MOLPRO Basis Query, element=Ba, basis=AVQZ-PP, l=p
Basis Ba p AVQZ-PP
| Primitives | Contractions... |
|---|
| 12.433700 | -0.002988 | 0.000974 | 0.000000 | 0.000000 | 0.000000 | 0.000000 |
| 6.821250 | 0.024062 | -0.007549 | 0.000000 | 0.000000 | 0.000000 | 0.000000 |
| 4.255780 | -0.013686 | 0.005615 | 0.000000 | 0.000000 | 0.000000 | 0.000000 |
| 1.857250 | -0.220996 | 0.060311 | 0.000000 | 0.000000 | 0.000000 | 0.000000 |
| 0.652230 | 0.323990 | -0.101749 | 0.000000 | 0.000000 | 0.000000 | 0.000000 |
| 0.356635 | 0.502622 | -0.154956 | 0.000000 | 0.000000 | 0.000000 | 0.000000 |
| 0.187724 | 0.297026 | -0.172421 | 0.000000 | 0.000000 | 0.000000 | 0.000000 |
| 0.089136 | 0.052591 | 0.096329 | 0.000000 | 0.000000 | 0.000000 | 0.000000 |
| 0.044682 | 0.000477 | 0.502635 | 1.000000 | 0.000000 | 0.000000 | 0.000000 |
| 0.022696 | 0.001930 | 0.450051 | 0.000000 | 1.000000 | 0.000000 | 0.000000 |
| 0.011643 | -0.000350 | 0.102433 | 0.000000 | 0.000000 | 1.000000 | 0.000000 |
| 0.006000 | 0.000000 | 0.000000 | 0.000000 | 0.000000 | 0.000000 | 1.000000 |
Comment: J.G. Hill and K.A. Peterson, J. Chem. Phys. 147, 244106 (2017)
| 