MOLPRO Basis Query, element=Ca, basis=cc-pCVQZ-old, l=p
Basis Ca p cc-pCVQZ-old
| Primitives | Contractions... |
|---|
| 9363.010000 | 0.000046 | -0.000015 | 0.000003 | 0.000000 | 0.000000 | 0.000000 | 0.000000 | 0.000000 | 0.000000 |
| 2216.255000 | 0.000410 | -0.000134 | 0.000028 | 0.000000 | 0.000000 | 0.000000 | 0.000000 | 0.000000 | 0.000000 |
| 719.759600 | 0.002356 | -0.000770 | 0.000160 | 0.000000 | 0.000000 | 0.000000 | 0.000000 | 0.000000 | 0.000000 |
| 275.172800 | 0.010255 | -0.003365 | 0.000704 | 0.000000 | 0.000000 | 0.000000 | 0.000000 | 0.000000 | 0.000000 |
| 116.392400 | 0.035660 | -0.011866 | 0.002469 | 0.000000 | 0.000000 | 0.000000 | 0.000000 | 0.000000 | 0.000000 |
| 52.777700 | 0.099641 | -0.033894 | 0.007119 | 0.000000 | 0.000000 | 0.000000 | 0.000000 | 0.000000 | 0.000000 |
| 25.131880 | 0.213206 | -0.075143 | 0.015690 | 0.000000 | 0.000000 | 0.000000 | 0.000000 | 0.000000 | 0.000000 |
| 12.314160 | 0.331535 | -0.121443 | 0.025786 | 0.000000 | 0.000000 | 0.000000 | 0.000000 | 0.000000 | 0.000000 |
| 6.166797 | 0.329343 | -0.129221 | 0.026937 | 0.000000 | 0.000000 | 0.000000 | 0.000000 | 0.000000 | 0.000000 |
| 3.114279 | 0.154664 | 0.015877 | -0.004856 | 0.000000 | 0.000000 | 0.000000 | 0.000000 | 0.000000 | 0.000000 |
| 1.519013 | 0.022155 | 0.308537 | -0.076542 | 0.000000 | 0.000000 | 0.000000 | 0.000000 | 0.000000 | 0.000000 |
| 0.725435 | 0.000552 | 0.472815 | -0.115545 | 0.000000 | 0.000000 | 0.000000 | 0.000000 | 0.000000 | 0.000000 |
| 0.340926 | 0.000152 | 0.294103 | -0.121271 | 0.000000 | 0.000000 | 0.000000 | 0.000000 | 0.000000 | 0.000000 |
| 0.144000 | -0.000054 | 0.044981 | 0.126420 | 1.000000 | 0.000000 | 0.000000 | 0.000000 | 0.000000 | 0.000000 |
| 0.058000 | 0.000005 | 0.000012 | 0.614431 | 0.000000 | 1.000000 | 0.000000 | 0.000000 | 0.000000 | 0.000000 |
| 0.023160 | -0.000004 | 0.000659 | 0.394082 | 0.000000 | 0.000000 | 1.000000 | 0.000000 | 0.000000 | 0.000000 |
| 3.339200 | 0.000000 | 0.000000 | 0.000000 | 0.000000 | 0.000000 | 0.000000 | 1.000000 | 0.000000 | 0.000000 |
| 1.630900 | 0.000000 | 0.000000 | 0.000000 | 0.000000 | 0.000000 | 0.000000 | 0.000000 | 1.000000 | 0.000000 |
| 0.796600 | 0.000000 | 0.000000 | 0.000000 | 0.000000 | 0.000000 | 0.000000 | 0.000000 | 0.000000 | 1.000000 |
Comment: Koput and Peterson, J. Phys. Chem. A 106, 9595 (2002)
| 