8d ag i d10 8k 0.000000 ( //r1// )= 0.00000 a0 0.0000 0.000000 0.000 0.000 sqrtdel= 1.0000 0.00000 47 -1 0.70 0.50 ag i d9 5s8d ag i d10 9k 0.000000 ( //r1// )= 0.00000 a0 0.0000 0.000000 0.000 0.000 sqrtdel= 1.0000 0.00000 47 -1 0.70 0.50 ag i d9 5s8d ag i d9 5s8k 0.000000 ( //r1// )= 0.00000 a0 0.0000 0.000000 0.000 0.000 sqrtdel= 1.0000 0.00000 47 -1 0.70 0.50 ag i d9 5s8d ag i d9 5s9k 0.000000 ( //r1// )= 0.00000 a0 0.0000 0.000000 0.000 0.000 sqrtdel= 1.0000 0.00000 47 -1 0.70 0.50 ag i d9 5s9d ag i d10 5p 0.000000 ( //r1// )= 0.00000 a0 0.0000 0.000000 0.000 0.000 sqrtdel= 1.0000 0.00000 47 -1 0.70 0.50 ag i d9 5s9d ag i d10 6p 0.000000 ( //r1// )= 0.00000 a0 0.0000 0.000000 0.000 0.000 sqrtdel= 1.0000 0.00000 47 -1 0.70 0.50 ag i d9 5s9d ag i d10 7p 0.000000 ( //r1// )= 0.00000 a0 0.0000 0.000000 0.000 0.000 sqrtdel= 1.0000 0.00000 47 -1 0.70 0.50 ag i d9 5s9d ag i d10 8p 0.000000 ( //r1// )= 0.00000 a0 0.0000 0.000000 0.000 0.000 sqrtdel= 1.0000 0.00000 47 -1 0.70 0.50 ag i d9 5s9d ag i d10 9p 0.000000 ( //r1// )= 0.00000 a0 0.0000 0.000000 0.000 0.000 sqrtdel= 1.0000 0.00000 47 -1 0.70 0.50 ag i d9 5s9d ag i d9 5s5p -0.489064 ( 9d//r1// 5p)= -0.69164 a0 -0.6718 0.015946-0.113-0.852 sqrtdel= 1.0000 -0.69164 47 -1 0.70 0.50 ag i d9 5s9d ag i d9 5s6p -1.130687 ( 9d//r1// 6p)= -1.59903 a0 -0.3867 0.085230-0.096-0.456 sqrtdel= 1.0000 -1.59903 47 -1 0.70 0.50 ag i d9 5s9d ag i d9 5s7p -2.423287 ( 9d//r1// 7p)= -3.42705 a0 -0.3056 0.391488-0.095-0.300 sqrtdel= 1.0000 -3.42705 47 -1 0.70 0.50 ag i d9 5s9d ag i d9 5s8p -5.558310 ( 9d//r1// 8p)= -7.86064 a0 -0.3086 2.059654-0.099-0.217 sqrtdel= 1.0000 -7.86064 47 -1 0.70 0.50 ag i d9 5s9d ag i d9 5s9p -17.810367 ( 9d//r1// 9p)= -25.18766 a0 -0.4540 21.147279-0.113-0.165 sqrtdel= 1.0000 -25.18766 47 -1 0.70 0.50 ag i d9 5s9d ag i d8 5s2 5p 0.000000 ( //r1// )= 0.00000 a0 0.0000 0.000000 0.000 0.000 sqrtdel= 1.0000 0.00000 47 -1 0.70 0.50 ag i d9 5s9d ag i d10 4f 0.000000 ( //r1// )= 0.00000 a0 0.0000 0.000000 0.000 0.000 sqrtdel= 1.0000 0.00000 47 -1 0.70 0.50 ag i d9 5s9d ag i d10 5f 0.000000 ( //r1// )= 0.00000 a0 0.0000 0.000000 0.000 0.000 sqrtdel= 1.0000 0.00000 47 -1 0.70 0.50 ag i d9 5s9d ag i d10 6f 0.000000 ( //r1// )= 0.00000 a0 0.0000 0.000000 0.000 0.000 sqrtdel= 1.0000 0.00000 47 -1 0.70 0.50 ag i d9 5s9d ag i d10 7f 0.000000 ( //r1// )= 0.00000 a0 0.0000 0.000000 0.000 0.000 sqrtdel= 1.0000 0.00000 47 -1 0.70 0.50 ag i d9 5s9d ag i d10 8f 0.000000 ( //r1// )= 0.00000 a0 0.0000 0.000000 0.000 0.000 sqrtdel= 1.0000 0.00000 47 -1 0.70 0.50 ag i d9 5s9d ag i d10 9f 0.000000 ( //r1// )= 0.00000 a0 0.0000 0.000000 0.000 0.000 sqrtdel= 1.0000 0.00000 47 -1 0.70 0.50 ag i d9 5s9d ag i d9 5s4f 0.429236 ( 9d//r1// 4f)= -0.74346 a0 0.0685 0.005264-0.015-0.049 sqrtdel= 1.0000 -0.74346 47 -1 0.70 0.50 ag i d9 5s9d ag i d9 5s5f 1.704743 ( 9d//r1// 5f)= -2.95270 a0 0.1054 0.083033-0.026-0.055 sqrtdel= 1.0000 -2.95270 47 -1 0.70 0.50 ag i d9 5s9d ag i d9 5s6f 8.670414 ( 9d//r1// 6f)= -15.01760 a0 0.2373 2.147888-0.038-0.056 sqrtdel= 1.0000 -15.01760 47 -1 0.70 0.50 ag i d9 5s9d ag i d9 5s7f -66.841314 ( 9d//r1// 7f)= 115.77255 a0 -0.9945 127.650320-0.933-0.966 sqrtdel= 1.0000 115.77255 47 -1 0.70 0.50 ag i d9 5s9d ag i d9 5s8f 24.580109 ( 9d//r1// 8f)= -42.57400 a0 0.4638 17.262336 0.140 0.203 sqrtdel= 1.0000 -42.57400 47 -1 0.70 0.50 ag i d9 5s9d ag i d9 5s9f 10.306386 ( 9d//r1// 9f)= -17.85118 a0 0.2692 3.034903 0.105 0.207 sqrtdel= 1.0000 -17.85118 47 -1 0.70 0.50 ag i d9 5s9d ag i d8 5s2 4f 0.000000 ( //r1// )= 0.00000 a0 0.0000 0.000000 0.000 0.000 sqrtdel= 1.0000 0.00000 47 -1 0.70 0.50 ag i d9 5s9d ag i d10 6h 0.000000 ( //r1// )= 0.00000 a0 0.0000 0.000000 0.000 0.000 sqrtdel= 1.0000 0.00000 47 -1 0.70 0.50 ag i d9 5s9d ag i d10 7h 0.000000 ( //r1// )= 0.00000 a0 0.0000 0.000000 0.000 0.000 sqrtdel= 1.0000 0.00000 47 -1 0.70 0.50 ag i d9 5s9d ag i d10 8h 0.000000 ( //r1// )= 0.00000 a0 0.0000 0.000000 0.000 0.000 sqrtdel= 1.0000 0.00000 47 -1 0.70 0.50 ag i d9 5s9d ag i d10 9h 0.000000 ( //r1// )= 0.00000 a0 0.0000 0.000000 0.000 0.000 sqrtdel= 1.0000 0.00000 47 -1 0.70 0.50 ag i d9 5s9d ag i d9 5s6h 0.000000 ( //r1// )= 0.00000 a0 0.0000 0.000000 0.000 0.000 sqrtdel= 1.0000 0.00000 47 -1 0.70 0.50 ag i d9 5s9d ag i d9 5s7h 0.000000 ( //r1// )= 0.00000 a0 0.0000 0.000000 0.000 0.000 sqrtdel= 1.0000 0.00000 47 -1 0.70 0.50 ag i d9 5s9d ag i d9 5s8h 0.000000 ( //r1// )= 0.00000 a0 0.0000 0.000000 0.000 0.000 sqrtdel= 1.0000 0.00000 47 -1 0.70 0.50 ag i d9 5s9d ag i d9 5s9h 0.000000 ( //r1// )= 0.00000 a0 0.0000 0.000000 0.000 0.000 sqrtdel= 1.0000 0.00000 47 -1 0.70 0.50 ag i d9 5s9d ag i d10 8k 0.000000 ( //r1// )= 0.00000 a0 0.0000 0.000000 0.000 0.000 sqrtdel= 1.0000 0.00000 47 -1 0.70 0.50 ag i d9 5s9d ag i d10 9k 0.000000 ( //r1// )= 0.00000 a0 0.0000 0.000000 0.000 0.000 sqrtdel= 1.0000 0.00000 47 -1 0.70 0.50 ag i d9 5s9d ag i d9 5s8k 0.000000 ( //r1// )= 0.00000 a0 0.0000 0.000000 0.000 0.000 sqrtdel= 1.0000 0.00000 47 -1 0.70 0.50 ag i d9 5s9d ag i d9 5s9k 0.000000 ( //r1// )= 0.00000 a0 0.0000 0.000000 0.000 0.000 sqrtdel= 1.0000 0.00000 47 -1 0.70 0.50 ag i d8 5s2 5d ag i d10 5p 0.000000 ( //r1// )= 0.00000 a0 0.0000 0.000000 0.000 0.000 sqrtdel= 1.0000 0.00000 47 -1 0.70 0.50 ag i d8 5s2 5d ag i d10 6p 0.000000 ( //r1// )= 0.00000 a0 0.0000 0.000000 0.000 0.000 sqrtdel= 1.0000 0.00000 47 -1 0.70 0.50 ag i d8 5s2 5d ag i d10 7p 0.000000 ( //r1// )= 0.00000 a0 0.0000 0.000000 0.000 0.000 sqrtdel= 1.0000 0.00000 47 -1 0.70 0.50 ag i d8 5s2 5d ag i d10 8p 0.000000 ( //r1// )= 0.00000 a0 0.0000 0.000000 0.000 0.000 sqrtdel= 1.0000 0.00000 47 -1 0.70 0.50 ag i d8 5s2 5d ag i d10 9p 0.000000 ( //r1// )= 0.00000 a0 0.0000 0.000000 0.000 0.000 sqrtdel= 1.0000 0.00000 47 -1 0.70 0.50 ag i d8 5s2 5d ag i d9 5s5p 0.000000 ( //r1// )= 0.00000 a0 0.0000 0.000000 0.000 0.000 sqrtdel= 1.0000 0.00000 47 -1 0.70 0.50 ag i d8 5s2 5d ag i d9 5s6p 0.000000 ( //r1// )= 0.00000 a0 0.0000 0.000000 0.000 0.000 sqrtdel= 1.0000 0.00000 47 -1 0.70 0.50 ag i d8 5s2 5d ag i d9 5s7p 0.000000 ( //r1// )= 0.00000 a0 0.0000 0.000000 0.000 0.000 sqrtdel= 1.0000 0.00000 47 -1 0.70 0.50 ag i d8 5s2 5d ag i d9 5s8p 0.000000 ( //r1// )= 0.00000 a0 0.0000 0.000000 0.000 0.000 sqrtdel= 1.0000 0.00000 47 -1 0.70 0.50 ag i d8 5s2 5d ag i d9 5s9p 0.000000 ( //r1// )= 0.00000 a0 0.0000 0.000000 0.000 0.000 sqrtdel= 1.0000 0.00000 47 -1 0.70 0.50 ag i d8 5s2 5d ag i d8 5s2 5p -2.850339 ( 5d//r1// 5p)= -4.03099 a0 -0.9950 0.541629-0.476-0.982 sqrtdel= 1.0000 -4.03099 47 -1 0.70 0.50 ag i d8 5s2 5d ag i d10 4f 0.000000 ( //r1// )= 0.00000 a0 0.0000 0.000000 0.000 0.000 sqrtdel= 1.0000 0.00000 47 -1 0.70 0.50 ag i d8 5s2 5d ag i d10 5f 0.000000 ( //r1// )= 0.00000 a0 0.0000 0.000000 0.000 0.000 sqrtdel= 1.0000 0.00000 47 -1 0.70 0.50 ag i d8 5s2 5d ag i d10 6f 0.000000 ( //r1// )= 0.00000 a0 0.0000 0.000000 0.000 0.000 sqrtdel= 1.0000 0.00000 47 -1 0.70 0.50 ag i d8 5s2 5d ag i d10 7f 0.000000 ( //r1// )= 0.00000 a0 0.0000 0.000000 0.000 0.000 sqrtdel= 1.0000 0.00000 47 -1 0.70 0.50 ag i d8 5s2 5d ag i d10 8f 0.000000 ( //r1// )= 0.00000 a0 0.0000 0.000000 0.000 0.000 sqrtdel= 1.0000 0.00000 47 -1 0.70 0.50 ag i d8 5s2 5d ag i d10 9f 0.000000 ( //r1// )= 0.00000 a0 0.0000 0.000000 0.000 0.000 sqrtdel= 1.0000 0.00000 47 -1 0.70 0.50 ag i d8 5s2 5d ag i d9 5s4f 0.000000 ( //r1// )= 0.00000 a0 0.0000 0.000000 0.000 0.000 sqrtdel= 1.0000 0.00000 47 -1 0.70 0.50 ag i d8 5s2 5d ag i d9 5s5f 0.000000 ( //r1// )= 0.00000 a0 0.0000 0.000000 0.000 0.000 sqrtdel= 1.0000 0.00000 47 -1 0.70 0.50 ag i d8 5s2 5d ag i d9 5s6f 0.000000 ( //r1// )= 0.00000 a0 0.0000 0.000000 0.000 0.000 sqrtdel= 1.0000 0.00000 47 -1 0.70 0.50 ag i d8 5s2 5d ag i d9 5s7f 0.000000 ( //r1// )= 0.00000 a0 0.0000 0.000000 0.000 0.000 sqrtdel= 1.0000 0.00000 47 -1 0.70 0.50 ag i d8 5s2 5d ag i d9 5s8f 0.000000 ( //r1// )= 0.00000 a0 0.0000 0.000000 0.000 0.000 sqrtdel= 1.0000 0.00000 47 -1 0.70 0.50 ag i d8 5s2 5d ag i d9 5s9f 0.000000 ( //r1// )= 0.00000 a0 0.0000 0.000000 0.000 0.000 sqrtdel= 1.0000 0.00000 47 -1 0.70 0.50 ag i d8 5s2 5d ag i d8 5s2 4f 9.796489 ( 5d//r1// 4f)= -16.96802 a0 1.0000 2.742034 0.726 1.000 sqrtdel= 1.0000 -16.96802 47 -1 0.70 0.50 ag i d8 5s2 5d ag i d10 6h 0.000000 ( //r1// )= 0.00000 a0 0.0000 0.000000 0.000 0.000 sqrtdel= 1.0000 0.00000 47 -1 0.70 0.50 ag i d8 5s2 5d ag i d10 7h 0.000000 ( //r1// )= 0.00000 a0 0.0000 0.000000 0.000 0.000 sqrtdel= 1.0000 0.00000 47 -1 0.70 0.50 ag i d8 5s2 5d ag i d10 8h 0.000000 ( //r1// )= 0.00000 a0 0.0000 0.000000 0.000 0.000 sqrtdel= 1.0000 0.00000 47 -1 0.70 0.50 ag i d8 5s2 5d ag i d10 9h 0.000000 ( //r1// )= 0.00000 a0 0.0000 0.000000 0.000 0.000 sqrtdel= 1.0000 0.00000 47 -1 0.70 0.50 ag i d8 5s2 5d ag i d9 5s6h 0.000000 ( //r1// )= 0.00000 a0 0.0000 0.000000 0.000 0.000 sqrtdel= 1.0000 0.00000 47 -1 0.70 0.50 ag i d8 5s2 5d ag i d9 5s7h 0.000000 ( //r1// )= 0.00000 a0 0.0000 0.000000 0.000 0.000 sqrtdel= 1.0000 0.00000 47 -1 0.70 0.50 ag i d8 5s2 5d ag i d9 5s8h 0.000000 ( //r1// )= 0.00000 a0 0.0000 0.000000 0.000 0.000 sqrtdel= 1.0000 0.00000 47 -1 0.70 0.50 ag i d8 5s2 5d ag i d9 5s9h 0.000000 ( //r1// )= 0.00000 a0 0.0000 0.000000 0.000 0.000 sqrtdel= 1.0000 0.00000 47 -1 0.70 0.50 ag i d8 5s2 5d ag i d10 8k 0.000000 ( //r1// )= 0.00000 a0 0.0000 0.000000 0.000 0.000 sqrtdel= 1.0000 0.00000 47 -1 0.70 0.50 ag i d8 5s2 5d ag i d10 9k 0.000000 ( //r1// )= 0.00000 a0 0.0000 0.000000 0.000 0.000 sqrtdel= 1.0000 0.00000 47 -1 0.70 0.50 ag i d8 5s2 5d ag i d9 5s8k 0.000000 ( //r1// )= 0.00000 a0 0.0000 0.000000 0.000 0.000 sqrtdel= 1.0000 0.00000 47 -1 0.70 0.50 ag i d8 5s2 5d ag i d9 5s9k 0.000000 ( //r1// )= 0.00000 a0 0.0000 0.000000 0.000 0.000 sqrtdel= 1.0000 0.00000 47 -1 0.70 0.50 ag i d10 5g ag i d10 5p 0.000000 ( //r1// )= 0.00000 a0 0.0000 0.000000 0.000 0.000 sqrtdel= 1.0000 0.00000 47 -1 0.70 0.50 ag i d10 5g ag i d10 6p 0.000000 ( //r1// )= 0.00000 a0 0.0000 0.000000 0.000 0.000 sqrtdel= 1.0000 0.00000 47 -1 0.70 0.50 ag i d10 5g ag i d10 7p 0.000000 ( //r1// )= 0.00000 a0 0.0000 0.000000 0.000 0.000 sqrtdel= 1.0000 0.00000 47 -1 0.70 0.50 ag i d10 5g ag i d10 8p 0.000000 ( //r1// )= 0.00000 a0 0.0000 0.000000 0.000 0.000 sqrtdel= 1.0000 0.00000 47 -1 0.70 0.50 ag i d10 5g ag i d10 9p 0.000000 ( //r1// )= 0.00000 a0 0.0000 0.000000 0.000 0.000 sqrtdel= 1.0000 0.00000 47 -1 0.70 0.50 ag i d10 5g ag i d9 5s5p 0.000000 ( //r1// )= 0.00000 a0 0.0000 0.000000 0.000 0.000 sqrtdel= 1.0000 0.00000 47 -1 0.70 0.50 ag i d10 5g ag i d9 5s6p 0.000000 ( //r1// )= 0.00000 a0 0.0000 0.000000 0.000 0.000 sqrtdel= 1.0000 0.00000 47 -1 0.70 0.50 ag i d10 5g ag i d9 5s7p 0.000000 ( //r1// )= 0.00000 a0 0.0000 0.000000 0.000 0.000 sqrtdel= 1.0000 0.00000 47 -1 0.70 0.50 ag i d10 5g ag i d9 5s8p 0.000000 ( //r1// )= 0.00000 a0 0.0000 0.000000 0.000 0.000 sqrtdel= 1.0000 0.00000 47 -1 0.70 0.50 ag i d10 5g ag i d9 5s9p 0.000000 ( //r1// )= 0.00000 a0 0.0000 0.000000 0.000 0.000 sqrtdel= 1.0000 0.00000 47 -1 0.70 0.50 ag i d10 5g ag i d8 5s2 5p 0.000000 ( //r1// )= 0.00000 a0 0.0000 0.000000 0.000 0.000 sqrtdel= 1.0000 0.00000 47 -1 0.70 0.50 ag i d10 5g ag i d10 4f 17.702110 ( 5g//r1// 4f)= 35.40422 a0 1.0000 4.974043 0.797 1.000 sqrtdel= 1.0000 35.40422 47 -1 0.70 0.50 ag i d10 5g ag i d10 5f -22.516851 ( 5g//r1// 5f)= -45.03370 a0 -0.8618 8.047755-0.601-0.702 sqrtdel= 1.0000 -45.03370 47 -1 0.70 0.50 ag i d10 5g ag i d10 6f 2.054402 ( 5g//r1// 6f)= 4.10880 a0 0.1110 0.066993-0.049-0.086 sqrtdel= 1.0000 4.10880 47 -1 0.70 0.50 ag i d10 5g ag i d10 7f 0.649419 ( 5g//r1// 7f)= 1.29884 a0 0.0496 0.006694-0.025-0.059 sqrtdel= 1.0000 1.29884 47 -1 0.70 0.50 ag i d10 5g ag i d10 8f 0.336579 ( 5g//r1// 8f)= 0.67316 a0 0.0330 0.001798-0.016-0.049 sqrtdel= 1.0000 0.67316 47 -1 0.70 0.50 ag i d10 5g ag i d10 9f 0.214764 ( 5g//r1// 9f)= 0.42953 a0 0.0258 0.000732-0.011-0.043 sqrtdel= 1.0000 0.42953 47 -1 0.70 0.50 ag i d10 5g ag i d9 5s4f 0.000000 ( //r1// )= 0.00000 a0 0.0000 0.000000 0.000 0.000 sqrtdel= 1.0000 0.00000 47 -1 0.70 0.50 ag i d10 5g ag i d9 5s5f 0.000000 ( //r1// )= 0.00000 a0 0.0000 0.000000 0.000 0.000 sqrtdel= 1.0000 0.00000 47 -1 0.70 0.50 ag i d10 5g ag i d9 