MOLPRO Basis Query, element=Th, basis=cc-pVDZ-DK3, l=p
Basis Th p cc-pVDZ-DK3
Primitives | Contractions... |
25376500.000000 | 0.000032 | -0.000038 | 0.000004 | -0.000005 | 0.000002 | -0.000001 | -0.000001 | 0.000000 |
5256400.000000 | 0.000071 | -0.000084 | 0.000010 | -0.000012 | 0.000005 | -0.000001 | -0.000003 | 0.000000 |
1307700.000000 | 0.000200 | -0.000237 | 0.000028 | -0.000033 | 0.000015 | -0.000004 | -0.000009 | 0.000000 |
366581.000000 | 0.000508 | -0.000604 | 0.000071 | -0.000083 | 0.000037 | -0.000009 | -0.000023 | 0.000000 |
112775.000000 | 0.001339 | -0.001596 | 0.000190 | -0.000221 | 0.000099 | -0.000025 | -0.000062 | 0.000000 |
37577.100000 | 0.003585 | -0.004294 | 0.000514 | -0.000596 | 0.000268 | -0.000067 | -0.000166 | 0.000000 |
13500.300000 | 0.009829 | -0.011872 | 0.001447 | -0.001658 | 0.000744 | -0.000186 | -0.000463 | 0.000000 |
5223.300000 | 0.026851 | -0.032858 | 0.004085 | -0.004643 | 0.002083 | -0.000519 | -0.001295 | 0.000000 |
2167.970000 | 0.069485 | -0.087071 | 0.011316 | -0.012512 | 0.005615 | -0.001402 | -0.003491 | 0.000000 |
957.173000 | 0.154554 | -0.200766 | 0.027514 | -0.029710 | 0.013315 | -0.003317 | -0.008285 | 0.000000 |
444.127000 | 0.255117 | -0.346998 | 0.051435 | -0.052985 | 0.023782 | -0.005944 | -0.014784 | 0.000000 |
214.166000 | 0.260246 | -0.300513 | 0.030337 | -0.039203 | 0.017512 | -0.004335 | -0.010910 | 0.000000 |
105.621000 | 0.200799 | 0.180446 | -0.145548 | 0.093891 | -0.041929 | 0.010420 | 0.026331 | 0.000000 |
54.088400 | 0.214140 | 0.623819 | -0.389003 | 0.258367 | -0.116809 | 0.029446 | 0.073068 | 0.000000 |
28.001100 | 0.116640 | 0.318382 | -0.040927 | 0.029162 | -0.010030 | 0.001997 | 0.005974 | 0.000000 |
14.086200 | 0.009579 | -0.096159 | 0.652972 | -0.536682 | 0.257327 | -0.064750 | -0.166908 | 0.000000 |
7.238580 | -0.002437 | -0.100300 | 0.485896 | -0.359575 | 0.174970 | -0.045876 | -0.109201 | 0.000000 |
3.345630 | -0.000295 | -0.008435 | 0.057973 | 0.633016 | -0.445517 | 0.123378 | 0.316342 | 0.000000 |
1.612690 | 0.000324 | 0.003721 | -0.003714 | 0.584510 | -0.387023 | 0.103390 | 0.293387 | 0.000000 |
0.603608 | -0.000013 | 0.000229 | 0.000868 | 0.083551 | 0.548358 | -0.187912 | -0.844687 | 0.000000 |
0.258298 | 0.000021 | 0.000095 | -0.000336 | 0.014395 | 0.618403 | -0.298740 | -0.004057 | 0.000000 |
0.078150 | -0.000005 | -0.000007 | 0.000137 | 0.004886 | 0.080683 | 0.339731 | 0.911333 | 0.000000 |
0.027834 | 0.000002 | 0.000004 | -0.000044 | -0.001018 | -0.008577 | 0.799706 | 0.138324 | 1.000000 |
Comment: R. Feng and K.A. Peterson, J. Chem. Phys. 147, 084108 (2017)
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