MOLPRO Basis Query, element=Hg, basis=AVTZ-DK, l=p
Basis Hg p AVTZ-DK
Primitives | Contractions... |
422095000.000000 | 0.000003 | -0.000002 | 0.000001 | -0.000000 | 0.000000 | -0.000000 | -0.000000 | 0.000000 | 0.000000 |
72298800.000000 | 0.000009 | -0.000005 | 0.000002 | -0.000001 | 0.000000 | -0.000000 | -0.000001 | 0.000000 | 0.000000 |
14929600.000000 | 0.000026 | -0.000013 | 0.000007 | -0.000003 | 0.000001 | -0.000001 | -0.000002 | 0.000000 | 0.000000 |
3625460.000000 | 0.000067 | -0.000034 | 0.000017 | -0.000007 | 0.000002 | -0.000003 | -0.000005 | 0.000000 | 0.000000 |
1012740.000000 | 0.000165 | -0.000085 | 0.000043 | -0.000017 | 0.000004 | -0.000008 | -0.000013 | 0.000000 | 0.000000 |
319140.000000 | 0.000394 | -0.000204 | 0.000102 | -0.000041 | 0.000010 | -0.000020 | -0.000031 | 0.000000 | 0.000000 |
111526.000000 | 0.000927 | -0.000481 | 0.000240 | -0.000097 | 0.000023 | -0.000048 | -0.000073 | 0.000000 | 0.000000 |
42575.800000 | 0.002189 | -0.001141 | 0.000570 | -0.000231 | 0.000056 | -0.000114 | -0.000173 | 0.000000 | 0.000000 |
17525.200000 | 0.005230 | -0.002739 | 0.001370 | -0.000555 | 0.000134 | -0.000275 | -0.000413 | 0.000000 | 0.000000 |
7690.100000 | 0.012625 | -0.006673 | 0.003346 | -0.001356 | 0.000327 | -0.000668 | -0.001017 | 0.000000 | 0.000000 |
3561.870000 | 0.030325 | -0.016228 | 0.008159 | -0.003311 | 0.000799 | -0.001639 | -0.002462 | 0.000000 | 0.000000 |
1726.440000 | 0.070224 | -0.038448 | 0.019444 | -0.007894 | 0.001904 | -0.003886 | -0.005937 | 0.000000 | 0.000000 |
869.100000 | 0.147224 | -0.083192 | 0.042389 | -0.017253 | 0.004169 | -0.008557 | -0.012809 | 0.000000 | 0.000000 |
451.339000 | 0.256963 | -0.152058 | 0.078451 | -0.031989 | 0.007715 | -0.015723 | -0.024190 | 0.000000 | 0.000000 |
240.323000 | 0.328282 | -0.198075 | 0.102640 | -0.041962 | 0.010160 | -0.020952 | -0.030880 | 0.000000 | 0.000000 |
130.456000 | 0.250912 | -0.090875 | 0.035371 | -0.013166 | 0.003083 | -0.005935 | -0.010833 | 0.000000 | 0.000000 |
71.796700 | 0.088476 | 0.238789 | -0.188917 | 0.084066 | -0.020433 | 0.041166 | 0.067379 | 0.000000 | 0.000000 |
39.838100 | 0.009129 | 0.509016 | -0.425909 | 0.194429 | -0.047897 | 0.099881 | 0.145381 | 0.000000 | 0.000000 |
22.157500 | 0.000414 | 0.325330 | -0.176328 | 0.062563 | -0.014322 | 0.026790 | 0.056440 | 0.000000 | 0.000000 |
12.275500 | -0.000235 | 0.067077 | 0.416082 | -0.257169 | 0.064963 | -0.131351 | -0.249331 | 0.000000 | 0.000000 |
6.727050 | 0.000031 | 0.004412 | 0.590811 | -0.427505 | 0.113390 | -0.242171 | -0.323093 | 0.000000 | 0.000000 |
3.617940 | -0.000047 | 0.000116 | 0.220477 | -0.035052 | 0.000873 | 0.002952 | -0.138291 | 0.000000 | 0.000000 |
1.892530 | 0.000027 | 0.000023 | 0.017468 | 0.525943 | -0.169656 | 0.394613 | 1.346826 | 0.000000 | 0.000000 |
0.949778 | -0.000009 | -0.000079 | 0.001855 | 0.509915 | -0.198063 | 0.479940 | -0.200606 | 0.000000 | 0.000000 |
0.453840 | 0.000005 | 0.000014 | -0.000295 | 0.158670 | 0.015181 | -0.485262 | -1.552799 | 0.000000 | 0.000000 |
0.183075 | -0.000002 | -0.000009 | 0.000142 | 0.011573 | 0.373128 | -0.701303 | 0.807778 | 0.000000 | 0.000000 |
0.075311 | 0.000001 | 0.000004 | -0.000072 | 0.000466 | 0.532956 | -0.112283 | 0.447636 | 0.000000 | 0.000000 |
0.030803 | -0.000000 | -0.000001 | 0.000021 | 0.000013 | 0.227189 | -0.005627 | -0.016311 | 1.000000 | 0.000000 |
0.012600 | 0.000000 | 0.000000 | 0.000000 | 0.000000 | 0.000000 | 0.000000 | 0.000000 | 0.000000 | 1.000000 |
Comment: basis set from gbasis database