5s6f 0.000000 ( //r1// )= 0.00000 a0 0.0000 0.000000 0.000 0.000 sqrtdel= 1.0000 0.00000 47 -1 0.70 0.50 ag i d10 5g ag i d9 5s7f 0.000000 ( //r1// )= 0.00000 a0 0.0000 0.000000 0.000 0.000 sqrtdel= 1.0000 0.00000 47 -1 0.70 0.50 ag i d10 5g ag i d9 5s8f 0.000000 ( //r1// )= 0.00000 a0 0.0000 0.000000 0.000 0.000 sqrtdel= 1.0000 0.00000 47 -1 0.70 0.50 ag i d10 5g ag i d9 5s9f 0.000000 ( //r1// )= 0.00000 a0 0.0000 0.000000 0.000 0.000 sqrtdel= 1.0000 0.00000 47 -1 0.70 0.50 ag i d10 5g ag i d8 5s2 4f 0.000000 ( //r1// )= 0.00000 a0 0.0000 0.000000 0.000 0.000 sqrtdel= 1.0000 0.00000 47 -1 0.70 0.50 ag i d10 5g ag i d10 6h 27.214345 ( 5g//r1// 6h)= -60.85313 a0 1.0000 7.481016 0.832 1.000 sqrtdel= 1.0000 -60.85313 47 -1 0.70 0.50 ag i d10 5g ag i d10 7h 7.457386 ( 5g//r1// 7h)= -16.67522 a0 0.4421 0.561744 0.365 0.681 sqrtdel= 1.0000 -16.67522 47 -1 0.70 0.50 ag i d10 5g ag i d10 8h 3.643328 ( 5g//r1// 8h)= -8.14673 a0 0.2911 0.134079 0.222 0.546 sqrtdel= 1.0000 -8.14673 47 -1 0.70 0.50 ag i d10 5g ag i d10 9h 2.249959 ( 5g//r1// 9h)= -5.03106 a0 0.2253 0.051134 0.156 0.476 sqrtdel= 1.0000 -5.03106 47 -1 0.70 0.50 ag i d10 5g ag i d9 5s6h 0.000000 ( //r1// )= 0.00000 a0 0.0000 0.000000 0.000 0.000 sqrtdel= 1.0000 0.00000 47 -1 0.70 0.50 ag i d10 5g ag i d9 5s7h 0.000000 ( //r1// )= 0.00000 a0 0.0000 0.000000 0.000 0.000 sqrtdel= 1.0000 0.00000 47 -1 0.70 0.50 ag i d10 5g ag i d9 5s8h 0.000000 ( //r1// )= 0.00000 a0 0.0000 0.000000 0.000 0.000 sqrtdel= 1.0000 0.00000 47 -1 0.70 0.50 ag i d10 5g ag i d9 5s9h 0.000000 ( //r1// )= 0.00000 a0 0.0000 0.000000 0.000 0.000 sqrtdel= 1.0000 0.00000 47 -1 0.70 0.50 ag i d10 5g ag i d10 8k 0.000000 ( //r1// )= 0.00000 a0 0.0000 0.000000 0.000 0.000 sqrtdel= 1.0000 0.00000 47 -1 0.70 0.50 ag i d10 5g ag i d10 9k 0.000000 ( //r1// )= 0.00000 a0 0.0000 0.000000 0.000 0.000 sqrtdel= 1.0000 0.00000 47 -1 0.70 0.50 ag i d10 5g ag i d9 5s8k 0.000000 ( //r1// )= 0.00000 a0 0.0000 0.000000 0.000 0.000 sqrtdel= 1.0000 0.00000 47 -1 0.70 0.50 ag i d10 5g ag i d9 5s9k 0.000000 ( //r1// )= 0.00000 a0 0.0000 0.000000 0.000 0.000 sqrtdel= 1.0000 0.00000 47 -1 0.70 0.50 ag i d10 6g ag i d10 5p 0.000000 ( //r1// )= 0.00000 a0 0.0000 0.000000 0.000 0.000 sqrtdel= 1.0000 0.00000 47 -1 0.70 0.50 ag i d10 6g ag i d10 6p 0.000000 ( //r1// )= 0.00000 a0 0.0000 0.000000 0.000 0.000 sqrtdel= 1.0000 0.00000 47 -1 0.70 0.50 ag i d10 6g ag i d10 7p 0.000000 ( //r1// )= 0.00000 a0 0.0000 0.000000 0.000 0.000 sqrtdel= 1.0000 0.00000 47 -1 0.70 0.50 ag i d10 6g ag i d10 8p 0.000000 ( //r1// )= 0.00000 a0 0.0000 0.000000 0.000 0.000 sqrtdel= 1.0000 0.00000 47 -1 0.70 0.50 ag i d10 6g ag i d10 9p 0.000000 ( //r1// )= 0.00000 a0 0.0000 0.000000 0.000 0.000 sqrtdel= 1.0000 0.00000 47 -1 0.70 0.50 ag i d10 6g ag i d9 5s5p 0.000000 ( //r1// )= 0.00000 a0 0.0000 0.000000 0.000 0.000 sqrtdel= 1.0000 0.00000 47 -1 0.70 0.50 ag i d10 6g ag i d9 5s6p 0.000000 ( //r1// )= 0.00000 a0 0.0000 0.000000 0.000 0.000 sqrtdel= 1.0000 0.00000 47 -1 0.70 0.50 ag i d10 6g ag i d9 5s7p 0.000000 ( //r1// )= 0.00000 a0 0.0000 0.000000 0.000 0.000 sqrtdel= 1.0000 0.00000 47 -1 0.70 0.50 ag i d10 6g ag i d9 5s8p 0.000000 ( //r1// )= 0.00000 a0 0.0000 0.000000 0.000 0.000 sqrtdel= 1.0000 0.00000 47 -1 0.70 0.50 ag i d10 6g ag i d9 5s9p 0.000000 ( //r1// )= 0.00000 a0 0.0000 0.000000 0.000 0.000 sqrtdel= 1.0000 0.00000 47 -1 0.70 0.50 ag i d10 6g ag i d8 5s2 5p 0.000000 ( //r1// )= 0.00000 a0 0.0000 0.000000 0.000 0.000 sqrtdel= 1.0000 0.00000 47 -1 0.70 0.50 ag i d10 6g ag i d10 4f 5.253710 ( 6g//r1// 4f)= 10.50742 a0 0.5007 0.438118 0.365 0.734 sqrtdel= 1.0000 10.50742 47 -1 0.70 0.50 ag i d10 6g ag i d10 5f 22.494126 ( 6g//r1// 5f)= 44.98825 a0 0.8507 8.031519 0.550 0.777 sqrtdel= 1.0000 44.98825 47 -1 0.70 0.50 ag i d10 6g ag i d10 6f -40.285960 ( 6g//r1// 6f)= -80.57192 a0 -0.9436 25.761247-0.747-0.836 sqrtdel= 1.0000 -80.57192 47 -1 0.70 0.50 ag i d10 6g ag i d10 7f 4.348667 ( 6g//r1// 7f)= 8.69733 a0 0.1360 0.300173-0.062-0.097 sqrtdel= 1.0000 8.69733 47 -1 0.70 0.50 ag i d10 6g ag i d10 8f 1.412500 ( 6g//r1// 8f)= 2.82500 a0 0.0608 0.031669-0.033-0.069 sqrtdel= 1.0000 2.82500 47 -1 0.70 0.50 ag i d10 6g ag i d10 9f 0.739314 ( 6g//r1// 9f)= 1.47863 a0 0.0402 0.008676-0.022-0.057 sqrtdel= 1.0000 1.47863 47 -1 0.70 0.50 ag i d10 6g ag i d9 5s4f 0.000000 ( //r1// )= 0.00000 a0 0.0000 0.000000 0.000 0.000 sqrtdel= 1.0000 0.00000 47 -1 0.70 0.50 ag i d10 6g ag i d9 5s5f 0.000000 ( //r1// )= 0.00000 a0 0.0000 0.000000 0.000 0.000 sqrtdel= 1.0000 0.00000 47 -1 0.70 0.50 ag i d10 6g ag i d9 5s6f 0.000000 ( //r1// )= 0.00000 a0 0.0000 0.000000 0.000 0.000 sqrtdel= 1.0000 0.00000 47 -1 0.70 0.50 ag i d10 6g ag i d9 5s7f 0.000000 ( //r1// )= 0.00000 a0 0.0000 0.000000 0.000 0.000 sqrtdel= 1.0000 0.00000 47 -1 0.70 0.50 ag i d10 6g ag i d9 5s8f 0.000000 ( //r1// )= 0.00000 a0 0.0000 0.000000 0.000 0.000 sqrtdel= 1.0000 0.00000 47 -1 0.70 0.50 ag i d10 6g ag i d9 5s9f 0.000000 ( //r1// )= 0.00000 a0 0.0000 0.000000 0.000 0.000 sqrtdel= 1.0000 0.00000 47 -1 0.70 0.50 ag i d10 6g ag i d8 5s2 4f 0.000000 ( //r1// )= 0.00000 a0 0.0000 0.000000 0.000 0.000 sqrtdel= 1.0000 0.00000 47 -1 0.70 0.50 ag i d10 6g ag i d10 6h -29.849855 ( 6g//r1// 6h)= 66.74631 a0 -0.8230 9.000140-0.553-0.653 sqrtdel= 1.0000 66.74631 47 -1 0.70 0.50 ag i d10 6g ag i d10 7h 33.063977 ( 6g//r1// 7h)= -73.93330 a0 0.8765 11.042693 0.609 0.825 sqrtdel= 1.0000 -73.93330 47 -1 0.70 0.50 ag i d10 6g ag i d10 8h 10.866399 ( 6g//r1// 8h)= -24.29801 a0 0.4139 1.192713 0.330 0.615 sqrtdel= 1.0000 -24.29801 47 -1 0.70 0.50 ag i d10 6g ag i d10 9h 5.706013 ( 6g//r1// 9h)= -12.75903 a0 0.2785 0.328875 0.220 0.512 sqrtdel= 1.0000 -12.75903 47 -1 0.70 0.50 ag i d10 6g ag i d9 5s6h 0.000000 ( //r1// )= 0.00000 a0 0.0000 0.000000 0.000 0.000 sqrtdel= 1.0000 0.00000 47 -1 0.70 0.50 ag i d10 6g ag i d9 5s7h 0.000000 ( //r1// )= 0.00000 a0 0.0000 0.000000 0.000 0.000 sqrtdel= 1.0000 0.00000 47 -1 0.70 0.50 ag i d10 6g ag i d9 5s8h 0.000000 ( //r1// )= 0.00000 a0 0.0000 0.000000 0.000 0.000 sqrtdel= 1.0000 0.00000 47 -1 0.70 0.50 ag i d10 6g ag i d9 5s9h 0.000000 ( //r1// )= 0.00000 a0 0.0000 0.000000 0.000 0.000 sqrtdel= 1.0000 0.00000 47 -1 0.70 0.50 ag i d10 6g ag i d10 8k 0.000000 ( //r1// )= 0.00000 a0 0.0000 0.000000 0.000 0.000 sqrtdel= 1.0000 0.00000 47 -1 0.70 0.50 ag i d10 6g ag i d10 9k 0.000000 ( //r1// )= 0.00000 a0 0.0000 0.000000 0.000 0.000 sqrtdel= 1.0000 0.00000 47 -1 0.70 0.50 ag i d10 6g ag i d9 5s8k 0.000000 ( //r1// )= 0.00000 a0 0.0000 0.000000 0.000 0.000 sqrtdel= 1.0000 0.00000 47 -1 0.70 0.50 ag i d10 6g ag i d9 5s9k 0.000000 ( //r1// )= 0.00000 a0 0.0000 0.000000 0.000 0.000 sqrtdel= 1.0000 0.00000 47 -1 0.70 0.50 ag i d10 7g ag i d10 5p 0.000000 ( //r1// )= 0.00000 a0 0.0000 0.000000 0.000 0.000 sqrtdel= 1.0000 0.00000 47 -1 0.70 0.50 ag i d10 7g ag i d10 6p 0.000000 ( //r1// )= 0.00000 a0 0.0000 0.000000 0.000 0.000 sqrtdel= 1.0000 0.00000 47 -1 0.70 0.50 ag i d10 7g ag i d10 7p 0.000000 ( //r1// )= 0.00000 a0 0.0000 0.000000 0.000 0.000 sqrtdel= 1.0000 0.00000 47 -1 0.70 0.50 ag i d10 7g ag i d10 8p 0.000000 ( //r1// )= 0.00000 a0 0.0000 0.000000 0.000 0.000 sqrtdel= 1.0000 0.00000 47 -1 0.70 0.50 ag i d10 7g ag i d10 9p 0.000000 ( //r1// )= 0.00000 a0 0.0000 0.000000 0.000 0.000 sqrtdel= 1.0000 0.00000 47 -1 0.70 0.50 ag i d10 7g ag i d9 5s5p 0.000000 ( //r1// )= 0.00000 a0 0.0000 0.000000 0.000 0.000 sqrtdel= 1.0000 0.00000 47 -1 0.70 0.50 ag i d10 7g ag i d9 5s6p 0.000000 ( //r1// )= 0.00000 a0 0.0000 0.000000 0.000 0.000 sqrtdel= 1.0000 0.00000 47 -1 0.70 0.50 ag i d10 7g ag i d9 5s7p 0.000000 ( //r1// )= 0.00000 a0 0.0000 0.000000 0.000 0.000 sqrtdel= 1.0000 0.00000 47 -1 0.70 0.50 ag i d10 7g ag i d9 5s8p 0.000000 ( //r1// )= 0.00000 a0 0.0000 0.000000 0.000 0.000 sqrtdel= 1.0000 0.00000 47 -1 0.70 0.50 ag i d10 7g ag i d9 5s9p 0.000000 ( //r1// )= 0.00000 a0 0.0000 0.000000 0.000 0.000 sqrtdel= 1.0000 0.00000 47 -1 0.70 0.50 ag i d10 7g ag i d8 5s2 5p 0.000000 ( //r1// )= 0.00000 a0 0.0000 0.000000 0.000 0.000 sqrtdel= 1.0000 0.00000 47 -1 0.70 0.50 ag i d10 7g ag i d10 4f 2.701854 ( 7g//r1// 4f)= 5.40371 a0 0.3550 0.115873 0.227 0.618 sqrtdel= 1.0000 5.40371 47 -1 0.70 0.50 ag i d10 7g ag i d10 5f 7.826471 ( 7g//r1// 5f)= 15.65294 a0 0.4418 0.972280 0.306 0.618 sqrtdel= 1.0000 15.65294 47 -1 0.70 0.50 ag i d10 7g ag i d10 6f 27.963641 ( 7g//r1// 6f)= 55.92728 a0 0.7289 12.412147 0.411 0.596 sqrtdel= 1.0000 55.92728 47 -1 0.70 0.50 ag i d10 7g ag i d10 7f -60.377334 ( 7g//r1// 7f)=-120.75467 a0 -0.9709 57.863849-0.823-0.897 sqrtdel= 1.0000 -120.75467 47 -1 0.70 0.50 ag i d10 7g ag i d10 8f 7.280480 ( 7g//r1// 8f)= 14.56096 a0 0.1521 0.841355-0.067-0.098 sqrtdel= 1.0000 14.56096 47 -1 0.70 0.50 ag i d10 7g ag i d10 9f 2.401766 ( 7g//r1// 9f)= 4.80353 a0 0.0682 0.091563-0.037-0.072 sqrtdel= 1.0000 4.80353 47 -1 0.70 0.50 ag i d10 7g ag i d9 5s4f 0.000000 ( //r1// )= 0.00000 a0 0.0000 0.000000 0.000 0.000 sqrtdel= 1.0000 0.00000 47 -1 0.70 0.50 ag i d10 7g ag i d9 5s5f 0.000000 ( //r1// )= 0.00000 a0 0.0000 0.000000 0.000 0.000 sqrtdel= 1.0000 0.00000 47 -1 0.70 0.50 ag i d10 7g ag i d9 5s6f 0.000000 ( //r1// )= 0.00000 a0 0.0000 0.000000 0.000 0.000 sqrtdel= 1.0000 0.00000 47 -1 0.70 0.50 ag i d10 7g ag i d9 5s7f 0.000000 ( //r1// )= 0.00000 a0 0.0000 0.000000 0.000 0.000 sqrtdel= 1.0000 0.00000 47 -1 0.70 0.50 ag i d10 7g ag i d9 5s8f 0.000000 ( //r1// )= 0.00000 a0 0.0000 0.000000 0.000 0.000 sqrtdel= 1.0000 0.00000 47 -1 0.70 0.50 ag i d10 7g ag i d9 5s9f 0.000000 ( //r1// )= 0.00000 a0 0.0000 0.000000 0.000 0.000 sqrtdel= 1.0000 0.00000 47 -1 0.70 0.50 ag i d10 7g ag i d8 5s2 4f 0.000000 ( //r1// )= 0.00000 a0 0.0000 0.000000 0.000 0.000 sqrtdel= 1.0000 0.00000 47 -1 0.70 0.50 ag i d10 7g ag i d10 6h 2.374651 ( 7g//r1// 6h)= -5.30988 a0 0.0902 0.056959-0.044-0.075 sqrtdel= 1.0000 -5.30988 47 -1 0.70 0.50 ag i d10 7g ag i d10 7h -51.439949 ( 7g//r1// 7h)= 115.02322 a0 -0.9208 26.727963-0.700-0.794 sqrtdel= 1.0000 115.02322 47 -1 0.70 0.50 ag i d10 7g ag i d10 8h 39.640038 ( 7g//r1// 8h)= -88.63782 a0 0.7678 15.872046 0.474 0.666 sqrtdel= 1.0000 -88.63782 47 -1 0.70 0.50 ag i d10 7g ag i d10 9h 13.958574 ( 7g//r1// 9h)= -31.21232 a0 0.3706 1.968099 0.281 0.523 sqrtdel= 1.0000 -31.21232 47 -1 0.70 0.50 ag i d10 7g ag i d9 5s6h 0.000000 ( //r1// )= 0.00000 a0 0.0000 0.000000 0.000 0.000 sqrtdel= 1.0000 0.00000 47 -1 0.70 0.50 ag i d10 7g ag i d9 5s7h 0.000000 ( //r1// )= 0.00000 a0 0.0000 0.000000 0.000 0.000 sqrtdel= 1.0000 0.00000 47 -1 0.70 0.50 ag i d10 7g ag i d9 5s8h 0.000000 ( //r1// )= 0.00000 a0 0.0000 0.000000 0.000 0.000 sqrtdel= 1.0000 0.00000 47 -1 0.70 0.50 ag i d10 7g ag i d9 5s9h 0.000000 ( //r1// )= 0.00000 a0 0.0000 0.000000 0.000 0.000 sqrtdel= 1.0000 0.00000 47 -1 0.70 0.50 ag i d10 7g ag i d10 8k 0.000000 ( //r1// )= 0.00000 a0 0.0000 0.000000 0.000 0.000 sqrtdel= 1.0000 0.00000 47 -1 0.70 0.50 ag i d10 7g ag i d10 9k 0.000000 ( //r1// )= 0.00000 a0 0.0000 0.000000 0.000 0.000 sqrtdel= 1.0000 0.00000 47 -1 0.70 0.50 ag i d10 7g ag i d9 5s8k 0.000000 ( //r1// )= 0.00000 a0 0.0000 0.000000 0.000 0.000 sqrtdel= 1.0000 0.00000 47 -1 0.70 0.50 ag i d10 7g ag i d9 5s9k 0.000000 ( //r1// )= 0.00000 a0 0.0000 0.000000 0.000 0.000 sqrtdel= 1.0000 0.00000 47 -1 0.70 0.50 ag i d10 8g ag i d10 5p 0.000000 ( //r1// )= 0.00000 a0 0.0000 0.000000 0.000 0.000 sqrtdel= 1.0000 0.00000 47 -1 0.70 0.50 ag i d10 8g ag i d10 6p 0.000000 ( //r1// )= 0.00000 a0 0.0000 0.000000 0.000 0.000 sqrtdel= 1.0000 0.00000 47 -1 0.70 0.50 ag i d10 8g ag i d10 7p 0.000000 ( //r1// )= 0.00000 a0 0.0000 0.000000 0.000 0.000 sqrtdel= 1.0000 0.00000 47 -1 0.70 0.50 ag i d10 8g ag i d10 8p 0.000000 ( //r1// )= 0.00000 a0 0.0000 0.000000 0.000 0.000 sqrtdel= 1.0000 0.00000 47 -1 0.70 0.50 ag i d10 8g ag i d10 9p 0.000000 ( //r1// )= 0.00000 a0 0.0000 0.000000 0.000 0.000 sqrtdel= 1.0000 0.00000 47 -1 0.70 0.50 ag i d10 8g ag i d9 5s5p 0.000000 ( //r1// )= 0.00000 a0 0.0000 0.000000 0.000 0.000 sqrtdel= 1.0000 0.00000 47 -1 0.70 0.50 ag i d10 8g ag i d9 5s6p 0.000000 ( //r1// )= 0.00000 a0 0.0000 0.000000 0.000 0.000 sqrtdel= 1.0000 0.00000 47 -1 0.70 0.50 ag i d10 8g ag i d9 