MOLPRO Basis Query, element=Th, basis=cc-pwCVDZ-DK3, l=d
Basis Th d cc-pwCVDZ-DK3
| Primitives | Contractions... |
|---|
| 30187.200000 | 0.000131 | -0.000048 | 0.000029 | -0.000008 | -0.000015 | 0.000000 | 0.000000 |
| 7379.660000 | 0.000910 | -0.000338 | 0.000199 | -0.000054 | -0.000098 | 0.000000 | 0.000000 |
| 2502.540000 | 0.004893 | -0.001833 | 0.001080 | -0.000294 | -0.000565 | 0.000000 | 0.000000 |
| 1011.650000 | 0.021361 | -0.008076 | 0.004739 | -0.001287 | -0.002342 | 0.000000 | 0.000000 |
| 455.639000 | 0.073980 | -0.028530 | 0.016751 | -0.004564 | -0.008776 | 0.000000 | 0.000000 |
| 220.484000 | 0.194518 | -0.076635 | 0.044745 | -0.012157 | -0.021990 | 0.000000 | 0.000000 |
| 111.758000 | 0.354886 | -0.138163 | 0.081180 | -0.022150 | -0.043597 | 0.000000 | 0.000000 |
| 58.493300 | 0.391057 | -0.117428 | 0.069159 | -0.018487 | -0.029861 | 0.000000 | 0.000000 |
| 30.969400 | 0.182855 | 0.138876 | -0.075270 | 0.021282 | 0.028924 | 0.000000 | 0.000000 |
| 16.229800 | -0.029597 | 0.460930 | -0.260881 | 0.074207 | 0.164055 | 0.000000 | 0.000000 |
| 8.507410 | -0.063527 | 0.426736 | -0.203256 | 0.053701 | 0.062908 | 0.000000 | 0.000000 |
| 4.340360 | -0.019274 | 0.128203 | 0.252529 | -0.086439 | -0.098948 | 1.000000 | 0.000000 |
| 2.167340 | -0.000582 | 0.004075 | 0.560446 | -0.200556 | -0.592096 | 0.000000 | 0.000000 |
| 1.030960 | 0.000219 | -0.000805 | 0.335014 | -0.048812 | 0.277733 | 0.000000 | 0.000000 |
| 0.421985 | 0.000082 | -0.000526 | 0.048878 | 0.350210 | 0.971418 | 0.000000 | 0.000000 |
| 0.160635 | -0.000013 | 0.000105 | -0.001986 | 0.557091 | -0.530018 | 0.000000 | 0.000000 |
| 0.055926 | 0.000004 | -0.000035 | 0.000714 | 0.297680 | -0.444449 | 0.000000 | 1.000000 |
Comment: R. Feng and K.A. Peterson, J. Chem. Phys. 147, 084108 (2017)
| 