MOLPRO Basis Query, element=Ca, basis=aug-cc-pwCVDZ, l=p
Basis Ca p aug-cc-pwCVDZ
| Primitives | Contractions... |
|---|
| 1236.528000 | 0.001610 | -0.000527 | 0.000110 | 0.000000 | 0.000000 | 0.000000 |
| 277.429200 | 0.014372 | -0.004705 | 0.000978 | 0.000000 | 0.000000 | 0.000000 |
| 86.513470 | 0.071588 | -0.024059 | 0.005053 | 0.000000 | 0.000000 | 0.000000 |
| 31.626220 | 0.225429 | -0.078081 | 0.016282 | 0.000000 | 0.000000 | 0.000000 |
| 12.500150 | 0.425126 | -0.157752 | 0.033609 | 0.000000 | 0.000000 | 0.000000 |
| 5.134094 | 0.381133 | -0.134782 | 0.027235 | 0.000000 | 0.000000 | 0.000000 |
| 2.008968 | 0.082750 | 0.224136 | -0.052528 | 0.000000 | 0.000000 | 0.000000 |
| 0.838154 | -0.003633 | 0.557516 | -0.146018 | 0.000000 | 0.000000 | 0.000000 |
| 0.337704 | 0.001847 | 0.356789 | -0.107776 | 0.000000 | 0.000000 | 0.000000 |
| 0.080709 | -0.000525 | 0.026944 | 0.504039 | 0.000000 | 0.000000 | 0.000000 |
| 0.029033 | 0.000202 | -0.004960 | 0.607438 | 1.000000 | 0.000000 | 0.000000 |
| 1.180400 | 0.000000 | 0.000000 | 0.000000 | 0.000000 | 1.000000 | 0.000000 |
| 0.010440 | 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)
| 