5s7p 0.000000 ( //r1// )= 0.00000 a0 0.0000 0.000000 0.000 0.000 sqrtdel= 1.0000 0.00000 47 -1 0.70 0.50 ag i d10 8g ag i d9 5s8p 0.000000 ( //r1// )= 0.00000 a0 0.0000 0.000000 0.000 0.000 sqrtdel= 1.0000 0.00000 47 -1 0.70 0.50 ag i d10 8g ag i d9 5s9p 0.000000 ( //r1// )= 0.00000 a0 0.0000 0.000000 0.000 0.000 sqrtdel= 1.0000 0.00000 47 -1 0.70 0.50 ag i d10 8g ag i d8 5s2 5p 0.000000 ( //r1// )= 0.00000 a0 0.0000 0.000000 0.000 0.000 sqrtdel= 1.0000 0.00000 47 -1 0.70 0.50 ag i d10 8g ag i d10 4f 1.727415 ( 8g//r1// 4f)= 3.45483 a0 0.2894 0.047364 0.162 0.557 sqrtdel= 1.0000 3.45483 47 -1 0.70 0.50 ag i d10 8g ag i d10 5f 4.270185 ( 8g//r1// 5f)= 8.54037 a0 0.3152 0.289436 0.208 0.535 sqrtdel= 1.0000 8.54037 47 -1 0.70 0.50 ag i d10 8g ag i d10 6f 10.278200 ( 8g//r1// 6f)= 20.55640 a0 0.3801 1.676847 0.249 0.495 sqrtdel= 1.0000 20.55640 47 -1 0.70 0.50 ag i d10 8g ag i d10 7f 34.086871 ( 8g//r1// 7f)= 68.17374 a0 0.6422 18.443092 0.325 0.468 sqrtdel= 1.0000 68.17374 47 -1 0.70 0.50 ag i d10 8g ag i d10 8f -83.222182 ( 8g//r1// 8f)=-166.44436 a0 -0.9828 109.935423-0.868-0.930 sqrtdel= 1.0000 -166.44436 47 -1 0.70 0.50 ag i d10 8g ag i d10 9f 10.870152 ( 8g//r1// 9f)= 21.74030 a0 0.1641 1.875559-0.068-0.096 sqrtdel= 1.0000 21.74030 47 -1 0.70 0.50 ag i d10 8g ag i d9 5s4f 0.000000 ( //r1// )= 0.00000 a0 0.0000 0.000000 0.000 0.000 sqrtdel= 1.0000 0.00000 47 -1 0.70 0.50 ag i d10 8g ag i d9 5s5f 0.000000 ( //r1// )= 0.00000 a0 0.0000 0.000000 0.000 0.000 sqrtdel= 1.0000 0.00000 47 -1 0.70 0.50 ag i d10 8g ag i d9 5s6f 0.000000 ( //r1// )= 0.00000 a0 0.0000 0.000000 0.000 0.000 sqrtdel= 1.0000 0.00000 47 -1 0.70 0.50 ag i d10 8g ag i d9 5s7f 0.000000 ( //r1// )= 0.00000 a0 0.0000 0.000000 0.000 0.000 sqrtdel= 1.0000 0.00000 47 -1 0.70 0.50 ag i d10 8g ag i d9 5s8f 0.000000 ( //r1// )= 0.00000 a0 0.0000 0.000000 0.000 0.000 sqrtdel= 1.0000 0.00000 47 -1 0.70 0.50 ag i d10 8g ag i d9 5s9f 0.000000 ( //r1// )= 0.00000 a0 0.0000 0.000000 0.000 0.000 sqrtdel= 1.0000 0.00000 47 -1 0.70 0.50 ag i d10 8g ag i d8 5s2 4f 0.000000 ( //r1// )= 0.00000 a0 0.0000 0.000000 0.000 0.000 sqrtdel= 1.0000 0.00000 47 -1 0.70 0.50 ag i d10 8g ag i d10 6h 0.699723 ( 8g//r1// 6h)= -1.56463 a0 0.0364 0.004946-0.021-0.048 sqrtdel= 1.0000 -1.56463 47 -1 0.70 0.50 ag i d10 8g ag i d10 7h 4.869393 ( 8g//r1// 7h)= -10.88829 a0 0.1140 0.239505-0.058-0.089 sqrtdel= 1.0000 -10.88829 47 -1 0.70 0.50 ag i d10 8g ag i d10 8h -74.940878 ( 8g//r1// 8h)= 167.57290 a0 -0.9566 56.728638-0.781-0.864 sqrtdel= 1.0000 167.57290 47 -1 0.70 0.50 ag i d10 8g ag i d10 9h 46.912382 ( 8g//r1// 9h)=-104.89928 a0 0.6846 22.230016 0.385 0.544 sqrtdel= 1.0000 -104.89928 47 -1 0.70 0.50 ag i d10 8g ag i d9 5s6h 0.000000 ( //r1// )= 0.00000 a0 0.0000 0.000000 0.000 0.000 sqrtdel= 1.0000 0.00000 47 -1 0.70 0.50 ag i d10 8g ag i d9 5s7h 0.000000 ( //r1// )= 0.00000 a0 0.0000 0.000000 0.000 0.000 sqrtdel= 1.0000 0.00000 47 -1 0.70 0.50 ag i d10 8g ag i d9 5s8h 0.000000 ( //r1// )= 0.00000 a0 0.0000 0.000000 0.000 0.000 sqrtdel= 1.0000 0.00000 47 -1 0.70 0.50 ag i d10 8g ag i d9 5s9h 0.000000 ( //r1// )= 0.00000 a0 0.0000 0.000000 0.000 0.000 sqrtdel= 1.0000 0.00000 47 -1 0.70 0.50 ag i d10 8g ag i d10 8k 0.000000 ( //r1// )= 0.00000 a0 0.0000 0.000000 0.000 0.000 sqrtdel= 1.0000 0.00000 47 -1 0.70 0.50 ag i d10 8g ag i d10 9k 0.000000 ( //r1// )= 0.00000 a0 0.0000 0.000000 0.000 0.000 sqrtdel= 1.0000 0.00000 47 -1 0.70 0.50 ag i d10 8g ag i d9 5s8k 0.000000 ( //r1// )= 0.00000 a0 0.0000 0.000000 0.000 0.000 sqrtdel= 1.0000 0.00000 47 -1 0.70 0.50 ag i d10 8g ag i d9 5s9k 0.000000 ( //r1// )= 0.00000 a0 0.0000 0.000000 0.000 0.000 sqrtdel= 1.0000 0.00000 47 -1 0.70 0.50 ag i d10 9g ag i d10 5p 0.000000 ( //r1// )= 0.00000 a0 0.0000 0.000000 0.000 0.000 sqrtdel= 1.0000 0.00000 47 -1 0.70 0.50 ag i d10 9g ag i d10 6p 0.000000 ( //r1// )= 0.00000 a0 0.0000 0.000000 0.000 0.000 sqrtdel= 1.0000 0.00000 47 -1 0.70 0.50 ag i d10 9g ag i d10 7p 0.000000 ( //r1// )= 0.00000 a0 0.0000 0.000000 0.000 0.000 sqrtdel= 1.0000 0.00000 47 -1 0.70 0.50 ag i d10 9g ag i d10 8p 0.000000 ( //r1// )= 0.00000 a0 0.0000 0.000000 0.000 0.000 sqrtdel= 1.0000 0.00000 47 -1 0.70 0.50 ag i d10 9g ag i d10 9p 0.000000 ( //r1// )= 0.00000 a0 0.0000 0.000000 0.000 0.000 sqrtdel= 1.0000 0.00000 47 -1 0.70 0.50 ag i d10 9g ag i d9 5s5p 0.000000 ( //r1// )= 0.00000 a0 0.0000 0.000000 0.000 0.000 sqrtdel= 1.0000 0.00000 47 -1 0.70 0.50 ag i d10 9g ag i d9 5s6p 0.000000 ( //r1// )= 0.00000 a0 0.0000 0.000000 0.000 0.000 sqrtdel= 1.0000 0.00000 47 -1 0.70 0.50 ag i d10 9g ag i d9 5s7p 0.000000 ( //r1// )= 0.00000 a0 0.0000 0.000000 0.000 0.000 sqrtdel= 1.0000 0.00000 47 -1 0.70 0.50 ag i d10 9g ag i d9 5s8p 0.000000 ( //r1// )= 0.00000 a0 0.0000 0.000000 0.000 0.000 sqrtdel= 1.0000 0.00000 47 -1 0.70 0.50 ag i d10 9g ag i d9 5s9p 0.000000 ( //r1// )= 0.00000 a0 0.0000 0.000000 0.000 0.000 sqrtdel= 1.0000 0.00000 47 -1 0.70 0.50 ag i d10 9g ag i d8 5s2 5p 0.000000 ( //r1// )= 0.00000 a0 0.0000 0.000000 0.000 0.000 sqrtdel= 1.0000 0.00000 47 -1 0.70 0.50 ag i d10 9g ag i d10 4f 1.237523 ( 9g//r1// 4f)= 2.47505 a0 0.2540 0.024309 0.124 0.520 sqrtdel= 1.0000 2.47505 47 -1 0.70 0.50 ag i d10 9g ag i d10 5f 2.810877 ( 9g//r1// 5f)= 5.62175 a0 0.2563 0.125413 0.155 0.487 sqrtdel= 1.0000 5.62175 47 -1 0.70 0.50 ag i d10 9g ag i d10 6f 5.754672 ( 9g//r1// 6f)= 11.50934 a0 0.2711 0.525655 0.177 0.438 sqrtdel= 1.0000 11.50934 47 -1 0.70 0.50 ag i d10 9g ag i d10 7f 12.817342 ( 9g//r1// 7f)= 25.63468 a0 0.3325 2.607686 0.206 0.399 sqrtdel= 1.0000 25.63468 47 -1 0.70 0.50 ag i d10 9g ag i d10 8f 40.852701 ( 9g//r1// 8f)= 81.70540 a0 0.5808 26.491161 0.266 0.380 sqrtdel= 1.0000 81.70540 47 -1 0.70 0.50 ag i d10 9g ag i d10 9f -108.949458 ( 9g//r1// 9f)=-217.89892 a0 -0.9890 188.412452-0.898-0.950 sqrtdel= 1.0000 -217.89892 47 -1 0.70 0.50 ag i d10 9g ag i d9 5s4f 0.000000 ( //r1// )= 0.00000 a0 0.0000 0.000000 0.000 0.000 sqrtdel= 1.0000 0.00000 47 -1 0.70 0.50 ag i d10 9g ag i d9 5s5f 0.000000 ( //r1// )= 0.00000 a0 0.0000 0.000000 0.000 0.000 sqrtdel= 1.0000 0.00000 47 -1 0.70 0.50 ag i d10 9g ag i d9 5s6f 0.000000 ( //r1// )= 0.00000 a0 0.0000 0.000000 0.000 0.000 sqrtdel= 1.0000 0.00000 47 -1 0.70 0.50 ag i d10 9g ag i d9 5s7f 0.000000 ( //r1// )= 0.00000 a0 0.0000 0.000000 0.000 0.000 sqrtdel= 1.0000 0.00000 47 -1 0.70 0.50 ag i d10 9g ag i d9 5s8f 0.000000 ( //r1// )= 0.00000 a0 0.0000 0.000000 0.000 0.000 sqrtdel= 1.0000 0.00000 47 -1 0.70 0.50 ag i d10 9g ag i d9 5s9f 0.000000 ( //r1// )= 0.00000 a0 0.0000 0.000000 0.000 0.000 sqrtdel= 1.0000 0.00000 47 -1 0.70 0.50 ag i d10 9g ag i d8 5s2 4f 0.000000 ( //r1// )= 0.00000 a0 0.0000 0.000000 0.000 0.000 sqrtdel= 1.0000 0.00000 47 -1 0.70 0.50 ag i d10 9g ag i d10 6h 0.344950 ( 9g//r1// 6h)= -0.77133 a0 0.0226 0.001202-0.013-0.038 sqrtdel= 1.0000 -0.77133 47 -1 0.70 0.50 ag i d10 9g ag i d10 7h 1.495116 ( 9g//r1// 7h)= -3.34318 a0 0.0470 0.022580-0.030-0.060 sqrtdel= 1.0000 -3.34318 47 -1 0.70 0.50 ag i d10 9g ag i d10 8h 7.968464 ( 9g//r1// 8h)= -17.81803 a0 0.1299 0.641378-0.065-0.095 sqrtdel= 1.0000 -17.81803 47 -1 0.70 0.50 ag i d10 9g ag i d10 9h -101.026299 ( 9g//r1// 9h)= 225.90167 a0 -0.9733 103.094072-0.832-0.903 sqrtdel= 1.0000 225.90167 47 -1 0.70 0.50 ag i d10 9g ag i d9 5s6h 0.000000 ( //r1// )= 0.00000 a0 0.0000 0.000000 0.000 0.000 sqrtdel= 1.0000 0.00000 47 -1 0.70 0.50 ag i d10 9g ag i d9 5s7h 0.000000 ( //r1// )= 0.00000 a0 0.0000 0.000000 0.000 0.000 sqrtdel= 1.0000 0.00000 47 -1 0.70 0.50 ag i d10 9g ag i d9 5s8h 0.000000 ( //r1// )= 0.00000 a0 0.0000 0.000000 0.000 0.000 sqrtdel= 1.0000 0.00000 47 -1 0.70 0.50 ag i d10 9g ag i d9 5s9h 0.000000 ( //r1// )= 0.00000 a0 0.0000 0.000000 0.000 0.000 sqrtdel= 1.0000 0.00000 47 -1 0.70 0.50 ag i d10 9g ag i d10 8k 0.000000 ( //r1// )= 0.00000 a0 0.0000 0.000000 0.000 0.000 sqrtdel= 1.0000 0.00000 47 -1 0.70 0.50 ag i d10 9g ag i d10 9k 0.000000 ( //r1// )= 0.00000 a0 0.0000 0.000000 0.000 0.000 sqrtdel= 1.0000 0.00000 47 -1 0.70 0.50 ag i d10 9g ag i d9 5s8k 0.000000 ( //r1// )= 0.00000 a0 0.0000 0.000000 0.000 0.000 sqrtdel= 1.0000 0.00000 47 -1 0.70 0.50 ag i d10 9g ag i d9 5s9k 0.000000 ( //r1// )= 0.00000 a0 0.0000 0.000000 0.000 0.000 sqrtdel= 1.0000 0.00000 47 -1 0.70 0.50 ag i d9 5s5g ag i d10 5p 0.000000 ( //r1// )= 0.00000 a0 0.0000 0.000000 0.000 0.000 sqrtdel= 1.0000 0.00000 47 -1 0.70 0.50 ag i d9 5s5g ag i d10 6p 0.000000 ( //r1// )= 0.00000 a0 0.0000 0.000000 0.000 0.000 sqrtdel= 1.0000 0.00000 47 -1 0.70 0.50 ag i d9 5s5g ag i d10 7p 0.000000 ( //r1// )= 0.00000 a0 0.0000 0.000000 0.000 0.000 sqrtdel= 1.0000 0.00000 47 -1 0.70 0.50 ag i d9 5s5g ag i d10 8p 0.000000 ( //r1// )= 0.00000 a0 0.0000 0.000000 0.000 0.000 sqrtdel= 1.0000 0.00000 47 -1 0.70 0.50 ag i d9 5s5g ag i d10 9p 0.000000 ( //r1// )= 0.00000 a0 0.0000 0.000000 0.000 0.000 sqrtdel= 1.0000 0.00000 47 -1 0.70 0.50 ag i d9 5s5g ag i d9 5s5p 0.000000 ( //r1// )= 0.00000 a0 0.0000 0.000000 0.000 0.000 sqrtdel= 1.0000 0.00000 47 -1 0.70 0.50 ag i d9 5s5g ag i d9 5s6p 0.000000 ( //r1// )= 0.00000 a0 0.0000 0.000000 0.000 0.000 sqrtdel= 1.0000 0.00000 47 -1 0.70 0.50 ag i d9 5s5g ag i d9 5s7p 0.000000 ( //r1// )= 0.00000 a0 0.0000 0.000000 0.000 0.000 sqrtdel= 1.0000 0.00000 47 -1 0.70 0.50 ag i d9 5s5g ag i d9 5s8p 0.000000 ( //r1// )= 0.00000 a0 0.0000 0.000000 0.000 0.000 sqrtdel= 1.0000 0.00000 47 -1 0.70 0.50 ag i d9 5s5g ag i d9 5s9p 0.000000 ( //r1// )= 0.00000 a0 0.0000 0.000000 0.000 0.000 sqrtdel= 1.0000 0.00000 47 -1 0.70 0.50 ag i d9 5s5g ag i d8 5s2 5p 0.000000 ( //r1// )= 0.00000 a0 0.0000 0.000000 0.000 0.000 sqrtdel= 1.0000 0.00000 47 -1 0.70 0.50 ag i d9 5s5g ag i d10 4f 0.000000 ( //r1// )= 0.00000 a0 0.0000 0.000000 0.000 0.000 sqrtdel= 1.0000 0.00000 47 -1 0.70 0.50 ag i d9 5s5g ag i d10 5f 0.000000 ( //r1// )= 0.00000 a0 0.0000 0.000000 0.000 0.000 sqrtdel= 1.0000 0.00000 47 -1 0.70 0.50 ag i d9 5s5g ag i d10 6f 0.000000 ( //r1// )= 0.00000 a0 0.0000 0.000000 0.000 0.000 sqrtdel= 1.0000 0.00000 47 -1 0.70 0.50 ag i d9 5s5g ag i d10 7f 0.000000 ( //r1// )= 0.00000 a0 0.0000 0.000000 0.000 0.000 sqrtdel= 1.0000 0.00000 47 -1 0.70 0.50 ag i d9 5s5g ag i d10 8f 0.000000 ( //r1// )= 0.00000 a0 0.0000 0.000000 0.000 0.000 sqrtdel= 1.0000 0.00000 47 -1 0.70 0.50 ag i d9 5s5g ag i d10 9f 0.000000 ( //r1// )= 0.00000 a0 0.0000 0.000000 0.000 0.000 sqrtdel= 1.0000 0.00000 47 -1 0.70 0.50 ag i d9 5s5g ag i d9 5s4f 17.674623 ( 5g//r1// 4f)= 35.34925 a0 1.0000 4.958608 0.796 1.000 sqrtdel= 1.0000 35.34925 47 -1 0.70 0.50 ag i d9 5s5g ag i d9 5s5f -22.542868 ( 5g//r1// 5f)= -45.08574 a0 -0.8628 8.066364-0.603-0.704 sqrtdel= 1.0000 -45.08574 47 -1 0.70 0.50 ag i d9 5s5g ag i d9 5s6f 2.112150 ( 5g//r1// 6f)= 4.22430 a0 0.1140 0.070812-0.048-0.084 sqrtdel= 1.0000 4.22430 47 -1 0.70 0.50 ag i d9 5s5g ag i d9 5s7f 0.671259 ( 5g//r1// 7f)= 1.34252 a0 0.0512 0.007152-0.024-0.058 sqrtdel= 1.0000 1.34252 47 -1 0.70 0.50 ag i d9 5s5g ag i d9 5s8f 0.350039 ( 5g//r1// 8f)= 0.70008 a0 0.0343 0.001945-0.016-0.048 sqrtdel= 1.0000 0.70008 47 -1 0.70 0.50 ag i d9 5s5g ag i d9 5s9f 0.224618 ( 5g//r1// 9f)= 0.44924 a0 0.0270 0.000801-0.011-0.042 sqrtdel= 1.0000 0.44924 47 -1 0.70 0.50 ag i d9 5s5g ag i d8 5s2 4f 0.000000 ( //r1// )= 0.00000 a0 0.0000 0.000000 0.000 0.000 sqrtdel= 1.0000 0.00000 47 -1 0.70 0.50 ag i d9 5s5g ag i d10 6h 0.000000 ( //r1// )= 0.00000 a0 0.0000 0.000000 0.000 0.000 sqrtdel= 1.0000 0.00000 47 -1 0.70 0.50 ag i d9 5s5g ag i d10 7h 0.000000 ( //r1// )= 0.00000 a0 0.0000 0.000000 0.000 0.000 sqrtdel= 1.0000 0.00000 47 -1 0.70 0.50 ag i d9 5s5g ag i d10 8h 0.000000 ( //r1// )= 0.00000 a0 0.0000 0.000000 0.000 0.000 sqrtdel= 1.0000 0.00000 47 -1 0.70 0.50 ag i d9 5s5g ag i d10 9h 0.000000 ( //r1// )= 0.00000 a0 0.0000 0.000000 0.000 0.000 sqrtdel= 1.0000 0.00000 47 -1 0.70 0.50 ag i d9 5s5g ag i d9 5s6h 27.213796 ( 5g//r1// 6h)= -60.85190 a0 1.0000 7.480714 0.832 1.000 sqrtdel= 1.0000 -60.85190 47 -1 0.70 0.50 ag i d9 5s5g ag i d9 5s7h 7.457517 ( 5g//r1// 7h)= -16.67552 a0 0.4421 0.561763 0.365 0.681 sqrtdel= 1.0000 -16.67552 47 -1 0.70 0.50 ag i d9 5s5g ag i d9 5s8h 3.643464 ( 5g//r1// 8h)= -8.14703 a0 0.2911 0.134089 0.222 