MOLPRO Basis Query, element=Th, basis=cc-pVTZ-X2C, l=s
Basis Th s cc-pVTZ-X2C
| Primitives | Contractions... |
|---|
| 57354700.000000 | 0.001027 | 0.002585 | 0.000127 | -0.000389 | 0.000140 | -0.000057 | 0.000020 | -0.000040 | -0.000062 | 0.000075 | 0.000000 |
| 15266300.000000 | 0.000682 | 0.001723 | 0.000085 | -0.000260 | 0.000093 | -0.000038 | 0.000014 | -0.000026 | -0.000042 | 0.000050 | 0.000000 |
| 5222650.000000 | 0.002196 | 0.005545 | 0.000275 | -0.000836 | 0.000301 | -0.000122 | 0.000044 | -0.000085 | -0.000134 | 0.000161 | 0.000000 |
| 1986480.000000 | 0.002257 | 0.005734 | 0.000289 | -0.000869 | 0.000313 | -0.000127 | 0.000046 | -0.000089 | -0.000140 | 0.000168 | 0.000000 |
| 828684.000000 | 0.004810 | 0.012247 | 0.000623 | -0.001861 | 0.000669 | -0.000272 | 0.000098 | -0.000190 | -0.000299 | 0.000358 | 0.000000 |
| 366334.000000 | 0.005899 | 0.015196 | 0.000797 | -0.002333 | 0.000839 | -0.000341 | 0.000122 | -0.000238 | -0.000375 | 0.000452 | 0.000000 |
| 170394.000000 | 0.010627 | 0.027591 | 0.001477 | -0.004266 | 0.001533 | -0.000623 | 0.000224 | -0.000434 | -0.000685 | 0.000818 | 0.000000 |
| 82200.700000 | 0.014323 | 0.037971 | 0.002140 | -0.005978 | 0.002148 | -0.000873 | 0.000313 | -0.000610 | -0.000962 | 0.001165 | 0.000000 |
| 40916.100000 | 0.023615 | 0.063815 | 0.003762 | -0.010213 | 0.003668 | -0.001491 | 0.000535 | -0.001038 | -0.001635 | 0.001939 | 0.000000 |
| 20874.000000 | 0.032832 | 0.092202 | 0.005897 | -0.015218 | 0.005463 | -0.002222 | 0.000798 | -0.001554 | -0.002452 | 0.003004 | 0.000000 |
| 10882.100000 | 0.049002 | 0.144175 | 0.010086 | -0.024666 | 0.008846 | -0.003597 | 0.001291 | -0.002498 | -0.003932 | 0.004585 | 0.000000 |
| 5778.570000 | 0.061828 | 0.198327 | 0.015940 | -0.036008 | 0.012912 | -0.005254 | 0.001886 | -0.003687 | -0.005827 | 0.007318 | 0.000000 |
| 3118.860000 | 0.071494 | 0.259043 | 0.024404 | -0.050673 | 0.018143 | -0.007378 | 0.002646 | -0.005095 | -0.008004 | 0.008916 | 0.000000 |
| 1707.150000 | 0.061354 | 0.259067 | 0.028340 | -0.054678 | 0.019613 | -0.007991 | 0.002872 | -0.005686 | -0.009031 | 0.012384 | 0.000000 |
| 945.440000 | 0.060103 | 0.161756 | 0.008048 | -0.024027 | 0.008469 | -0.003416 | 0.001217 | -0.002142 | -0.003230 | 0.000577 | 0.000000 |
| 527.505000 | 0.131275 | -0.069254 | -0.081371 | 0.094105 | -0.034771 | 0.014244 | -0.005098 | 0.009463 | 0.014686 | -0.010805 | 0.000000 |
| 299.802000 | 0.277979 | -0.292594 | -0.246670 | 0.305663 | -0.116987 | 0.048378 | -0.017434 | 0.034967 | 0.055961 | -0.082839 | 0.000000 |
| 172.658000 | 0.287305 | -0.327354 | -0.328377 | 0.421750 | -0.166310 | 0.068898 | -0.024696 | 0.046135 | 0.071873 | -0.056169 | 0.000000 |
| 100.725000 | 0.130232 | -0.134481 | -0.078594 | 0.103606 | -0.042677 | 0.018299 | -0.006774 | 0.017202 | 0.029440 | -0.097757 | 0.000000 |
| 59.554500 | 0.030401 | 0.015659 | 0.345253 | -0.698068 | 0.369474 | -0.162692 | 0.059255 | -0.124681 | -0.205426 | 0.383048 | 0.000000 |
| 35.717900 | 0.016403 | 0.036062 | 0.332386 | -0.966564 | 0.551485 | -0.242987 | 0.087425 | -0.159274 | -0.248793 | 0.088904 | 0.000000 |
| 21.401800 | 0.003689 | 0.017510 | 0.179646 | -0.149616 | 0.050474 | -0.026185 | 0.010726 | -0.039457 | -0.067761 | 0.421650 | 0.000000 |
| 12.342400 | -0.004724 | 0.028949 | 0.261125 | 0.757211 | -0.860452 | 0.451292 | -0.169334 | 0.380916 | 0.665044 | -1.582340 | 0.000000 |
| 7.319170 | -0.003883 | 0.017535 | 0.172451 | 0.543436 | -0.926364 | 0.527406 | -0.195475 | 0.353225 | 0.558335 | 0.501480 | 0.000000 |
| 4.272360 | -0.000609 | 0.003966 | 0.032301 | 0.110859 | 0.276676 | -0.232189 | 0.086076 | -0.171200 | -0.408102 | -1.028900 | 0.000000 |
| 2.416550 | -0.000132 | -0.000067 | 0.002782 | 0.033707 | 0.953462 | -0.876145 | 0.368923 | -0.890104 | -1.564050 | 5.970820 | 0.000000 |
| 1.370050 | 0.000006 | 0.000355 | 0.001118 | 0.011954 | 0.375130 | -0.576169 | 0.246035 | -0.611493 | -1.567100 | -6.039100 | 0.000000 |
| 0.840557 | -0.000019 | -0.000138 | -0.000038 | 0.001188 | 0.038833 | 0.427201 | -0.210341 | 1.308560 | 5.425110 | -2.735260 | 0.000000 |
| 0.428443 | 0.000006 | 0.000055 | 0.000070 | 0.000199 | 0.011322 | 0.854740 | -0.562288 | 1.183880 | -2.015060 | 9.419120 | 0.000000 |
| 0.218325 | -0.000002 | -0.000021 | -0.000009 | 0.000033 | 0.001568 | 0.286571 | -0.341614 | -1.022150 | -2.674010 | -6.978710 | 0.000000 |
| 0.091126 | 0.000001 | 0.000008 | 0.000007 | 0.000004 | 0.000421 | 0.025082 | 0.413341 | -1.555170 | 2.799670 | 1.072490 | 0.000000 |
| 0.042334 | -0.000000 | -0.000004 | -0.000003 | 0.000001 | 0.000009 | 0.029090 | 0.725500 | 0.870363 | -0.132248 | 2.082940 | 0.000000 |
| 0.018975 | 0.000000 | 0.000001 | 0.000001 | 0.000001 | 0.000058 | 0.007104 | 0.186504 | 0.628182 | -0.927749 | -1.561820 | 1.000000 |
Comment: R. Feng and K.A. Peterson, J. Chem. Phys. 147, 084108 (2017)
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