MOLPRO Basis Query, element=Hg, basis=WCVTZ-DK3, l=d
Basis Hg d WCVTZ-DK3
Primitives | Contractions... |
62494.100000 | 0.000020 | -0.000010 | 0.000003 | 0.000004 | 0.000005 | 0.000000 | 0.000000 | 0.000000 |
16643.100000 | 0.000116 | -0.000060 | 0.000019 | 0.000023 | 0.000028 | 0.000000 | 0.000000 | 0.000000 |
5557.080000 | 0.000622 | -0.000325 | 0.000101 | 0.000124 | 0.000154 | 0.000000 | 0.000000 | 0.000000 |
2202.770000 | 0.002781 | -0.001456 | 0.000454 | 0.000553 | 0.000678 | 0.000000 | 0.000000 | 0.000000 |
990.976000 | 0.010644 | -0.005613 | 0.001750 | 0.002151 | 0.002673 | 0.000000 | 0.000000 | 0.000000 |
487.885000 | 0.033660 | -0.017887 | 0.005589 | 0.006816 | 0.008373 | 0.000000 | 0.000000 | 0.000000 |
255.394000 | 0.088764 | -0.047983 | 0.015023 | 0.018523 | 0.023111 | 0.000000 | 0.000000 | 0.000000 |
139.018000 | 0.187508 | -0.102420 | 0.032162 | 0.039293 | 0.048568 | 0.000000 | 0.000000 | 0.000000 |
77.382200 | 0.300714 | -0.161643 | 0.050553 | 0.062227 | 0.076885 | 0.000000 | 0.000000 | 0.000000 |
43.515200 | 0.330542 | -0.150065 | 0.045024 | 0.052461 | 0.059419 | 0.000000 | 0.000000 | 0.000000 |
24.508800 | 0.200920 | 0.050676 | -0.028950 | -0.039613 | -0.059285 | 0.000000 | 0.000000 | 0.000000 |
13.741700 | 0.056723 | 0.330549 | -0.129053 | -0.174266 | -0.245377 | 0.000000 | 0.000000 | 0.000000 |
7.634990 | 0.005870 | 0.433079 | -0.168972 | -0.188896 | -0.175704 | 0.000000 | 0.000000 | 0.000000 |
4.186600 | 0.000553 | 0.258521 | -0.038972 | -0.038191 | -0.055246 | 0.000000 | 0.000000 | 0.000000 |
2.217860 | 0.000028 | 0.061235 | 0.226455 | 0.475831 | 1.195745 | 0.000000 | 0.000000 | 0.000000 |
1.132370 | 0.000017 | 0.004017 | 0.391526 | 0.528441 | -0.456164 | 0.000000 | 0.000000 | 0.000000 |
0.554423 | -0.000008 | 0.000412 | 0.356973 | -0.326152 | -1.103543 | 0.000000 | 0.000000 | 0.000000 |
0.258015 | 0.000003 | -0.000063 | 0.201364 | -0.580734 | 0.710722 | 0.000000 | 0.000000 | 0.000000 |
0.111354 | -0.000001 | 0.000020 | 0.050358 | -0.177057 | 0.392890 | 1.000000 | 0.000000 | 0.000000 |
5.424000 | 0.000000 | 0.000000 | 0.000000 | 0.000000 | 0.000000 | 0.000000 | 1.000000 | 0.000000 |
1.403000 | 0.000000 | 0.000000 | 0.000000 | 0.000000 | 0.000000 | 0.000000 | 0.000000 | 1.000000 |
Comment: basis set from gbasis database