0.546 sqrtdel= 1.0000 -8.14703 47 -1 0.70 0.50 ag i d9 5s5g ag i d9 5s9h 2.250071 ( 5g//r1// 9h)= -5.03131 a0 0.2253 0.051140 0.156 0.476 sqrtdel= 1.0000 -5.03131 47 -1 0.70 0.50 ag i d9 5s5g ag i d10 8k 0.000000 ( //r1// )= 0.00000 a0 0.0000 0.000000 0.000 0.000 sqrtdel= 1.0000 0.00000 47 -1 0.70 0.50 ag i d9 5s5g ag i d10 9k 0.000000 ( //r1// )= 0.00000 a0 0.0000 0.000000 0.000 0.000 sqrtdel= 1.0000 0.00000 47 -1 0.70 0.50 ag i d9 5s5g ag i d9 5s8k 0.000000 ( //r1// )= 0.00000 a0 0.0000 0.000000 0.000 0.000 sqrtdel= 1.0000 0.00000 47 -1 0.70 0.50 ag i d9 5s5g ag i d9 5s9k 0.000000 ( //r1// )= 0.00000 a0 0.0000 0.000000 0.000 0.000 sqrtdel= 1.0000 0.00000 47 -1 0.70 0.50 ag i d9 5s6g ag i d10 5p 0.000000 ( //r1// )= 0.00000 a0 0.0000 0.000000 0.000 0.000 sqrtdel= 1.0000 0.00000 47 -1 0.70 0.50 ag i d9 5s6g ag i d10 6p 0.000000 ( //r1// )= 0.00000 a0 0.0000 0.000000 0.000 0.000 sqrtdel= 1.0000 0.00000 47 -1 0.70 0.50 ag i d9 5s6g ag i d10 7p 0.000000 ( //r1// )= 0.00000 a0 0.0000 0.000000 0.000 0.000 sqrtdel= 1.0000 0.00000 47 -1 0.70 0.50 ag i d9 5s6g ag i d10 8p 0.000000 ( //r1// )= 0.00000 a0 0.0000 0.000000 0.000 0.000 sqrtdel= 1.0000 0.00000 47 -1 0.70 0.50 ag i d9 5s6g ag i d10 9p 0.000000 ( //r1// )= 0.00000 a0 0.0000 0.000000 0.000 0.000 sqrtdel= 1.0000 0.00000 47 -1 0.70 0.50 ag i d9 5s6g ag i d9 5s5p 0.000000 ( //r1// )= 0.00000 a0 0.0000 0.000000 0.000 0.000 sqrtdel= 1.0000 0.00000 47 -1 0.70 0.50 ag i d9 5s6g ag i d9 5s6p 0.000000 ( //r1// )= 0.00000 a0 0.0000 0.000000 0.000 0.000 sqrtdel= 1.0000 0.00000 47 -1 0.70 0.50 ag i d9 5s6g ag i d9 5s7p 0.000000 ( //r1// )= 0.00000 a0 0.0000 0.000000 0.000 0.000 sqrtdel= 1.0000 0.00000 47 -1 0.70 0.50 ag i d9 5s6g ag i d9 5s8p 0.000000 ( //r1// )= 0.00000 a0 0.0000 0.000000 0.000 0.000 sqrtdel= 1.0000 0.00000 47 -1 0.70 0.50 ag i d9 5s6g ag i d9 5s9p 0.000000 ( //r1// )= 0.00000 a0 0.0000 0.000000 0.000 0.000 sqrtdel= 1.0000 0.00000 47 -1 0.70 0.50 ag i d9 5s6g ag i d8 5s2 5p 0.000000 ( //r1// )= 0.00000 a0 0.0000 0.000000 0.000 0.000 sqrtdel= 1.0000 0.00000 47 -1 0.70 0.50 ag i d9 5s6g ag i d10 4f 0.000000 ( //r1// )= 0.00000 a0 0.0000 0.000000 0.000 0.000 sqrtdel= 1.0000 0.00000 47 -1 0.70 0.50 ag i d9 5s6g ag i d10 5f 0.000000 ( //r1// )= 0.00000 a0 0.0000 0.000000 0.000 0.000 sqrtdel= 1.0000 0.00000 47 -1 0.70 0.50 ag i d9 5s6g ag i d10 6f 0.000000 ( //r1// )= 0.00000 a0 0.0000 0.000000 0.000 0.000 sqrtdel= 1.0000 0.00000 47 -1 0.70 0.50 ag i d9 5s6g ag i d10 7f 0.000000 ( //r1// )= 0.00000 a0 0.0000 0.000000 0.000 0.000 sqrtdel= 1.0000 0.00000 47 -1 0.70 0.50 ag i d9 5s6g ag i d10 8f 0.000000 ( //r1// )= 0.00000 a0 0.0000 0.000000 0.000 0.000 sqrtdel= 1.0000 0.00000 47 -1 0.70 0.50 ag i d9 5s6g ag i d10 9f 0.000000 ( //r1// )= 0.00000 a0 0.0000 0.000000 0.000 0.000 sqrtdel= 1.0000 0.00000 47 -1 0.70 0.50 ag i d9 5s6g ag i d9 5s4f 5.257869 ( 6g//r1// 4f)= 10.51574 a0 0.5018 0.438813 0.365 0.735 sqrtdel= 1.0000 10.51574 47 -1 0.70 0.50 ag i d9 5s6g ag i d9 5s5f 22.384918 ( 6g//r1// 5f)= 44.76984 a0 0.8490 7.953723 0.547 0.774 sqrtdel= 1.0000 44.76984 47 -1 0.70 0.50 ag i d9 5s6g ag i d9 5s6f -40.343341 ( 6g//r1// 6f)= -80.68668 a0 -0.9447 25.834685-0.750-0.838 sqrtdel= 1.0000 -80.68668 47 -1 0.70 0.50 ag i d9 5s6g ag i d9 5s7f 4.494640 ( 6g//r1// 7f)= 8.98928 a0 0.1403 0.320663-0.060-0.094 sqrtdel= 1.0000 8.98928 47 -1 0.70 0.50 ag i d9 5s6g ag i d9 5s8f 1.463647 ( 6g//r1// 8f)= 2.92729 a0 0.0629 0.034004-0.032-0.067 sqrtdel= 1.0000 2.92729 47 -1 0.70 0.50 ag i d9 5s6g ag i d9 5s9f 0.769453 ( 6g//r1// 9f)= 1.53891 a0 0.0418 0.009398-0.021-0.056 sqrtdel= 1.0000 1.53891 47 -1 0.70 0.50 ag i d9 5s6g ag i d8 5s2 4f 0.000000 ( //r1// )= 0.00000 a0 0.0000 0.000000 0.000 0.000 sqrtdel= 1.0000 0.00000 47 -1 0.70 0.50 ag i d9 5s6g ag i d10 6h 0.000000 ( //r1// )= 0.00000 a0 0.0000 0.000000 0.000 0.000 sqrtdel= 1.0000 0.00000 47 -1 0.70 0.50 ag i d9 5s6g ag i d10 7h 0.000000 ( //r1// )= 0.00000 a0 0.0000 0.000000 0.000 0.000 sqrtdel= 1.0000 0.00000 47 -1 0.70 0.50 ag i d9 5s6g ag i d10 8h 0.000000 ( //r1// )= 0.00000 a0 0.0000 0.000000 0.000 0.000 sqrtdel= 1.0000 0.00000 47 -1 0.70 0.50 ag i d9 5s6g ag i d10 9h 0.000000 ( //r1// )= 0.00000 a0 0.0000 0.000000 0.000 0.000 sqrtdel= 1.0000 0.00000 47 -1 0.70 0.50 ag i d9 5s6g ag i d9 5s6h -29.850540 ( 6g//r1// 6h)= 66.74784 a0 -0.8230 9.000553-0.553-0.653 sqrtdel= 1.0000 66.74784 47 -1 0.70 0.50 ag i d9 5s6g ag i d9 5s7h 33.061398 ( 6g//r1// 7h)= -73.92753 a0 0.8764 11.040970 0.609 0.825 sqrtdel= 1.0000 -73.92753 47 -1 0.70 0.50 ag i d9 5s6g ag i d9 5s8h 10.866478 ( 6g//r1// 8h)= -24.29818 a0 0.4139 1.192731 0.330 0.615 sqrtdel= 1.0000 -24.29818 47 -1 0.70 0.50 ag i d9 5s6g ag i d9 5s9h 5.706282 ( 6g//r1// 9h)= -12.75964 a0 0.2785 0.328906 0.220 0.512 sqrtdel= 1.0000 -12.75964 47 -1 0.70 0.50 ag i d9 5s6g ag i d10 8k 0.000000 ( //r1// )= 0.00000 a0 0.0000 0.000000 0.000 0.000 sqrtdel= 1.0000 0.00000 47 -1 0.70 0.50 ag i d9 5s6g ag i d10 9k 0.000000 ( //r1// )= 0.00000 a0 0.0000 0.000000 0.000 0.000 sqrtdel= 1.0000 0.00000 47 -1 0.70 0.50 ag i d9 5s6g ag i d9 5s8k 0.000000 ( //r1// )= 0.00000 a0 0.0000 0.000000 0.000 0.000 sqrtdel= 1.0000 0.00000 47 -1 0.70 0.50 ag i d9 5s6g ag i d9 5s9k 0.000000 ( //r1// )= 0.00000 a0 0.0000 0.000000 0.000 0.000 sqrtdel= 1.0000 0.00000 47 -1 0.70 0.50 ag i d9 5s7g ag i d10 5p 0.000000 ( //r1// )= 0.00000 a0 0.0000 0.000000 0.000 0.000 sqrtdel= 1.0000 0.00000 47 -1 0.70 0.50 ag i d9 5s7g ag i d10 6p 0.000000 ( //r1// )= 0.00000 a0 0.0000 0.000000 0.000 0.000 sqrtdel= 1.0000 0.00000 47 -1 0.70 0.50 ag i d9 5s7g ag i d10 7p 0.000000 ( //r1// )= 0.00000 a0 0.0000 0.000000 0.000 0.000 sqrtdel= 1.0000 0.00000 47 -1 0.70 0.50 ag i d9 5s7g ag i d10 8p 0.000000 ( //r1// )= 0.00000 a0 0.0000 0.000000 0.000 0.000 sqrtdel= 1.0000 0.00000 47 -1 0.70 0.50 ag i d9 5s7g ag i d10 9p 0.000000 ( //r1// )= 0.00000 a0 0.0000 0.000000 0.000 0.000 sqrtdel= 1.0000 0.00000 47 -1 0.70 0.50 ag i d9 5s7g ag i d9 5s5p 0.000000 ( //r1// )= 0.00000 a0 0.0000 0.000000 0.000 0.000 sqrtdel= 1.0000 0.00000 47 -1 0.70 0.50 ag i d9 5s7g ag i d9 5s6p 0.000000 ( //r1// )= 0.00000 a0 0.0000 0.000000 0.000 0.000 sqrtdel= 1.0000 0.00000 47 -1 0.70 0.50 ag i d9 5s7g ag i d9 5s7p 0.000000 ( //r1// )= 0.00000 a0 0.0000 0.000000 0.000 0.000 sqrtdel= 1.0000 0.00000 47 -1 0.70 0.50 ag i d9 5s7g ag i d9 5s8p 0.000000 ( //r1// )= 0.00000 a0 0.0000 0.000000 0.000 0.000 sqrtdel= 1.0000 0.00000 47 -1 0.70 0.50 ag i d9 5s7g ag i d9 5s9p 0.000000 ( //r1// )= 0.00000 a0 0.0000 0.000000 0.000 0.000 sqrtdel= 1.0000 0.00000 47 -1 0.70 0.50 ag i d9 5s7g ag i d8 5s2 5p 0.000000 ( //r1// )= 0.00000 a0 0.0000 0.000000 0.000 0.000 sqrtdel= 1.0000 0.00000 47 -1 0.70 0.50 ag i d9 5s7g ag i d10 4f 0.000000 ( //r1// )= 0.00000 a0 0.0000 0.000000 0.000 0.000 sqrtdel= 1.0000 0.00000 47 -1 0.70 0.50 ag i d9 5s7g ag i d10 5f 0.000000 ( //r1// )= 0.00000 a0 0.0000 0.000000 0.000 0.000 sqrtdel= 1.0000 0.00000 47 -1 0.70 0.50 ag i d9 5s7g ag i d10 6f 0.000000 ( //r1// )= 0.00000 a0 0.0000 0.000000 0.000 0.000 sqrtdel= 1.0000 0.00000 47 -1 0.70 0.50 ag i d9 5s7g ag i d10 7f 0.000000 ( //r1// )= 0.00000 a0 0.0000 0.000000 0.000 0.000 sqrtdel= 1.0000 0.00000 47 -1 0.70 0.50 ag i d9 5s7g ag i d10 8f 0.000000 ( //r1// )= 0.00000 a0 0.0000 0.000000 0.000 0.000 sqrtdel= 1.0000 0.00000 47 -1 0.70 0.50 ag i d9 5s7g ag i d10 9f 0.000000 ( //r1// )= 0.00000 a0 0.0000 0.000000 0.000 0.000 sqrtdel= 1.0000 0.00000 47 -1 0.70 0.50 ag i d9 5s7g ag i d9 5s4f 2.706853 ( 7g//r1// 4f)= 5.41371 a0 0.3561 0.116302 0.228 0.619 sqrtdel= 1.0000 5.41371 47 -1 0.70 0.50 ag i d9 5s7g ag i d9 5s5f 7.822957 ( 7g//r1// 5f)= 15.64591 a0 0.4428 0.971407 0.306 0.618 sqrtdel= 1.0000 15.64591 47 -1 0.70 0.50 ag i d9 5s7g ag i d9 5s6f 27.720451 ( 7g//r1// 6f)= 55.44090 a0 0.7250 12.197197 0.406 0.590 sqrtdel= 1.0000 55.44090 47 -1 0.70 0.50 ag i d9 5s7g ag i d9 5s7f -60.470663 ( 7g//r1// 7f)=-120.94133 a0 -0.9717 58.042875-0.826-0.899 sqrtdel= 1.0000 -120.94133 47 -1 0.70 0.50 ag i d9 5s7g ag i d9 5s8f 7.555487 ( 7g//r1// 8f)= 15.11097 a0 0.1575 0.906117-0.064-0.094 sqrtdel= 1.0000 15.11097 47 -1 0.70 0.50 ag i d9 5s7g ag i d9 5s9f 2.493367 ( 7g//r1// 9f)= 4.98673 a0 0.0707 0.098681-0.036-0.070 sqrtdel= 1.0000 4.98673 47 -1 0.70 0.50 ag i d9 5s7g ag i d8 5s2 4f 0.000000 ( //r1// )= 0.00000 a0 0.0000 0.000000 0.000 0.000 sqrtdel= 1.0000 0.00000 47 -1 0.70 0.50 ag i d9 5s7g ag i d10 6h 0.000000 ( //r1// )= 0.00000 a0 0.0000 0.000000 0.000 0.000 sqrtdel= 1.0000 0.00000 47 -1 0.70 0.50 ag i d9 5s7g ag i d10 7h 0.000000 ( //r1// )= 0.00000 a0 0.0000 0.000000 0.000 0.000 sqrtdel= 1.0000 0.00000 47 -1 0.70 0.50 ag i d9 5s7g ag i d10 8h 0.000000 ( //r1// )= 0.00000 a0 0.0000 0.000000 0.000 0.000 sqrtdel= 1.0000 0.00000 47 -1 0.70 0.50 ag i d9 5s7g ag i d10 9h 0.000000 ( //r1// )= 0.00000 a0 0.0000 0.000000 0.000 0.000 sqrtdel= 1.0000 0.00000 47 -1 0.70 0.50 ag i d9 5s7g ag i d9 5s6h 2.376050 ( 7g//r1// 6h)= -5.31301 a0 0.0903 0.057026-0.044-0.075 sqrtdel= 1.0000 -5.31301 47 -1 0.70 0.50 ag i d9 5s7g ag i d9 5s7h -51.441714 ( 7g//r1// 7h)= 115.02717 a0 -0.9208 26.729798-0.700-0.794 sqrtdel= 1.0000 115.02717 47 -1 0.70 0.50 ag i d9 5s7g ag i d9 5s8h 39.633647 ( 7g//r1// 8h)= -88.62353 a0 0.7677 15.866929 0.474 0.666 sqrtdel= 1.0000 -88.62353 47 -1 0.70 0.50 ag i d9 5s7g ag i d9 5s9h 13.958203 ( 7g//r1// 9h)= -31.21149 a0 0.3706 1.967994 0.281 0.523 sqrtdel= 1.0000 -31.21149 47 -1 0.70 0.50 ag i d9 5s7g ag i d10 8k 0.000000 ( //r1// )= 0.00000 a0 0.0000 0.000000 0.000 0.000 sqrtdel= 1.0000 0.00000 47 -1 0.70 0.50 ag i d9 5s7g ag i d10 9k 0.000000 ( //r1// )= 0.00000 a0 0.0000 0.000000 0.000 0.000 sqrtdel= 1.0000 0.00000 47 -1 0.70 0.50 ag i d9 5s7g ag i d9 5s8k 0.000000 ( //r1// )= 0.00000 a0 0.0000 0.000000 0.000 0.000 sqrtdel= 1.0000 0.00000 47 -1 0.70 0.50 ag i d9 5s7g ag i d9 5s9k 0.000000 ( //r1// )= 0.00000 a0 0.0000 0.000000 0.000 0.000 sqrtdel= 1.0000 0.00000 47 -1 0.70 0.50 ag i d9 5s8g ag i d10 5p 0.000000 ( //r1// )= 0.00000 a0 0.0000 0.000000 0.000 0.000 sqrtdel= 1.0000 0.00000 47 -1 0.70 0.50 ag i d9 5s8g ag i d10 6p 0.000000 ( //r1// )= 0.00000 a0 0.0000 0.000000 0.000 0.000 sqrtdel= 1.0000 0.00000 47 -1 0.70 0.50 ag i d9 5s8g ag i d10 7p 0.000000 ( //r1// )= 0.00000 a0 0.0000 0.000000 0.000 0.000 sqrtdel= 1.0000 0.00000 47 -1 0.70 0.50 ag i d9 5s8g ag i d10 8p 0.000000 ( //r1// )= 0.00000 a0 0.0000 0.000000 0.000 0.000 sqrtdel= 1.0000 0.00000 47 -1 0.70 0.50 ag i d9 5s8g ag i d10 9p 0.000000 ( //r1// )= 0.00000 a0 0.0000 0.000000 0.000 0.000 sqrtdel= 1.0000 0.00000 47 -1 0.70 0.50 ag i d9 5s8g ag i d9 5s5p 0.000000 ( //r1// )= 0.00000 a0 0.0000 0.000000 0.000 0.000 sqrtdel= 1.0000 0.00000 47 -1 0.70 0.50 ag i d9 5s8g ag i d9 5s6p 0.000000 ( //r1// )= 0.00000 a0 0.0000 0.000000 0.000 0.000 sqrtdel= 1.0000 0.00000 47 -1 0.70 0.50 ag i d9 5s8g ag i d9 5s7p 0.000000 ( //r1// )= 0.00000 a0 0.0000 0.000000 0.000 0.000 sqrtdel= 1.0000 0.00000 47 -1 0.70 0.50 ag i d9 5s8g ag i d9 5s8p 0.000000 ( //r1// )= 0.00000 a0 0.0000 0.000000 0.000 0.000 sqrtdel= 1.0000 0.00000 47 -1 0.70 0.50 ag i d9 5s8g ag i d9 5s9p 0.000000 ( //r1// )= 0.00000 a0 0.0000 0.000000 0.000 0.000 sqrtdel= 1.0000 0.00000 47 -1 0.70 0.50 ag i d9 5s8g ag i d8 5s2 5p 0.000000 ( //r1// )= 0.00000 a0 0.0000 0.000000 0.000 0.000 sqrtdel= 1.0000 0.00000 47 -1 0.70 0.50 ag i d9 5s8g ag i d10 4f 0.000000 ( //r1// )= 0.00000 a0 0.0000 0.000000 0.000 0.000 sqrtdel= 1.0000 0.00000 47 -1 0.70 0.50 ag i d9 5s8g ag i d10 5f 0.000000 ( //r1// )= 0.00000 a0 0.0000 0.000000 0.000 0.000 sqrtdel= 1.0000 0.00000 47 -1 0.70 0.50 ag i d9 5s8g ag i d10 6f 0.000000 ( //r1// )= 0.00000 a0 0.0000 0.000000 0.000 0.000 sqrtdel= 1.0000 0.00000 47 -1 0.70 0.50 ag i d9 5s8g ag i d10 7f 0.000000 ( //r1// )= 0.00000 a0 0.0000 0.000000 0.000 0.000 sqrtdel= 1.0000 0.00000 47 -1 0.70 0.50 ag i d9 5s8g ag i d10 8f 0.000000 ( //r1// )= 0.00000 a0 0.0000 0.000000 0.000 0.000 sqrtdel= 1.0000 0.00000 47 -1 0.70 0.50 ag i d9 5s8g ag i d10 9f 0.000000 ( //r1// )= 0.00000 a0 0.0000 0.000000 0.000 0.000 sqrtdel= 1.0000 0.00000 47 -1 0.70 0.50 ag i d9 5s8g ag i d9 5s4f 1.731641 ( 8g//r1// 4f)= 3.46328 a0 0.2905 0.047596 0.162 0.558 sqrtdel= 1.0000 3.46328 47 -1 0.70 0.50 