MOLPRO Basis Query, element=At, basis=cc-pVQZ-PP-F12, l=d
Basis At d cc-pVQZ-PP-F12
| Primitives | Contractions... |
|---|
| 180.133000 | 0.000101 | 0.000000 | 0.000000 | 0.000000 | 0.000000 | 0.000000 |
| 53.478200 | 0.000750 | 0.000000 | 0.000000 | 0.000000 | 0.000000 | 0.000000 |
| 15.473500 | 0.010023 | 0.000000 | 0.000000 | 0.000000 | 0.000000 | 0.000000 |
| 7.149000 | -0.085610 | 0.000000 | 0.000000 | 0.000000 | 0.000000 | 0.000000 |
| 4.460470 | 0.037715 | 0.000000 | 0.000000 | 0.000000 | 0.000000 | 0.000000 |
| 2.758810 | 0.231543 | 0.000000 | 0.000000 | 0.000000 | 0.000000 | 0.000000 |
| 1.722110 | 0.322219 | 0.000000 | 0.000000 | 0.000000 | 0.000000 | 0.000000 |
| 1.070740 | 0.303855 | 0.000000 | 0.000000 | 0.000000 | 0.000000 | 0.000000 |
| 0.640318 | 0.195201 | 0.000000 | 0.000000 | 0.000000 | 0.000000 | 0.000000 |
| 0.366291 | 0.072028 | 0.000000 | 0.000000 | 0.000000 | 0.000000 | 0.000000 |
| 0.205139 | 0.013998 | 0.000000 | 0.000000 | 0.000000 | 0.000000 | 0.000000 |
| 0.101700 | 0.001567 | 0.000000 | 0.000000 | 0.000000 | 0.000000 | 0.000000 |
| 3.738300 | 0.000000 | 1.000000 | 0.000000 | 0.000000 | 0.000000 | 0.000000 |
| 1.118400 | 0.000000 | 0.000000 | 1.000000 | 0.000000 | 0.000000 | 0.000000 |
| 0.521300 | 0.000000 | 0.000000 | 0.000000 | 1.000000 | 0.000000 | 0.000000 |
| 0.243000 | 0.000000 | 0.000000 | 0.000000 | 0.000000 | 1.000000 | 0.000000 |
| 0.113300 | 0.000000 | 0.000000 | 0.000000 | 0.000000 | 0.000000 | 1.000000 |
Comment: Hill and Peterson, J. Chem. Phys. 141, 094106 (2014)
| 