ag i d9 5s8g ag i d9 5s5f 4.276279 ( 8g//r1// 5f)= 8.55256 a0 0.3164 0.290263 0.208 0.535 sqrtdel= 1.0000 8.55256 47 -1 0.70 0.50 ag i d9 5s8g ag i d9 5s6f 10.251936 ( 8g//r1// 6f)= 20.50387 a0 0.3805 1.668289 0.248 0.493 sqrtdel= 1.0000 20.50387 47 -1 0.70 0.50 ag i d9 5s8g ag i d9 5s7f 33.659638 ( 8g//r1// 7f)= 67.31928 a0 0.6361 17.983671 0.318 0.460 sqrtdel= 1.0000 67.31928 47 -1 0.70 0.50 ag i d9 5s8g ag i d9 5s8f -83.354030 ( 8g//r1// 8f)=-166.70806 a0 -0.9836 110.284038-0.872-0.932 sqrtdel= 1.0000 -166.70806 47 -1 0.70 0.50 ag i d9 5s8g ag i d9 5s9f 11.317507 ( 8g//r1// 9f)= 22.63501 a0 0.1707 2.033111-0.065-0.091 sqrtdel= 1.0000 22.63501 47 -1 0.70 0.50 ag i d9 5s8g ag i d8 5s2 4f 0.000000 ( //r1// )= 0.00000 a0 0.0000 0.000000 0.000 0.000 sqrtdel= 1.0000 0.00000 47 -1 0.70 0.50 ag i d9 5s8g ag i d10 6h 0.000000 ( //r1// )= 0.00000 a0 0.0000 0.000000 0.000 0.000 sqrtdel= 1.0000 0.00000 47 -1 0.70 0.50 ag i d9 5s8g ag i d10 7h 0.000000 ( //r1// )= 0.00000 a0 0.0000 0.000000 0.000 0.000 sqrtdel= 1.0000 0.00000 47 -1 0.70 0.50 ag i d9 5s8g ag i d10 8h 0.000000 ( //r1// )= 0.00000 a0 0.0000 0.000000 0.000 0.000 sqrtdel= 1.0000 0.00000 47 -1 0.70 0.50 ag i d9 5s8g ag i d10 9h 0.000000 ( //r1// )= 0.00000 a0 0.0000 0.000000 0.000 0.000 sqrtdel= 1.0000 0.00000 47 -1 0.70 0.50 ag i d9 5s8g ag i d9 5s6h 0.700282 ( 8g//r1// 6h)= -1.56588 a0 0.0364 0.004953-0.021-0.048 sqrtdel= 1.0000 -1.56588 47 -1 0.70 0.50 ag i d9 5s8g ag i d9 5s7h 4.873219 ( 8g//r1// 7h)= -10.89685 a0 0.1141 0.239881-0.058-0.089 sqrtdel= 1.0000 -10.89685 47 -1 0.70 0.50 ag i d9 5s8g ag i d9 5s8h -74.944080 ( 8g//r1// 8h)= 167.58006 a0 -0.9566 56.733486-0.781-0.864 sqrtdel= 1.0000 167.58006 47 -1 0.70 0.50 ag i d9 5s8g ag i d9 5s9h 46.900310 ( 8g//r1// 9h)=-104.87228 a0 0.6845 22.218576 0.384 0.544 sqrtdel= 1.0000 -104.87228 47 -1 0.70 0.50 ag i d9 5s8g ag i d10 8k 0.000000 ( //r1// )= 0.00000 a0 0.0000 0.000000 0.000 0.000 sqrtdel= 1.0000 0.00000 47 -1 0.70 0.50 ag i d9 5s8g ag i d10 9k 0.000000 ( //r1// )= 0.00000 a0 0.0000 0.000000 0.000 0.000 sqrtdel= 1.0000 0.00000 47 -1 0.70 0.50 ag i d9 5s8g ag i d9 5s8k 0.000000 ( //r1// )= 0.00000 a0 0.0000 0.000000 0.000 0.000 sqrtdel= 1.0000 0.00000 47 -1 0.70 0.50 ag i d9 5s8g ag i d9 5s9k 0.000000 ( //r1// )= 0.00000 a0 0.0000 0.000000 0.000 0.000 sqrtdel= 1.0000 0.00000 47 -1 0.70 0.50 ag i d9 5s9g ag i d10 5p 0.000000 ( //r1// )= 0.00000 a0 0.0000 0.000000 0.000 0.000 sqrtdel= 1.0000 0.00000 47 -1 0.70 0.50 ag i d9 5s9g ag i d10 6p 0.000000 ( //r1// )= 0.00000 a0 0.0000 0.000000 0.000 0.000 sqrtdel= 1.0000 0.00000 47 -1 0.70 0.50 ag i d9 5s9g ag i d10 7p 0.000000 ( //r1// )= 0.00000 a0 0.0000 0.000000 0.000 0.000 sqrtdel= 1.0000 0.00000 47 -1 0.70 0.50 ag i d9 5s9g ag i d10 8p 0.000000 ( //r1// )= 0.00000 a0 0.0000 0.000000 0.000 0.000 sqrtdel= 1.0000 0.00000 47 -1 0.70 0.50 ag i d9 5s9g ag i d10 9p 0.000000 ( //r1// )= 0.00000 a0 0.0000 0.000000 0.000 0.000 sqrtdel= 1.0000 0.00000 47 -1 0.70 0.50 ag i d9 5s9g ag i d9 5s5p 0.000000 ( //r1// )= 0.00000 a0 0.0000 0.000000 0.000 0.000 sqrtdel= 1.0000 0.00000 47 -1 0.70 0.50 ag i d9 5s9g ag i d9 5s6p 0.000000 ( //r1// )= 0.00000 a0 0.0000 0.000000 0.000 0.000 sqrtdel= 1.0000 0.00000 47 -1 0.70 0.50 ag i d9 5s9g ag i d9 5s7p 0.000000 ( //r1// )= 0.00000 a0 0.0000 0.000000 0.000 0.000 sqrtdel= 1.0000 0.00000 47 -1 0.70 0.50 ag i d9 5s9g ag i d9 5s8p 0.000000 ( //r1// )= 0.00000 a0 0.0000 0.000000 0.000 0.000 sqrtdel= 1.0000 0.00000 47 -1 0.70 0.50 ag i d9 5s9g ag i d9 5s9p 0.000000 ( //r1// )= 0.00000 a0 0.0000 0.000000 0.000 0.000 sqrtdel= 1.0000 0.00000 47 -1 0.70 0.50 ag i d9 5s9g ag i d8 5s2 5p 0.000000 ( //r1// )= 0.00000 a0 0.0000 0.000000 0.000 0.000 sqrtdel= 1.0000 0.00000 47 -1 0.70 0.50 ag i d9 5s9g ag i d10 4f 0.000000 ( //r1// )= 0.00000 a0 0.0000 0.000000 0.000 0.000 sqrtdel= 1.0000 0.00000 47 -1 0.70 0.50 ag i d9 5s9g ag i d10 5f 0.000000 ( //r1// )= 0.00000 a0 0.0000 0.000000 0.000 0.000 sqrtdel= 1.0000 0.00000 47 -1 0.70 0.50 ag i d9 5s9g ag i d10 6f 0.000000 ( //r1// )= 0.00000 a0 0.0000 0.000000 0.000 0.000 sqrtdel= 1.0000 0.00000 47 -1 0.70 0.50 ag i d9 5s9g ag i d10 7f 0.000000 ( //r1// )= 0.00000 a0 0.0000 0.000000 0.000 0.000 sqrtdel= 1.0000 0.00000 47 -1 0.70 0.50 ag i d9 5s9g ag i d10 8f 0.000000 ( //r1// )= 0.00000 a0 0.0000 0.000000 0.000 0.000 sqrtdel= 1.0000 0.00000 47 -1 0.70 0.50 ag i d9 5s9g ag i d10 9f 0.000000 ( //r1// )= 0.00000 a0 0.0000 0.000000 0.000 0.000 sqrtdel= 1.0000 0.00000 47 -1 0.70 0.50 ag i d9 5s9g ag i d9 5s4f 1.241002 ( 9g//r1// 4f)= 2.48200 a0 0.2550 0.024446 0.124 0.521 sqrtdel= 1.0000 2.48200 47 -1 0.70 0.50 ag i d9 5s9g ag i d9 5s5f 2.817880 ( 9g//r1// 5f)= 5.63576 a0 0.2576 0.126039 0.155 0.488 sqrtdel= 1.0000 5.63576 47 -1 0.70 0.50 ag i d9 5s9g ag i d9 5s6f 5.754654 ( 9g//r1// 6f)= 11.50931 a0 0.2720 0.525651 0.176 0.437 sqrtdel= 1.0000 11.50931 47 -1 0.70 0.50 ag i d9 5s9g ag i d9 5s7f 12.753696 ( 9g//r1// 7f)= 25.50739 a0 0.3321 2.581854 0.203 0.395 sqrtdel= 1.0000 25.50739 47 -1 0.70 0.50 ag i d9 5s9g ag i d9 5s8f 40.192129 ( 9g//r1// 8f)= 80.38426 a0 0.5732 25.641385 0.258 0.369 sqrtdel= 1.0000 80.38426 47 -1 0.70 0.50 ag i d9 5s9g ag i d9 5s9f -109.121248 ( 9g//r1// 9f)=-218.24250 a0 -0.9897 189.007093-0.902-0.952 sqrtdel= 1.0000 -218.24250 47 -1 0.70 0.50 ag i d9 5s9g ag i d8 5s2 4f 0.000000 ( //r1// )= 0.00000 a0 0.0000 0.000000 0.000 0.000 sqrtdel= 1.0000 0.00000 47 -1 0.70 0.50 ag i d9 5s9g ag i d10 6h 0.000000 ( //r1// )= 0.00000 a0 0.0000 0.000000 0.000 0.000 sqrtdel= 1.0000 0.00000 47 -1 0.70 0.50 ag i d9 5s9g ag i d10 7h 0.000000 ( //r1// )= 0.00000 a0 0.0000 0.000000 0.000 0.000 sqrtdel= 1.0000 0.00000 47 -1 0.70 0.50 ag i d9 5s9g ag i d10 8h 0.000000 ( //r1// )= 0.00000 a0 0.0000 0.000000 0.000 0.000 sqrtdel= 1.0000 0.00000 47 -1 0.70 0.50 ag i d9 5s9g ag i d10 9h 0.000000 ( //r1// )= 0.00000 a0 0.0000 0.000000 0.000 0.000 sqrtdel= 1.0000 0.00000 47 -1 0.70 0.50 ag i d9 5s9g ag i d9 5s6h 0.345308 ( 9g//r1// 6h)= -0.77213 a0 0.0226 0.001204-0.013-0.038 sqrtdel= 1.0000 -0.77213 47 -1 0.70 0.50 ag i d9 5s9g ag i d9 5s7h 1.496516 ( 9g//r1// 7h)= -3.34631 a0 0.0470 0.022622-0.030-0.060 sqrtdel= 1.0000 -3.34631 47 -1 0.70 0.50 ag i d9 5s9g ag i d9 5s8h 7.976086 ( 9g//r1// 8h)= -17.83507 a0 0.1300 0.642606-0.065-0.095 sqrtdel= 1.0000 -17.83507 47 -1 0.70 0.50 ag i d9 5s9g ag i d9 5s9h -101.031216 ( 9g//r1// 9h)= 225.91267 a0 -0.9733 103.104107-0.832-0.903 sqrtdel= 1.0000 225.91267 47 -1 0.70 0.50 ag i d9 5s9g ag i d10 8k 0.000000 ( //r1// )= 0.00000 a0 0.0000 0.000000 0.000 0.000 sqrtdel= 1.0000 0.00000 47 -1 0.70 0.50 ag i d9 5s9g ag i d10 9k 0.000000 ( //r1// )= 0.00000 a0 0.0000 0.000000 0.000 0.000 sqrtdel= 1.0000 0.00000 47 -1 0.70 0.50 ag i d9 5s9g ag i d9 5s8k 0.000000 ( //r1// )= 0.00000 a0 0.0000 0.000000 0.000 0.000 sqrtdel= 1.0000 0.00000 47 -1 0.70 0.50 ag i d9 5s9g ag i d9 5s9k 0.000000 ( //r1// )= 0.00000 a0 0.0000 0.000000 0.000 0.000 sqrtdel= 1.0000 0.00000 47 -1 0.70 0.50 ag i d10 7i ag i d10 5p 0.000000 ( //r1// )= 0.00000 a0 0.0000 0.000000 0.000 0.000 sqrtdel= 1.0000 0.00000 47 -1 0.70 0.50 ag i d10 7i ag i d10 6p 0.000000 ( //r1// )= 0.00000 a0 0.0000 0.000000 0.000 0.000 sqrtdel= 1.0000 0.00000 47 -1 0.70 0.50 ag i d10 7i ag i d10 7p 0.000000 ( //r1// )= 0.00000 a0 0.0000 0.000000 0.000 0.000 sqrtdel= 1.0000 0.00000 47 -1 0.70 0.50 ag i d10 7i ag i d10 8p 0.000000 ( //r1// )= 0.00000 a0 0.0000 0.000000 0.000 0.000 sqrtdel= 1.0000 0.00000 47 -1 0.70 0.50 ag i d10 7i ag i d10 9p 0.000000 ( //r1// )= 0.00000 a0 0.0000 0.000000 0.000 0.000 sqrtdel= 1.0000 0.00000 47 -1 0.70 0.50 ag i d10 7i ag i d9 5s5p 0.000000 ( //r1// )= 0.00000 a0 0.0000 0.000000 0.000 0.000 sqrtdel= 1.0000 0.00000 47 -1 0.70 0.50 ag i d10 7i ag i d9 5s6p 0.000000 ( //r1// )= 0.00000 a0 0.0000 0.000000 0.000 0.000 sqrtdel= 1.0000 0.00000 47 -1 0.70 0.50 ag i d10 7i ag i d9 5s7p 0.000000 ( //r1// )= 0.00000 a0 0.0000 0.000000 0.000 0.000 sqrtdel= 1.0000 0.00000 47 -1 0.70 0.50 ag i d10 7i ag i d9 5s8p 0.000000 ( //r1// )= 0.00000 a0 0.0000 0.000000 0.000 0.000 sqrtdel= 1.0000 0.00000 47 -1 0.70 0.50 ag i d10 7i ag i d9 5s9p 0.000000 ( //r1// )= 0.00000 a0 0.0000 0.000000 0.000 0.000 sqrtdel= 1.0000 0.00000 47 -1 0.70 0.50 ag i d10 7i ag i d8 5s2 5p 0.000000 ( //r1// )= 0.00000 a0 0.0000 0.000000 0.000 0.000 sqrtdel= 1.0000 0.00000 47 -1 0.70 0.50 ag i d10 7i ag i d10 4f 0.000000 ( //r1// )= 0.00000 a0 0.0000 0.000000 0.000 0.000 sqrtdel= 1.0000 0.00000 47 -1 0.70 0.50 ag i d10 7i ag i d10 5f 0.000000 ( //r1// )= 0.00000 a0 0.0000 0.000000 0.000 0.000 sqrtdel= 1.0000 0.00000 47 -1 0.70 0.50 ag i d10 7i ag i d10 6f 0.000000 ( //r1// )= 0.00000 a0 0.0000 0.000000 0.000 0.000 sqrtdel= 1.0000 0.00000 47 -1 0.70 0.50 ag i d10 7i ag i d10 7f 0.000000 ( //r1// )= 0.00000 a0 0.0000 0.000000 0.000 0.000 sqrtdel= 1.0000 0.00000 47 -1 0.70 0.50 ag i d10 7i ag i d10 8f 0.000000 ( //r1// )= 0.00000 a0 0.0000 0.000000 0.000 0.000 sqrtdel= 1.0000 0.00000 47 -1 0.70 0.50 ag i d10 7i ag i d10 9f 0.000000 ( //r1// )= 0.00000 a0 0.0000 0.000000 0.000 0.000 sqrtdel= 1.0000 0.00000 47 -1 0.70 0.50 ag i d10 7i ag i d9 5s4f 0.000000 ( //r1// )= 0.00000 a0 0.0000 0.000000 0.000 0.000 sqrtdel= 1.0000 0.00000 47 -1 0.70 0.50 ag i d10 7i ag i d9 5s5f 0.000000 ( //r1// )= 0.00000 a0 0.0000 0.000000 0.000 0.000 sqrtdel= 1.0000 0.00000 47 -1 0.70 0.50 ag i d10 7i ag i d9 5s6f 0.000000 ( //r1// )= 0.00000 a0 0.0000 0.000000 0.000 0.000 sqrtdel= 1.0000 0.00000 47 -1 0.70 0.50 ag i d10 7i ag i d9 5s7f 0.000000 ( //r1// )= 0.00000 a0 0.0000 0.000000 0.000 0.000 sqrtdel= 1.0000 0.00000 47 -1 0.70 0.50 ag i d10 7i ag i d9 5s8f 0.000000 ( //r1// )= 0.00000 a0 0.0000 0.000000 0.000 0.000 sqrtdel= 1.0000 0.00000 47 -1 0.70 0.50 ag i d10 7i ag i d9 5s9f 0.000000 ( //r1// )= 0.00000 a0 0.0000 0.000000 0.000 0.000 sqrtdel= 1.0000 0.00000 47 -1 0.70 0.50 ag i d10 7i ag i d8 5s2 4f 0.000000 ( //r1// )= 0.00000 a0 0.0000 0.000000 0.000 0.000 sqrtdel= 1.0000 0.00000 47 -1 0.70 0.50 ag i d10 7i ag i d10 6h 38.710277 ( 7i//r1// 6h)= 94.82043 a0 1.0000 10.478920 0.856 1.000 sqrtdel= 1.0000 94.82043 47 -1 0.70 0.50 ag i d10 7i ag i d10 7h -37.858394 ( 7i//r1// 7h)= -92.73375 a0 -0.7888 10.022783-0.515-0.614 sqrtdel= 1.0000 -92.73375 47 -1 0.70 0.50 ag i d10 7i ag i d10 8h 2.729476 ( 7i//r1// 8h)= 6.68582 a0 0.0769 0.052098-0.039-0.066 sqrtdel= 1.0000 6.68582 47 -1 0.70 0.50 ag i d10 7i ag i d10 9h 0.757528 ( 7i//r1// 9h)= 1.85556 a0 0.0285 0.004013-0.018-0.040 sqrtdel= 1.0000 1.85556 47 -1 0.70 0.50 ag i d10 7i ag i d9 5s6h 0.000000 ( //r1// )= 0.00000 a0 0.0000 0.000000 0.000 0.000 sqrtdel= 1.0000 0.00000 47 -1 0.70 0.50 ag i d10 7i ag i d9 5s7h 0.000000 ( //r1// )= 0.00000 a0 0.0000 0.000000 0.000 0.000 sqrtdel= 1.0000 0.00000 47 -1 0.70 0.50 ag i d10 7i ag i d9 5s8h 0.000000 ( //r1// )= 0.00000 a0 0.0000 0.000000 0.000 0.000 sqrtdel= 1.0000 0.00000 47 -1 0.70 0.50 ag i d10 7i ag i d9 5s9h 0.000000 ( //r1// )= 0.00000 a0 0.0000 0.000000 0.000 0.000 sqrtdel= 1.0000 0.00000 47 -1 0.70 0.50 ag i d10 7i ag i d10 8k 52.207290 ( 7i//r1// 8k)=-138.12751 a0 1.0000 13.977442 0.874 1.000 sqrtdel= 1.0000 -138.12751 47 -1 0.70 0.50 ag i d10 7i ag i d10 9k 12.576316 ( 7i//r1// 9k)= -33.27380 a0 0.3662 0.811096 0.355 0.600 sqrtdel= 1.0000 -33.27380 47 -1 0.70 0.50 ag i d10 7i ag i d9 5s8k 0.000000 ( //r1// )= 0.00000 a0 0.0000 0.000000 0.000 0.000 sqrtdel= 1.0000 0.00000 47 -1 0.70 0.50 ag i d10 7i ag i d9 5s9k 0.000000 ( //r1// )= 0.00000 a0 0.0000 0.000000 0.000 0.000 sqrtdel= 1.0000 0.00000 47 -1 0.70 0.50 ag i d10 8i ag i d10 5p 0.000000 ( //r1// )= 0.00000 a0 0.0000 0.000000 0.000 0.000 sqrtdel= 1.0000 0.00000 47 -1 0.70 0.50 ag i d10 8i ag i d10 6p 0.000000 ( //r1// )= 0.00000 a0 0.0000 0.000000 0.000 0.000 sqrtdel= 1.0000 0.00000 47 -1 0.70 0.50 ag i d10 8i ag i d10 7p 0.000000 ( //r1// )= 0.00000 a0 0.0000 0.000000 0.000 0.000 sqrtdel= 1.0000 0.00000 47 -1 0.70 0.50 ag i d10 8i ag i d10 8p 0.000000 ( //r1// )= 0.00000 a0 0.0000 0.000000 0.000 0.000 sqrtdel= 1.0000 0.00000 47 -1 0.70 0.50 ag i d10 8i ag i d10 9p 0.000000 ( //r1// )= 0.00000 a0 0.0000 0.000000 0.000 0.000 sqrtdel= 1.0000 0.00000 47 -1 0.70 0.50 ag i d10 8i ag i d9 5s5p 0.000000 ( //r1// )= 0.00000 a0 0.0000 0.000000 0.000 0.000 sqrtdel= 1.0000 0.00000 47 -1 0.70 0.50 ag i d10 8i ag i d9 5s6p 0.000000 ( //r1// )= 0.00000 a0 0.0000 0.000000 0.000 0.000 sqrtdel= 1.0000 0.00000 47 -1 0.70 0.50 ag i d10 8i ag i d9 5s7p 0.000000 ( //r1// )= 0.00000 a0 0.0000 0.000000 0.000 0.000 sqrtdel= 1.0000 0.00000 47 -1 0.70 0.50 ag i d10 8i ag i d9 5s8p 0.000000 ( //r1// )= 0.00000 a0 0.0000 0.000000 0.000 0.000 sqrtdel= 1.0000 0.00000 47 -1 0.70 0.50 ag i d10 8i ag i d9 5s9p 0.000000 ( //r1// )= 0.00000 a0 0.0000 0.000000 0.000 0.000 sqrtdel= 1.0000 0.00000 47 -1 0.70 0.50 ag i d10 8i ag i d8 5s2 5p 0.000000 ( //r1// )= 0.00000 a0 0.0000 0.000000 0.000 0.000 sqrtdel= 1.0000 0.00000 47 -1 0.70 0.50 ag i d10 8i ag i d10 4f 0.000000 ( //r1// )= 0.00000 a0 0.0000 0.000000 0.000 0.000 sqrtdel= 1.0000 0.00000 47 -1 0.70 0.50 ag i d10 8i ag i d10 5f 0.000000 ( //r1// )= 0.00000 a0 0.0000 0.000000 0.000 0.000 sqrtdel= 1.0000 0.00000 47 -1 0.70 0.50 ag i d10 8i ag i d10 6f 0.000000 ( //r1// )= 0.00000 a0 0.0000 0.000000 0.000 0.000 sqrtdel= 1.0000 0.00000 47 -1 0.70 0.50 ag i d10 8i ag i d10 7f 0.000000 ( //r1// )= 0.00000 a0 0.0000 0.000000 0.000 0.000 sqrtdel= 1.0000 0.00000 47 -1 0.70 0.50 ag i d10 8i ag i d10 8f 0.000000 ( //r1// )= 0.00000 a0 0.0000 0.000000 0.000 0.000 sqrtdel= 1.0000 0.00000 47 -1 0.70 0.50 ag i d10 8i ag i d10 9f 0.000000 ( //r1// )= 0.00000 a0 0.0000 0.000000 0.000 0.000 sqrtdel= 1.0000 0.00000 47 -1 0.70 0.50 ag i d10 8i ag i d9 5s4f 0.000000 ( //r1// )= 0.00000 a0 0.0000 0.000000 0.000 0.000 sqrtdel= 1.0000 0.00000 47 -1 0.70 0.50 ag i d10 8i ag i d9 5s5f 0.000000 ( //r1// )= 0.00000 a0 0.0000 0.000000 0.000 0.000 sqrtdel= 1.0000 0.00000 47 -1 0.70 0.50 ag i d10 8i ag i d9 5s6f 0.000000 ( //r1// )= 0.00000 a0 0.0000 0.000000 0.000 0.000 sqrtdel= 1.0000 0.00000 47 -1 0.70 0.50 ag i d10 8i ag i d9 5s7f 0.000000 ( //r1// )= 0.00000 a0 0.0000 0.000000 0.000 0.000 sqrtdel= 1.0000 0.00000 47 -1 0.70 0.50 ag i d10 8i ag i d9 5s8f 0.000000 ( //r1// )= 0.00000 a0 0.0000 0.000000 0.000 0.000 sqrtdel= 1.0000 0.00000 47 -1 0.70 0.50 ag i d10 8i ag i d9 5s9f 0.000000 ( //r1// )= 0.00000 a0 0.0000 0.000000 0.000 0.000 sqrtdel= 1.0000 0.00000 47 -1 0.70 0.50 ag i d10 8i ag i d8 5s2 4f 0.000000 ( //r1// )= 0.00000 a0 0.0000 0.000000 0.000 0.000 sqrtdel= 1.0000 0.00000 47 -1 0.70 0.50 ag i d10 8i ag i d10 6h 9.906685 ( 8i//r1// 6h)= 24.26632 a0 0.3991 0.686311 0.361 0.636 sqrtdel= 1.0000 24.26632 47 -1 0.70 0.50 ag i d10 8i ag i d10 7h 45.564629 ( 8i//r1// 7h)= 111.61009 a0 0.8948 14.518430 0.654 0.857 sqrtdel= 1.0000 111.61009 47 -1 0.70 0.50 ag i d10 8i ag i d10 8h -63.497918 ( 8i//r1// 8h)=-155.53750 a0 -0.8988 28.195704-0.661-0.759 sqrtdel= 1.0000 -155.53750 47 -1 0.70 0.50 ag i d10 8i ag i d10 9h 5.478191 ( 8i//r1// 9h)= 13.41877 a0 0.0996 0.209864-0.054-0.081 sqrtdel= 1.0000 13.41877 47 -1 0.70 0.50 ag i d10 8i ag i d9 5s6h 0.000000 ( //r1// )= 0.00000 a0 0.0000 0.000000 0.000 0.000 sqrtdel= 1.0000 0.00000 47 -1 0.70 0.50 ag i d10 8i ag i d9 5s7h 0.000000 ( //r1// )= 0.00000 a0 0.0000 0.000000 0.000 0.000 sqrtdel= 1.0000 0.00000 47 -1 0.70 0.50 ag i d10 8i ag i d9 5s8h 0.000000 ( //r1// )= 0.00000 a0 0.0000 0.000000 0.000 0.000 sqrtdel= 1.0000 0.00000 47 -1 0.70 0.50 ag i d10 8i ag i d9 5s9h 0.000000 ( //r1// )= 0.00000 a0 0.0000 0.000000 0.000 0.000 sqrtdel= 1.0000 0.00000 47 -1 0.70 0.50 ag i d10 8i ag i d10 8k -46.475822 ( 8i//r1// 8k)= 122.96347 a0 -0.7577 11.076933-0.484-0.580 sqrtdel= 1.0000 122.96347 47 -1 0.70 0.50 ag i d10 8i ag i d10 9k 60.064367 ( 8i//r1// 9k)=-158.91538 a0 0.9091 18.501170 0.689 0.880 sqrtdel= 1.0000 -158.91538 47 -1 0.70 0.50 ag i d10 8i ag i d9 5s8k 0.000000 ( //r1// )= 0.00000 a0 0.0000 0.000000 0.000 0.000 sqrtdel= 1.0000 0.00000 47 -1 0.70 0.50 ag i d10 8i ag i d9 5s9k 0.000000 ( //r1// )= 0.00000 a0 0.0000 0.000000 0.000 0.000 sqrtdel= 1.0000 0.00000 47 -1 0.70 0.50 ag i d10 9i ag i d10 5p 0.000000 ( //r1// )= 0.00000 a0 0.0000 0.000000 0.000 0.000 sqrtdel= 1.0000 0.00000 47 -1 0.70 0.50 ag i d10 9i ag i d10 6p 0.000000 ( //r1// )= 0.00000 a0 0.0000 0.000000 0.000 0.000 sqrtdel= 1.0000 0.00000 47 -1 0.70 0.50 ag i d10 9i ag i d10 7p 0.000000 ( //r1// )= 0.00000 a0 0.0000 0.000000 0.000 0.000 sqrtdel= 1.0000 0.00000 47 -1 0.70 0.50 ag i d10 9i ag i d10 8p 0.000000 ( //r1// )= 0.00000 a0 0.0000 0.000000 0.000 0.000 sqrtdel= 1.0000 0.00000 47 -1 0.70 0.50 ag i d10 9i ag i d10 9p 0.000000 ( //r1// )= 0.00000 a0 0.0000 0.000000 0.000 0.000 sqrtdel= 1.0000 0.00000 47 -1 0.70 0.50 ag i d10 9i ag i d9 5s5p 0.000000 ( //r1// )= 0.00000 a0 0.0000 0.000000 0.000 0.000 sqrtdel= 1.0000 0.00000 47 -1 0.70 0.50 ag i d10 9i ag i d9 5s6p 0.000000 ( //r1// )= 0.00000 a0 0.0000 0.000000 0.000 0.000 sqrtdel= 1.0000 0.00000 47 -1 0.70 0.50 ag i d10 9i ag i d9 5s7p 0.000000 ( //r1// )= 0.00000 a0 0.0000 0.000000 0.000 0.000 sqrtdel= 1.0000 0.00000 47 -1 0.70 0.50 ag i d10 9i ag i d9 5s8p 0.000000 ( //r1// )= 0.00000 a0 0.0000 0.000000 0.000 0.000 sqrtdel= 1.0000 0.00000 47 -1 0.70 0.50 ag i d10 9i ag i d9 5s9p 0.000000 ( //r1// )= 0.00000 a0 0.0000 0.000000 0.000 0.000 sqrtdel= 1.0000 0.00000 47 -1 0.70 0.50 ag i d10 9i ag i d8 5s2 5p 0.000000 ( //r1// )= 0.00000 a0 0.0000 0.000000 0.000 0.000 sqrtdel= 1.0000 0.00000 47 -1 0.70 0.50 ag i d10 9i ag i d10 4f 0.000000 ( //r1// )= 0.00000 a0 0.0000 0.000000 0.000 0.000 sqrtdel= 1.0000 0.00000 47 -1 0.70 0.50 ag i d10 9i ag i d10 5f 0.000000 ( //r1// )= 0.00000 a0 0.0000 0.000000 0.000 0.000 sqrtdel= 1.0000 0.00000 47 -1 0.70 0.50 ag i d10 9i ag i d10 6f 0.000000 ( //r1// )= 0.00000 a0 0.0000 0.000000 0.000 0.000 sqrtdel= 1.0000 0.00000 47 -1 0.70 0.50 ag i d10 9i ag i d10 7f 0.000000 ( //r1// )= 0.00000 a0 0.0000 0.000000 0.000 0.000 sqrtdel= 1.0000 0.00000 47 -1 0.70 0.50 ag i d10 9i ag i d10 8f 0.000000 ( //r1// )= 0.00000 a0 0.0000 0.000000 0.000 0.000 sqrtdel= 1.0000 0.00000 47 -1 0.70 0.50 ag i d10 9i ag i d10 9f 0.000000 ( //r1// )= 0.00000 a0 0.0000 0.000000 0.000 0.000 sqrtdel= 1.0000 0.00000 47 -1 0.70 0.50 ag i d10 9i ag i d9 5s4f 0.000000 ( //r1// )= 0.00000 a0 0.0000 0.000000 0.000 0.000 sqrtdel= 1.0000 0.00000 47 -1 0.70 0.50 ag i d10 9i ag i d9 5s5f 0.000000 ( //r1// )= 0.00000 a0 0.0000 0.000000 0.000 0.000 sqrtdel= 1.0000 0.00000 47 -1 0.70 0.50 ag i d10 9i ag i d9 5s6f 0.000000 ( //r1// )= 0.00000 a0 0.0000 0.000000 0.000 0.000 sqrtdel= 1.0000 0.00000 47 -1 0.70 0.50 ag i d10 9i ag i d9 5s7f 0.000000 ( //r1// )= 0.00000 a0 0.0000 0.000000 0.000 0.000 sqrtdel= 1.0000 0.00000 47 -1 0.70 0.50 ag i d10 9i ag i d9 5s8f 0.000000 ( //r1// )= 0.00000 a0 0.0000 0.000000 0.000 0.000 sqrtdel= 1.0000 0.00000 47 -1 0.70 0.50 ag i d10 9i ag i d9 5s9f 0.000000 ( //r1// )= 0.00000 a0 0.0000 0.000000 0.000 0.000 sqrtdel= 1.0000 0.00000 47 -1 0.70 0.50 ag i d10 9i ag i d8 5s2 4f 0.000000 ( //r1// )= 0.00000 a0 0.0000 0.000000 0.000 0.000 sqrtdel= 1.0000 0.00000 47 -1 0.70 0.50 ag i d10 9i ag i d10 6h 4.616307 ( 9i//r1// 6h)= 11.30760 a0 0.2466 0.149023 0.214 0.489 sqrtdel= 1.0000 11.30760 47 -1 0.70 0.50 ag i d10 9i ag i d10 7h 14.250522 ( 9i//r1// 7h)= 34.90651 a0 0.3897 1.420122 0.345 0.604 sqrtdel= 1.0000 34.90651 47 -1 0.70 0.50 ag i d10 9i ag i d10 8h 53.161282 ( 9i//r1// 8h)= 130.21802 a0 0.7962 19.763091 0.523 0.717 sqrtdel= 1.0000 130.21802 47 -1 0.70 0.50 ag i d10 9i ag i d10 9h -90.560966 ( 9i//r1// 9h)=-221.82816 a0 -0.9417 57.351669-0.745-0.833 sqrtdel= 1.0000 -221.82816 47 -1 0.70 0.50 ag i d10 9i ag i d9 5s6h 0.000000 ( //r1// )= 0.00000 a0 0.0000 0.000000 0.000 0.000 sqrtdel= 1.0000 0.00000 47 -1 0.70 0.50 ag i d10 9i ag i d9 5s7h 0.000000 ( //r1// )= 0.00000 a0 0.0000 0.000000 0.000 0.000 sqrtdel= 1.0000 0.00000 47 -1 0.70 0.50 ag i d10 9i ag i d9 5s8h 0.000000 ( //r1// )= 0.00000 a0 0.0000 0.000000 0.000 0.000 sqrtdel= 1.0000 0.00000 47 -1 0.70 0.50 ag i d10 9i ag i d9 5s9h 0.000000 ( //r1// )= 0.00000 a0 0.0000 0.000000 0.000 0.000 sqrtdel= 1.0000 0.00000 47 -1 0.70 0.50 ag i d10 9i ag i d10 8k 3.084237 ( 9i//r1// 8k)= -8.16012 a0 0.0669 0.048782-0.035-0.058 sqrtdel= 1.0000 -8.16012 47 -1 0.70 0.50 ag i d10 9i ag i d10 9k -76.367711 ( 9i//r1// 9k)= 202.04997 a0 -0.8770 29.907832-0.629-0.726 sqrtdel= 1.0000 202.04997 47 -1 0.70 0.50 ag i d10 9i ag i d9 5s8k 0.000000 ( //r1// )= 0.00000 a0 0.0000 0.000000 0.000 0.000 sqrtdel= 1.0000 0.00000 47 -1 0.70 0.50 ag i d10 9i ag i d9 5s9k 0.000000 ( //r1// )= 0.00000 a0 0.0000 0.000000 0.000 0.000 sqrtdel= 1.0000 0.00000 47 -1 0.70 0.50 ag i d9 5s7i ag i d10 5p 0.000000 ( //r1// )= 0.00000 a0 0.0000 0.000000 0.000 0.000 sqrtdel= 1.0000 0.00000 47 -1 0.70 0.50 ag i d9 5s7i ag i d10 6p 0.000000 ( //r1// )= 0.00000 a0 0.0000 0.000000 0.000 0.000 sqrtdel= 1.0000 0.00000 47 -1 0.70 0.50 ag i d9 5s7i ag i d10 7p 0.000000 ( //r1// )= 0.00000 a0 0.0000 0.000000 0.000 0.000 sqrtdel= 1.0000 0.00000 47 -1 0.70 0.50 ag i d9 5s7i ag i d10 8p 0.000000 ( //r1// )= 0.00000 a0 0.0000 0.000000 0.000 0.000 sqrtdel= 1.0000 0.00000 47 -1 0.70 0.50 ag i d9 5s7i ag i d10 9p 0.000000 ( //r1// )= 0.00000 a0 0.0000 0.000000 0.000 0.000 sqrtdel= 1.0000 0.00000 47 -1 0.70 0.50 ag i d9 5s7i ag i d9 5s5p 0.000000 ( //r1// )= 0.00000 a0 0.0000 0.000000 0.000 0.000 sqrtdel= 1.0000 0.00000 47 -1 0.70 0.50 ag i d9 5s7i ag i d9 5s6p 0.000000 ( //r1// )= 0.00000 a0 0.0000 0.000000 0.000 0.000 sqrtdel= 1.0000 0.00000 47 -1 0.70 0.50 ag i d9 5s7i ag i d9 5s7p 0.000000 ( //r1// )= 0.00000 a0 0.0000 0.000000 0.000 0.000 sqrtdel= 1.0000 0.00000 47 -1 0.70 0.50 ag i d9 5s7i ag i d9 5s8p 0.000000 ( //r1// )= 0.00000 a0 0.0000 0.000000 0.000 0.000 sqrtdel= 1.0000 0.00000 47 -1 0.70 0.50 ag i d9 5s7i ag i d9 5s9p 0.000000 ( //r1// )= 0.00000 a0 0.0000 0.000000 0.000 0.000 sqrtdel= 1.0000 0.00000 47 -1 0.70 0.50 ag i d9 5s7i ag i d8 5s2 5p 0.000000 ( //r1// )= 0.00000 a0 0.0000 0.000000 0.000 0.000 sqrtdel= 1.0000 0.00000 47 -1 0.70 0.50 ag i d9 5s7i ag i d10 4f 0.000000 ( //r1// )= 0.00000 a0 0.0000 0.000000 0.000 0.000 sqrtdel= 1.0000 0.00000 47 -1 0.70 0.50 ag i d9 5s7i ag i d10 5f 0.000000 ( //r1// )= 0.00000 a0 0.0000 0.000000 0.000 0.000 sqrtdel= 1.0000 0.00000 47 -1 0.70 0.50 ag i d9 5s7i ag i d10 6f 0.000000 ( //r1// )= 0.00000 a0 0.0000 0.000000 0.000 0.000 sqrtdel= 1.0000 0.00000 47 -1 0.70 0.50 ag i d9 5s7i ag i d10 7f 0.000000 ( //r1// )= 0.00000 a0 0.0000 0.000000 0.000 0.000 sqrtdel= 1.0000 0.00000 47 -1 0.70 0.50 ag i d9 5s7i ag i d10 8f 0.000000 ( //r1// )= 0.00000 a0 0.0000 0.000000 0.000 0.000 sqrtdel= 1.0000 0.00000 47 -1 0.70 0.50 ag i d9 5s7i ag i d10 9f 0.000000 ( //r1// )= 0.00000 a0 0.0000 0.000000 0.000 0.000 sqrtdel= 1.0000 0.00000 47 -1 0.70 0.50 ag i d9 5s7i ag i d9 5s4f 0.000000 ( //r1// )= 0.00000 a0 0.0000 0.000000 0.000 0.000 sqrtdel= 1.0000 0.00000 47 -1 0.70 0.50 ag i d9 5s7i ag i d9 5s5f 0.000000 ( //r1// )= 0.00000 a0 0.0000 0.000000 0.000 0.000 sqrtdel= 1.0000 0.00000 47 -1 0.70 0.50 ag i d9 5s7i ag i d9 5s6f 0.000000 ( //r1// )= 0.00000 a0 0.0000 0.000000 0.000 0.000 sqrtdel= 1.0000 0.00000 47 -1 0.70 0.50 ag i d9 5s7i ag i d9 5s7f 0.000000 ( //r1// )= 0.00000 a0 0.0000 0.000000 0.000 0.000 sqrtdel= 1.0000 0.00000 47 -1 0.70 0.50 ag i d9 5s7i ag i d9 5s8f 0.000000 ( //r1// )= 0.00000 a0 0.0000 0.000000 0.000 0.000 sqrtdel= 1.0000 0.00000 47 -1 0.70 0.50 ag i d9 5s7i ag i d9 5s9f 0.000000 ( //r1// )= 0.00000 a0 0.0000 0.000000 0.000 0.000 sqrtdel= 1.0000 0.00000 47 -1 0.70 0.50 ag i d9 5s7i ag i d8 5s2 4f 0.000000 ( //r1// )= 0.00000 a0 0.0000 0.000000 0.000 0.000 sqrtdel= 1.0000 0.00000 47 -1 0.70 0.50 ag i d9 5s7i ag i d10 6h 0.000000 ( //r1// )= 0.00000 a0 0.0000 0.000000 0.000 0.000 sqrtdel= 1.0000 0.00000 47 -1 0.70 0.50 ag i d9 5s7i ag i d10 7h 0.000000 ( //r1// )= 0.00000 a0 0.0000 0.000000 0.000 0.000 sqrtdel= 1.0000 0.00000 47 -1 0.70 0.50 ag i d9 5s7i ag i d10 8h 0.000000 ( //r1// )= 0.00000 a0 0.0000 0.000000 0.000 0.000 sqrtdel= 1.0000 0.00000 47 -1 0.70 0.50 ag i d9 5s7i ag i d10 9h 0.000000 ( //r1// )= 0.00000 a0 0.0000 0.000000 0.000 0.000 sqrtdel= 1.0000 0.00000 47 -1 0.70 0.50 ag i d9 5s7i ag i d9 5s6h 38.710270 ( 7i//r1// 6h)= 94.82041 a0 1.0000 10.478916 0.856 1.000 sqrtdel= 1.0000 94.82041 47 -1 0.70 0.50 ag i d9 5s7i ag i d9 5s7h -37.858401 ( 7i//r1// 7h)= -92.73377 a0 -0.7888 10.022787-0.515-0.614 sqrtdel= 1.0000 -92.73377 47 -1 0.70 0.50 ag i d9 5s7i ag i d9 5s8h 2.729493 ( 7i//r1// 8h)= 6.68586 a0 0.0769 0.052099-0.039-0.066 sqrtdel= 1.0000 6.68586 47 -1 0.70 0.50 ag i d9 5s7i ag i d9 5s9h 0.757535 ( 7i//r1// 9h)= 1.85557 a0 0.0285 0.004013-0.018-0.040 sqrtdel= 1.0000 1.85557 47 -1 0.70 0.50 ag i d9 5s7i ag i d10 8k 0.000000 ( //r1// )= 0.00000 a0 0.0000 0.000000 0.000 0.000 sqrtdel= 1.0000 0.00000 47 -1 0.70 0.50 ag i d9 5s7i ag i d10 9k 0.000000 ( //r1// )= 0.00000 a0 0.0000 0.000000 0.000 0.000 sqrtdel= 1.0000 0.00000 47 -1 0.70 0.50 ag i d9 5s7i ag i d9 5s8k 52.207289 ( 7i//r1// 8k)=-138.12750 a0 1.0000 13.977441 0.874 1.000 sqrtdel= 1.0000 -138.12750 47 -1 0.70 0.50 ag i d9 5s7i ag i d9 5s9k 12.576315 ( 7i//r1// 9k)= -33.27380 a0 0.3662 0.811096 0.355 0.600 sqrtdel= 1.0000 -33.27380 47 -1 0.70 0.50 ag i d9 5s8i ag i d10 5p 0.000000 ( //r1// )= 0.00000 a0 0.0000 0.000000 0.000 0.000 sqrtdel= 1.0000 0.00000 47 -1 0.70 0.50 ag i d9 5s8i ag i d10 6p 0.000000 ( //r1// )= 0.00000 a0 0.0000 0.000000 0.000 0.000 sqrtdel= 1.0000 0.00000 47 -1 0.70 0.50 ag i d9 5s8i ag i d10 7p 0.000000 ( //r1// )= 0.00000 a0 0.0000 0.000000 0.000 0.000 sqrtdel= 1.0000 0.00000 47 -1 0.70 0.50 ag i d9 5s8i ag i d10 8p 0.000000 ( //r1// )= 0.00000 a0 0.0000 0.000000 0.000 0.000 sqrtdel= 1.0000 0.00000 47 -1 0.70 0.50 ag i d9 5s8i ag i d10 9p 0.000000 ( //r1// )= 0.00000 a0 0.0000 0.000000 0.000 0.000 sqrtdel= 1.0000 0.00000 47 -1 0.70 0.50 ag i d9 5s8i ag i d9 5s5p 0.000000 ( //r1// )= 0.00000 a0 0.0000 0.000000 0.000 0.000 sqrtdel= 1.0000 0.00000 47 -1 0.70 0.50 ag i d9 5s8i ag i d9 5s6p 0.000000 ( //r1// )= 0.00000 a0 0.0000 0.000000 0.000 0.000 sqrtdel= 1.0000 0.00000 47 -1 0.70 0.50 ag i d9 5s8i ag i d9 5s7p 0.000000 ( //r1// )= 0.00000 a0 0.0000 0.000000 0.000 0.000 sqrtdel= 1.0000 0.00000 47 -1 0.70 0.50 ag i d9 5s8i ag i d9 5s8p 0.000000 ( //r1// )= 0.00000 a0 0.0000 0.000000 0.000 0.000 sqrtdel= 1.0000 0.00000 47 -1 0.70 0.50 ag i d9 5s8i ag i d9 5s9p 0.000000 ( //r1// )= 0.00000 a0 0.0000 0.000000 0.000 0.000 sqrtdel= 1.0000 0.00000 47 -1 0.70 0.50 ag i d9 5s8i ag i d8 5s2 5p 0.000000 ( //r1// )= 0.00000 a0 0.0000 0.000000 0.000 0.000 sqrtdel= 1.0000 0.00000 47 -1 0.70 0.50 ag i d9 5s8i ag i d10 4f 0.000000 ( //r1// )= 0.00000 a0 0.0000 0.000000 0.000 0.000 sqrtdel= 1.0000 0.00000 47 -1 0.70 0.50 ag i d9 5s8i ag i d10 5f 0.000000 ( //r1// )= 0.00000 a0 0.0000 0.000000 0.000 0.000 sqrtdel= 1.0000 0.00000 47 -1 0.70 0.50 ag i d9 5s8i ag i d10 6f 0.000000 ( //r1// )= 0.00000 a0 0.0000 0.000000 0.000 0.000 sqrtdel= 1.0000 0.00000 47 -1 0.70 0.50 ag i d9 5s8i ag i d10 7f 0.000000 ( //r1// )= 0.00000 a0 0.0000 0.000000 0.000 0.000 sqrtdel= 1.0000 0.00000 47 -1 0.70 0.50 ag i d9 5s8i ag i d10 8f 0.000000 ( //r1// )= 0.00000 a0 0.0000 0.000000 0.000 0.000 sqrtdel= 1.0000 0.00000 47 -1 0.70 0.50 ag i d9 5s8i ag i d10 9f 0.000000 ( //r1// )= 0.00000 a0 0.0000 0.000000 0.000 0.000 sqrtdel= 1.0000 0.00000 47 -1 0.70 0.50 ag i d9 5s8i ag i d9 5s4f 0.000000 ( //r1// )= 0.00000 a0 0.0000 0.000000 0.000 0.000 sqrtdel= 1.0000 0.00000 47 -1 0.70 0.50 ag i d9 5s8i ag i d9 5s5f 0.000000 ( //r1// )= 0.00000 a0 0.0000 0.000000 0.000 0.000 sqrtdel= 1.0000 0.00000 47 -1 0.70 0.50 ag i d9 5s8i ag i d9 5s6f 0.000000 ( //r1// )= 0.00000 a0 0.0000 0.000000 0.000 0.000 sqrtdel= 1.0000 0.00000 47 -1 0.70 0.50 ag i d9 5s8i ag i d9 5s7f 0.000000 ( //r1// )= 0.00000 a0 0.0000 0.000000 0.000 0.000 sqrtdel= 1.0000 0.00000 47 -1 0.70 0.50 ag i d9 5s8i ag i d9 5s8f 0.000000 ( //r1// )= 0.00000 a0 0.0000 0.000000 0.000 0.000 sqrtdel= 1.0000 0.00000 47 -1 0.70 0.50 ag i d9 5s8i ag i d9 5s9f 0.000000 ( //r1// )= 0.00000 a0 0.0000 0.000000 0.000 0.000 sqrtdel= 1.0000 0.00000 47 -1 0.70 0.50 ag i d9 5s8i ag i d8 5s2 4f 0.000000 ( //r1// )= 0.00000 a0 0.0000 0.000000 0.000 0.000 sqrtdel= 1.0000 0.00000 47 -1 0.70 0.50 ag i d9 5s8i ag i d10 6h 0.000000 ( //r1// )= 0.00000 a0 0.0000 0.000000 0.000 0.000 sqrtdel= 1.0000 0.00000 47 -1 0.70 0.50 ag i d9 5s8i ag i d10 7h 0.000000 ( //r1// )= 0.00000 a0 0.0000 0.000000 0.000 0.000 sqrtdel= 1.0000 0.00000 47 -1 0.70 0.50 ag i d9 5s8i ag i d10 8h 0.000000 ( //r1// )= 0.00000 a0 0.0000 0.000000 0.000 0.000 sqrtdel= 1.0000 0.00000 47 -1 0.70 0.50 ag i d9 5s8i ag i d10 9h 0.000000 ( //r1// )= 0.00000 a0 0.0000 0.000000 0.000 0.000 sqrtdel= 1.0000 0.00000 47 -1 0.70 0.50 ag i d9 5s8i ag i d9 5s6h 9.906687 ( 8i//r1// 6h)= 24.26633 a0 0.3991 0.686311 0.361 0.636 sqrtdel= 1.0000 24.26633 47 -1 0.70 0.50 ag i d9 5s8i ag i d9 5s7h 45.564599 ( 8i//r1// 7h)= 111.61002 a0 0.8948 14.518410 0.654 0.857 sqrtdel= 1.0000 111.61002 47 -1 0.70 0.50 ag i d9 5s8i ag i d9 5s8h -63.497942 ( 8i//r1// 8h)=-155.53756 a0 -0.8988 28.195724-0.661-0.759 sqrtdel= 1.0000 -155.53756 47 -1 0.70 0.50 ag i d9 5s8i ag i d9 5s9h 5.478240 ( 8i//r1// 9h)= 13.41889 a0 0.0996 0.209868-0.054-0.081 sqrtdel= 1.0000 13.41889 47 -1 0.70 0.50 ag i d9 5s8i ag i d10 8k 0.000000 ( //r1// )= 0.00000 a0 0.0000 0.000000 0.000 0.000 sqrtdel= 1.0000 0.00000 47 -1 0.70 0.50 ag i d9 5s8i ag i d10 9k 0.000000 ( //r1// )= 0.00000 a0 0.0000 0.000000 0.000 0.000 sqrtdel= 1.0000 0.00000 47 -1 0.70 0.50 ag i d9 5s8i ag i d9 5s8k -46.475821 ( 8i//r1// 8k)= 122.96346 a0 -0.7577 11.076933-0.484-0.580 sqrtdel= 1.0000 122.96346 47 -1 0.70 0.50 ag i d9 5s8i ag i d9 5s9k 60.064366 ( 8i//r1// 9k)=-158.91537 a0 0.9091 18.501170 0.689 0.880 sqrtdel= 1.0000 -158.91537 47 -1 0.70 0.50 ag i d9 5s9i ag i d10 5p 0.000000 ( //r1// )= 0.00000 a0 0.0000 0.000000 0.000 0.000 sqrtdel= 1.0000 0.00000 47 -1 0.70 0.50 ag i d9 5s9i ag i d10 6p 0.000000 ( //r1// )= 0.00000 a0 0.0000 0.000000 0.000 0.000 sqrtdel= 1.0000 0.00000 47 -1 0.70 0.50 ag i d9 5s9i ag i d10 7p 0.000000 ( //r1// )= 0.00000 a0 0.0000 0.000000 0.000 0.000 sqrtdel= 1.0000 0.00000 47 -1 0.70 0.50 ag i d9 5s9i ag i d10 8p 0.000000 ( //r1// )= 0.00000 a0 0.0000 0.000000 0.000 0.000 sqrtdel= 1.0000 0.00000 47 -1 0.70 0.50 ag i d9 5s9i ag i d10 9p 0.000000 ( //r1// )= 0.00000 a0 0.0000 0.000000 0.000 0.000 sqrtdel= 1.0000 0.00000 47 -1 0.70 0.50 ag i d9 5s9i ag i d9 5s5p 0.000000 ( //r1// )= 0.00000 a0 0.0000 0.000000 0.000 0.000 sqrtdel= 1.0000 0.00000 47 -1 0.70 0.50 ag i d9 5s9i ag i d9 5s6p 0.000000 ( //r1// )= 0.00000 a0 0.0000 0.000000 0.000 0.000 sqrtdel= 1.0000 0.00000 47 -1 0.70 0.50 ag i d9 5s9i ag i d9 5s7p 0.000000 ( //r1// )= 0.00000 a0 0.0000 0.000000 0.000 0.000 sqrtdel= 1.0000 0.00000 47 -1 0.70 0.50 ag i d9 5s9i ag i d9 5s8p 0.000000 ( //r1// )= 0.00000 a0 0.0000 0.000000 0.000 0.000 sqrtdel= 1.0000 0.00000 47 -1 0.70 0.50 ag i d9 5s9i ag i d9 5s9p 0.000000 ( //r1// )= 0.00000 a0 0.0000 0.000000 0.000 0.000 sqrtdel= 1.0000 0.00000 47 -1 0.70 0.50 ag i d9 5s9i ag i d8 5s2 5p 0.000000 ( //r1// )= 0.00000 a0 0.0000 0.000000 0.000 0.000 sqrtdel= 1.0000 0.00000 47 -1 0.70 0.50 ag i d9 5s9i ag i d10 4f 0.000000 ( //r1// )= 0.00000 a0 0.0000 0.000000 0.000 0.000 sqrtdel= 1.0000 0.00000 47 -1 0.70 0.50 ag i d9 5s9i ag i d10 5f 0.000000 ( //r1// )= 0.00000 a0 0.0000 0.000000 0.000 0.000 sqrtdel= 1.0000 0.00000 47 -1 0.70 0.50 ag i d9 5s9i ag i d10 6f 0.000000 ( //r1// )= 0.00000 a0 0.0000 0.000000 0.000 0.000 sqrtdel= 1.0000 0.00000 47 -1 0.70 0.50 ag i d9 5s9i ag i d10 7f 0.000000 ( //r1// )= 0.00000 a0 0.0000 0.000000 0.000 0.000 sqrtdel= 1.0000 0.00000 47 -1 0.70 0.50 ag i d9 5s9i ag i d10 8f 0.000000 ( //r1// )= 0.00000 a0 0.0000 0.000000 0.000 0.000 sqrtdel= 1.0000 0.00000 47 -1 0.70 0.50 ag i d9 5s9i ag i d10 9f 0.000000 ( //r1// )= 0.00000 a0 0.0000 0.000000 0.000 0.000 sqrtdel= 1.0000 0.00000 47 -1 0.70 0.50 ag i d9 5s9i ag i d9 5s4f 0.000000 ( //r1// )= 0.00000 a0 0.0000 0.000000 0.000 0.000 sqrtdel= 1.0000 0.00000 47 -1 0.70 0.50 ag i d9 5s9i ag i d9 5s5f 0.000000 ( //r1// )= 0.00000 a0 0.0000 0.000000 0.000 0.000 sqrtdel= 1.0000 0.00000 47 -1 0.70 0.50 ag i d9 5s9i ag i d9 5s6f 0.000000 ( //r1// )= 0.00000 a0 0.0000 0.000000 0.000 0.000 sqrtdel= 1.0000 0.00000 47 -1 0.70 0.50 ag i d9 5s9i ag i d9 5s7f 0.000000 ( //r1// )= 0.00000 a0 0.0000 0.000000 0.000 0.000 sqrtdel= 1.0000 0.00000 47 -1 0.70 0.50 ag i d9 5s9i ag i d9 5s8f 0.000000 ( //r1// )= 0.00000 a0 0.0000 0.000000 0.000 0.000 sqrtdel= 1.0000 0.00000 47 -1 0.70 0.50 ag i d9 5s9i ag i d9 5s9f 0.000000 ( //r1// )= 0.00000 a0 0.0000 0.000000 0.000 0.000 sqrtdel= 1.0000 0.00000 47 -1 0.70 0.50 ag i d9 5s9i ag i d8 5s2 4f 0.000000 ( //r1// )= 0.00000 a0 0.0000 0.000000 0.000 0.000 sqrtdel= 1.0000 0.00000 47 -1 0.70 0.50 ag i d9 5s9i ag i d10 6h 0.000000 ( //r1// )= 0.00000 a0 0.0000 0.000000 0.000 0.000 sqrtdel= 1.0000 0.00000 47 -1 0.70 0.50 ag i d9 5s9i ag i d10 7h 0.000000 ( //r1// )= 0.00000 a0 0.0000 0.000000 0.000 0.000 sqrtdel= 1.0000 0.00000 47 -1 0.70 0.50 ag i d9 5s9i ag i d10 8h 0.000000 ( //r1// )= 0.00000 a0 0.0000 0.000000 0.000 0.000 sqrtdel= 1.0000 0.00000 47 -1 0.70 0.50 ag i d9 5s9i ag i d10 9h 0.000000 ( //r1// )= 0.00000 a0 0.0000 0.000000 0.000 0.000 sqrtdel= 1.0000 0.00000 47 -1 0.70 0.50 ag i d9 5s9i ag i d9 5s6h 4.616308 ( 9i//r1// 6h)= 11.30760 a0 0.2466 0.149023 0.214 0.489 sqrtdel= 1.0000 11.30760 47 -1 0.70 0.50 ag i d9 5s9i ag i d9 5s7h 14.250524 ( 9i//r1// 7h)= 34.90651 a0 0.3897 1.420122 0.345 0.604 sqrtdel= 1.0000 34.90651 47 -1 0.70 0.50 ag i d9 5s9i ag i d9 5s8h 53.161200 ( 9i//r1// 8h)= 130.21781 a0 0.7962 19.763029 0.523 0.717 sqrtdel= 1.0000 130.21781 47 -1 0.70 0.50 ag i d9 5s9i ag i d9 5s9h -90.561013 ( 9i//r1// 9h)=-221.82827 a0 -0.9417 57.351728-0.745-0.833 sqrtdel= 1.0000 -221.82827 47 -1 0.70 0.50 ag i d9 5s9i ag i d10 8k 0.000000 ( //r1// )= 0.00000 a0 0.0000 0.000000 0.000 0.000 sqrtdel= 1.0000 0.00000 47 -1 0.70 0.50 ag i d9 5s9i ag i d10 9k 0.000000 ( //r1// )= 0.00000 a0 0.0000 0.000000 0.000 0.000 sqrtdel= 1.0000 0.00000 47 -1 0.70 0.50 ag i d9 5s9i ag i d9 5s8k 3.084237 ( 9i//r1// 8k)= -8.16012 a0 0.0669 0.048782-0.035-0.058 sqrtdel= 1.0000 -8.16012 47 -1 0.70 0.50 ag i d9 5s9i ag i d9 5s9k -76.367709 ( 9i//r1// 9k)= 202.04997 a0 -0.8770 29.907831-0.629-0.726 sqrtdel= 1.0000 202.04997 47 -1 0.70 0.50 ag i d10 9l ag i d10 5p 0.000000 ( //r1// )= 0.00000 a0 0.0000 0.000000 0.000 0.000 sqrtdel= 1.0000 0.00000 47 -1 0.70 0.50 ag i d10 9l ag i d10 6p 0.000000 ( //r1// )= 0.00000 a0 0.0000 0.000000 0.000 0.000 sqrtdel= 1.0000 0.00000 47 -1 0.70 0.50 ag i d10 9l ag i d10 7p 0.000000 ( //r1// )= 0.00000 a0 0.0000 0.000000 0.000 0.000 sqrtdel= 1.0000 0.00000 47 -1 0.70 0.50 ag i d10 9l ag i d10 8p 0.000000 ( //r1// )= 0.00000 a0 0.0000 0.000000 0.000 0.000 sqrtdel= 1.0000 0.00000 47 -1 0.70 0.50 ag i d10 9l ag i d10 9p 0.000000 ( //r1// )= 0.00000 a0 0.0000 0.000000 0.000 0.000 sqrtdel= 1.0000 0.00000 47 -1 0.70 0.50 ag i d10 9l ag i d9 5s5p 0.000000 ( //r1// )= 0.00000 a0 0.0000 0.000000 0.000 0.000 sqrtdel= 1.0000 0.00000 47 -1 0.70 0.50 ag i d10 9l ag i d9 5s6p 0.000000 ( //r1// )= 0.00000 a0 0.0000 0.000000 0.000 0.000 sqrtdel= 1.0000 0.00000 47 -1 0.70 0.50 ag i d10 9l ag i d9 5s7p 0.000000 ( //r1// )= 0.00000 a0 0.0000 0.000000 0.000 0.000 sqrtdel= 1.0000 0.00000 47 -1 0.70 0.50 ag i d10 9l ag i d9 5s8p 0.000000 ( //r1// )= 0.00000 a0 0.0000 0.000000 0.000 0.000 sqrtdel= 1.0000 0.00000 47 -1 0.70 0.50 ag i d10 9l ag i d9 5s9p 0.000000 ( //r1// )= 0.00000 a0 0.0000 0.000000 0.000 0.000 sqrtdel= 1.0000 0.00000 47 -1 0.70 0.50 ag i d10 9l ag i d8 5s2 5p 0.000000 ( //r1// )= 0.00000 a0 0.0000 0.000000 0.000 0.000 sqrtdel= 1.0000 0.00000 47 -1 0.70 0.50 ag i d10 9l ag i d10 4f 0.000000 ( //r1// )= 0.00000 a0 0.0000 0.000000 0.000 0.000 sqrtdel= 1.0000 0.00000 47 -1 0.70 0.50 ag i d10 9l ag i d10 5f 0.000000 ( //r1// )= 0.00000 a0 0.0000 0.000000 0.000 0.000 sqrtdel= 1.0000 0.00000 47 -1 0.70 0.50 ag i d10 9l ag i d10 6f 0.000000 ( //r1// )= 0.00000 a0 0.0000 0.000000 0.000 0.000 sqrtdel= 1.0000 0.00000 47 -1 0.70 0.50 ag i d10 9l ag i d10 7f 0.000000 ( //r1// )= 0.00000 a0 0.0000 0.000000 0.000 0.000 sqrtdel= 1.0000 0.00000 47 -1 0.70 0.50 ag i d10 9l ag i d10 8f 0.000000 ( //r1// )= 0.00000 a0 0.0000 0.000000 0.000 0.000 sqrtdel= 1.0000 0.00000 47 -1 0.70 0.50 ag i d10 9l ag i d10 9f 0.000000 ( //r1// )= 0.00000 a0 0.0000 0.000000 0.000 0.000 sqrtdel= 1.0000 0.00000 47 -1 0.70 0.50 ag i d10 9l ag i d9 5s4f 0.000000 ( //r1// )= 0.00000 a0 0.0000 0.000000 0.000 0.000 sqrtdel= 1.0000 0.00000 47 -1 0.70 0.50 ag i d10 9l ag i d9 5s5f 0.000000 ( //r1// )= 0.00000 a0 0.0000 0.000000 0.000 0.000 sqrtdel= 1.0000 0.00000 47 -1 0.70 0.50 ag i d10 9l ag i d9 5s6f 0.000000 ( //r1// )= 0.00000 a0 0.0000 0.000000 0.000 0.000 sqrtdel= 1.0000 0.00000 47 -1 0.70 0.50 ag i d10 9l ag i d9 5s7f 0.000000 ( //r1// )= 0.00000 a0 0.0000 0.000000 0.000 0.000 sqrtdel= 1.0000 0.00000 47 -1 0.70 0.50 ag i d10 9l ag i d9 5s8f 0.000000 ( //r1// )= 0.00000 a0 0.0000 0.000000 0.000 0.000 sqrtdel= 1.0000 0.00000 47 -1 0.70 0.50 ag i d10 9l ag i d9 5s9f 0.000000 ( //r1// )= 0.00000 a0 0.0000 0.000000 0.000 0.000 sqrtdel= 1.0000 0.00000 47 -1 0.70 0.50 ag i d10 9l ag i d8 5s2 4f 0.000000 ( //r1// )= 0.00000 a0 0.0000 0.000000 0.000 0.000 sqrtdel= 1.0000 0.00000 47 -1 0.70 0.50 ag i d10 9l ag i d10 6h 0.000000 ( //r1// )= 0.00000 a0 0.0000 0.000000 0.000 0.000 sqrtdel= 1.0000 0.00000 47 -1 0.70 0.50 ag i d10 9l ag i d10 7h 0.000000 ( //r1// )= 0.00000 a0 0.0000 0.000000 0.000 0.000 sqrtdel= 1.0000 0.00000 47 -1 0.70 0.50 ag i d10 9l ag i d10 8h 0.000000 ( //r1// )= 0.00000 a0 0.0000 0.000000 0.000 0.000 sqrtdel= 1.0000 0.00000 47 -1 0.70 0.50 ag i d10 9l ag i d10 9h 0.000000 ( //r1// )= 0.00000 a0 0.0000 0.000000 0.000 0.000 sqrtdel= 1.0000 0.00000 47 -1 0.70 0.50 ag i d10 9l ag i d9 5s6h 0.000000 ( //r1// )= 0.00000 a0 0.0000 0.000000 0.000 0.000 sqrtdel= 1.0000 0.00000 47 -1 0.70 0.50 ag i d10 9l ag i d9 5s7h 0.000000 ( //r1// )= 0.00000 a0 0.0000 0.000000 0.000 0.000 sqrtdel= 1.0000 0.00000 47 -1 0.70 0.50 ag i d10 9l ag i d9 5s8h 0.000000 ( //r1// )= 0.00000 a0 0.0000 0.000000 0.000 0.000 sqrtdel= 1.0000 0.00000 47 -1 0.70 0.50 ag i d10 9l ag i d9 5s9h 0.000000 ( //r1// )= 0.00000 a0 0.0000 0.000000 0.000 0.000 sqrtdel= 1.0000 0.00000 47 -1 0.70 0.50 ag i d10 9l ag i d10 8k 15.449401 (10l//r1// 8k)= 43.69750 a0 0.3398 0.936016 0.348 0.569 sqrtdel= 1.0000 43.69750 47 -1 0.70 0.50 ag i d10 9l ag i d10 9k 76.564453 (10l//r1// 9k)= 216.55698 a0 0.9205 22.988688 0.718 0.898 sqrtdel= 1.0000 216.55698 47 -1 0.70 0.50 ag i d10 9l ag i d9 5s8k 0.000000 ( //r1// )= 0.00000 a0 0.0000 0.000000 0.000 0.000 sqrtdel= 1.0000 0.00000 47 -1 0.70 0.50 ag i d10 9l ag i d9 5s9k 0.000000 ( //r1// )= 0.00000 a0 0.0000 0.000000 0.000 0.000 sqrtdel= 1.0000 0.00000 47 -1 0.70 0.50 ag i d9 5s9l ag i d10 5p 0.000000 ( //r1// )= 0.00000 a0 0.0000 0.000000 0.000 0.000 sqrtdel= 1.0000 0.00000 47 -1 0.70 0.50 ag i d9 5s9l ag i d10 6p 0.000000 ( //r1// )= 0.00000 a0 0.0000 0.000000 0.000 0.000 sqrtdel= 1.0000 0.00000 47 -1 0.70 0.50 ag i d9 5s9l ag i d10 7p 0.000000 ( //r1// )= 0.00000 a0 0.0000 0.000000 0.000 0.000 sqrtdel= 1.0000 0.00000 47 -1 0.70 0.50 ag i d9 5s9l ag i d10 8p 0.000000 ( //r1// )= 0.00000 a0 0.0000 0.000000 0.000 0.000 sqrtdel= 1.0000 0.00000 47 -1 0.70 0.50 ag i d9 5s9l ag i d10 9p 0.000000 ( //r1// )= 0.00000 a0 0.0000 0.000000 0.000 0.000 sqrtdel= 1.0000 0.00000 47 -1 0.70 0.50 ag i d9 5s9l ag i d9 5s5p 0.000000 ( //r1// )= 0.00000 a0 0.0000 0.000000 0.000 0.000 sqrtdel= 1.0000 0.00000 47 -1 0.70 0.50 ag i d9 5s9l ag i d9 5s6p 0.000000 ( //r1// )= 0.00000 a0 0.0000 0.000000 0.000 0.000 sqrtdel= 1.0000 0.00000 47 -1 0.70 0.50 ag i d9 5s9l ag i d9 5s7p 0.000000 ( //r1// )= 0.00000 a0 0.0000 0.000000 0.000 0.000 sqrtdel= 1.0000 0.00000 47 -1 0.70 0.50 ag i d9 5s9l ag i d9 5s8p 0.000000 ( //r1// )= 0.00000 a0 0.0000 0.000000 0.000 0.000 sqrtdel= 1.0000 0.00000 47 -1 0.70 0.50 ag i d9 5s9l ag i d9 5s9p 0.000000 ( //r1// )= 0.00000 a0 0.0000 0.000000 0.000 0.000 sqrtdel= 1.0000 0.00000 47 -1 0.70 0.50 ag i d9 5s9l ag i d8 5s2 5p 0.000000 ( //r1// )= 0.00000 a0 0.0000 0.000000 0.000 0.000 sqrtdel= 1.0000 0.00000 47 -1 0.70 0.50 ag i d9 5s9l ag i d10 4f 0.000000 ( //r1// )= 0.00000 a0 0.0000 0.000000 0.000 0.000 sqrtdel= 1.0000 0.00000 47 -1 0.70 0.50 ag i d9 5s9l ag i d10 5f 0.000000 ( //r1// )= 0.00000 a0 0.0000 0.000000 0.000 0.000 sqrtdel= 1.0000 0.00000 47 -1 0.70 0.50 ag i d9 5s9l ag i d10 6f 0.000000 ( //r1// )= 0.00000 a0 0.0000 0.000000 0.000 0.000 sqrtdel= 1.0000 0.00000 47 -1 0.70 0.50 ag i d9 5s9l ag i d10 7f 0.000000 ( //r1// )= 0.00000 a0 0.0000 0.000000 0.000 0.000 sqrtdel= 1.0000 0.00000 47 -1 0.70 0.50 ag i d9 5s9l ag i d10 8f 0.000000 ( //r1// )= 0.00000 a0 0.0000 0.000000 0.000 0.000 sqrtdel= 1.0000 0.00000 47 -1 0.70 0.50 ag i d9 5s9l ag i d10 9f 0.000000 ( //r1// )= 0.00000 a0 0.0000 0.000000 0.000 0.000 sqrtdel= 1.0000 0.00000 47 -1 0.70 0.50 ag i d9 5s9l ag i d9 5s4f 0.000000 ( //r1// )= 0.00000 a0 0.0000 0.000000 0.000 0.000 sqrtdel= 1.0000 0.00000 47 -1 0.70 0.50 ag i d9 5s9l ag i d9 5s5f 0.000000 ( //r1// )= 0.00000 a0 0.0000 0.000000 0.000 0.000 sqrtdel= 1.0000 0.00000 47 -1 0.70 0.50 ag i d9 5s9l ag i d9 5s6f 0.000000 ( //r1// )= 0.00000 a0 0.0000 0.000000 0.000 0.000 sqrtdel= 1.0000 0.00000 47 -1 0.70 0.50 ag i d9 5s9l ag i d9 5s7f 0.000000 ( //r1// )= 0.00000 a0 0.0000 0.000000 0.000 0.000 sqrtdel= 1.0000 0.00000 47 -1 0.70 0.50 ag i d9 5s9l ag i d9 5s8f 0.000000 ( //r1// )= 0.00000 a0 0.0000 0.000000 0.000 0.000 sqrtdel= 1.0000 0.00000 47 -1 0.70 0.50 ag i d9 5s9l ag i d9 5s9f 0.000000 ( //r1// )= 0.00000 a0 0.0000 0.000000 0.000 0.000 sqrtdel= 1.0000 0.00000 47 -1 0.70 0.50 ag i d9 5s9l ag i d8 5s2 4f 0.000000 ( //r1// )= 0.00000 a0 0.0000 0.000000 0.000 0.000 sqrtdel= 1.0000 0.00000 47 -1 0.70 0.50 ag i d9 5s9l ag i d10 6h 0.000000 ( //r1// )= 0.00000 a0 0.0000 0.000000 0.000 0.000 sqrtdel= 1.0000 0.00000 47 -1 0.70 0.50 ag i d9 5s9l ag i d10 7h 0.000000 ( //r1// )= 0.00000 a0 0.0000 0.000000 0.000 0.000 sqrtdel= 1.0000 0.00000 47 -1 0.70 0.50 ag i d9 5s9l ag i d10 8h 0.000000 ( //r1// )= 0.00000 a0 0.0000 0.000000 0.000 0.000 sqrtdel= 1.0000 0.00000 47 -1 0.70 0.50 ag i d9 5s9l ag i d10 9h 0.000000 ( //r1// )= 0.00000 a0 0.0000 0.000000 0.000 0.000 sqrtdel= 1.0000 0.00000 47 -1 0.70 0.50 ag i d9 5s9l ag i d9 5s6h 0.000000 ( //r1// )= 0.00000 a0 0.0000 0.000000 0.000 0.000 sqrtdel= 1.0000 0.00000 47 -1 0.70 0.50 ag i d9 5s9l ag i d9 5s7h 0.000000 ( //r1// )= 0.00000 a0 0.0000 0.000000 0.000 0.000 sqrtdel= 1.0000 0.00000 47 -1 0.70 0.50 ag i d9 5s9l ag i d9 5s8h 0.000000 ( //r1// )= 0.00000 a0 0.0000 0.000000 0.000 0.000 sqrtdel= 1.0000 0.00000 47 -1 0.70 0.50 ag i d9 5s9l ag i d9 5s9h 0.000000 ( //r1// )= 0.00000 a0 0.0000 0.000000 0.000 0.000 sqrtdel= 1.0000 0.00000 47 -1 0.70 0.50 ag i d9 5s9l ag i d10 8k 0.000000 ( //r1// )= 0.00000 a0 0.0000 0.000000 0.000 0.000 sqrtdel= 1.0000 0.00000 47 -1 0.70 0.50 ag i d9 5s9l ag i d10 9k 0.000000 ( //r1// )= 0.00000 a0 0.0000 0.000000 0.000 0.000 sqrtdel= 1.0000 0.00000 47 -1 0.70 0.50 ag i d9 5s9l ag i d9 5s8k 15.449401 (10l//r1// 8k)= 43.69750 a0 0.3398 0.936016 0.348 0.569 sqrtdel= 1.0000 43.69750 47 -1 0.70 0.50 ag i d9 5s9l ag i d9 5s9k 76.564452 (10l//r1// 9k)= 216.55697 a0 0.9205 22.988688 0.718 0.898 sqrtdel= 1.0000 216.55697 47 -1 0.70 0.50 ag i d9 5p2 ag i d10 5p 0.915318 ( 5p//r1// 4d)= -1.29445 a0 0.8608 0.055854 0.274 0.601 sqrtdel= 1.0000 -1.29445 47 -1 0.70 0.50 ag i d9 5p2 ag i d10 6p 0.000000 ( //r1// )= 0.00000 a0 0.0000 0.000000 0.000 0.000 sqrtdel= 1.0000 0.00000 47 -1 0.70 0.50 ag i d9 5p2 ag i d10 7p 0.000000 ( //r1// )= 0.00000 a0 0.0000 0.000000 0.000 0.000 sqrtdel= 1.0000 0.00000 47 -1 0.70 0.50 ag i d9 5p2 ag i d10 8p 0.000000 ( //r1// )= 0.00000 a0 0.0000 0.000000 0.000 0.000 sqrtdel= 1.0000 0.00000 47 -1 0.70 0.50 ag i d9 5p2 ag i d10 9p 0.000000 ( //r1// )= 0.00000 a0 0.0000 0.000000 0.000 0.000 sqrtdel= 1.0000 0.00000 47 -1 0.70 0.50 ag i d9 5p2 ag i d9 5s5p -3.026790 ( 5p//r1// 5s)= -3.02679 a0 -0.9997 3.053819-0.900-0.999 sqrtdel= 1.0000 -3.02679 47 -1 0.70 0.50 ag i d9 5p2 ag i d9 5s6p 0.000000 ( //r1// )= 0.00000 a0 0.0000 0.000000 0.000 0.000 sqrtdel= 1.0000 0.00000 47 -1 0.70 0.50 ag i d9 5p2 ag i d9 5s7p 0.000000 ( //r1// )= 0.00000 a0 0.0000 0.000000 0.000 0.000 sqrtdel= 1.0000 0.00000 47 -1 0.70 0.50 ag i d9 5p2 ag i d9 5s8p 0.000000 ( //r1// )= 0.00000 a0 0.0000 0.000000 0.000 0.000 sqrtdel= 1.0000 0.00000 47 -1 0.70 0.50 ag i d9 5p2 ag i d9 5s9p 0.000000 ( //r1// )= 0.00000 a0 0.0000 0.000000 0.000 0.000 sqrtdel= 1.0000 0.00000 47 -1 0.70 0.50 ag i d9 5p2 ag i d8 5s2 5p 0.000000 ( //r1// )= 0.00000 a0 0.0000 0.000000 0.000 0.000 sqrtdel= 1.0000 0.00000 47 -1 0.70 0.50 ag i d9 5p2 ag i d10 4f 0.000000 ( //r1// )= 0.00000 a0 0.0000 0.000000 0.000 0.000 sqrtdel= 1.0000 0.00000 47 -1 0.70 0.50 ag i d9 5p2 ag i d10 5f 0.000000 ( //r1// )= 0.00000 a0 0.0000 0.000000 0.000 0.000 sqrtdel= 1.0000 0.00000 47 -1 0.70 0.50 ag i d9 5p2 ag i d10 6f 0.000000 ( //r1// )= 0.00000 a0 0.0000 0.000000 0.000 0.000 sqrtdel= 1.0000 0.00000 47 -1 0.70 0.50 ag i d9 5p2 ag i d10 7f 0.000000 ( //r1// )= 0.00000 a0 0.0000 0.000000 0.000 0.000 sqrtdel= 1.0000 0.00000 47 -1 0.70 0.50 ag i d9 5p2 ag i d10 8f 0.000000 ( //r1// )= 0.00000 a0 0.0000 0.000000 0.000 0.000 sqrtdel= 1.0000 0.00000 47 -1 0.70 0.50 ag i d9 5p2 ag i d10 9f 0.000000 ( //r1// )= 0.00000 a0 0.0000 0.000000 0.000 0.000 sqrtdel= 1.0000 0.00000 47 -1 0.70 0.50 ag i d9 5p2 ag i d9 5s4f 0.000000 ( //r1// )= 0.00000 a0 0.0000 0.000000 0.000 0.000 sqrtdel= 1.0000 0.00000 47 -1 0.70 0.50 ag i d9 5p2 ag i d9 5s5f 0.000000 ( //r1// )= 0.00000 a0 0.0000 0.000000 0.000 0.000 sqrtdel= 1.0000 0.00000 47 -1 0.70 0.50 ag i d9 5p2 ag i d9 5s6f 0.000000 ( //r1// )= 0.00000 a0 0.0000 0.000000 0.000 0.000 sqrtdel= 1.0000 0.00000 47 -1 0.70 0.50 ag i d9 5p2 ag i d9 5s7f 0.000000 ( //r1// )= 0.00000 a0 0.0000 0.000000 0.000 0.000 sqrtdel= 1.0000 0.00000 47 -1 0.70 0.50 ag i d9 5p2 ag i d9 5s8f 0.000000 ( //r1// )= 0.00000 a0 0.0000 0.000000 0.000 0.000 sqrtdel= 1.0000 0.00000 47 -1 0.70 0.50 ag i d9 5p2 ag i d9 5s9f 0.000000 ( //r1// )= 0.00000 a0 0.0000 0.000000 0.000 0.000 sqrtdel= 1.0000 0.00000 47 -1 0.70 0.50 ag i d9 5p2 ag i d8 5s2 4f 0.000000 ( //r1// )= 0.00000 a0 0.0000 0.000000 0.000 0.000 sqrtdel= 1.0000 0.00000 47 -1 0.70 0.50 ag i d9 5p2 ag i d10 6h 0.000000 ( //r1// )= 0.00000 a0 0.0000 0.000000 0.000 0.000 sqrtdel= 1.0000 0.00000 47 -1 0.70 0.50 ag i d9 5p2 ag i d10 7h 0.000000 ( //r1// )= 0.00000 a0 0.0000 0.000000 0.000 0.000 sqrtdel= 1.0000 0.00000 47 -1 0.70 0.50 ag i d9 5p2 ag i d10 8h 0.000000 ( //r1// )= 0.00000 a0 0.0000 0.000000 0.000 0.000 sqrtdel= 1.0000 0.00000 47 -1 0.70 0.50 ag i d9 5p2 ag i d10 9h 0.000000 ( //r1// )= 0.00000 a0 0.0000 0.000000 0.000 0.000 sqrtdel= 1.0000 0.00000 47 -1 0.70 0.50 ag i d9 5p2 ag i d9 5s6h 0.000000 ( //r1// )= 0.00000 a0 0.0000 0.000000 0.000 0.000 sqrtdel= 1.0000 0.00000 47 -1 0.70 0.50 ag i d9 5p2 ag i d9 5s7h 0.000000 ( //r1// )= 0.00000 a0 0.0000 0.000000 0.000 0.000 sqrtdel= 1.0000 0.00000 47 -1 0.70 0.50 ag i d9 5p2 ag i d9 5s8h 0.000000 ( //r1// )= 0.00000 a0 0.0000 0.000000 0.000 0.000 sqrtdel= 1.0000 0.00000 47 -1 0.70 0.50 ag i d9 5p2 ag i d9 5s9h 0.000000 ( //r1// )= 0.00000 a0 0.0000 0.000000 0.000 0.000 sqrtdel= 1.0000 0.00000 47 -1 0.70 0.50 ag i d9 5p2 ag i d10 8k 0.000000 ( //r1// )= 0.00000 a0 0.0000 0.000000 0.000 0.000 sqrtdel= 1.0000 0.00000 47 -1 0.70 0.50 ag i d9 5p2 ag i d10 9k 0.000000 ( //r1// )= 0.00000 a0 0.0000 0.000000 0.000 0.000 sqrtdel= 1.0000 0.00000 47 -1 0.70 0.50 ag i d9 5p2 ag i d9 5s8k 0.000000 ( //r1// )= 0.00000 a0 0.0000 0.000000 0.000 0.000 sqrtdel= 1.0000 0.00000 47 -1 0.70 0.50 ag i d9 5p2 ag i d9 5s9k 0.000000 ( //r1// )= 0.00000 a0 0.0000 0.000000 0.000 0.000 sqrtdel= 1.0000 0.00000 -99999999. t=******* sec %FOR-E-OUTCONERR, output conversion error unit 9 file SYS$OUTPUT:.; user PC 000DD361 %TRACE-E-TRACEBACK, symbolic stack dump follows module name routine name line rel PC abs PC 00132A92 00132A92 0013298F 0013298F 0012E9FC 0012E9FC G5INP G5INP 861 0000348D 000DD361 RCN232 RCN232 89 000000F1 000D70F1 finished g5inp $DELETE POOLG:HF470001.DAT;* $DELETE POOLG:HF470002.DAT;* $DELETE POOLG:HF470004.DAT;* $DELETE POOLG:HF470031.DAT;* $DELETE POOLG:HF470032.DAT;* KURUCZ job terminated at 17-APR-2000 21:27:08.51 Accounting information: Buffered I/O count: 1416 Peak working set size: 3357 Direct I/O count: 21975 Peak page file size: 7828 Page faults: 7662 Mounted volumes: 0 Charged CPU time: 0 00:27:29.26 Elapsed time: 0 00:44:25.44