MOLPRO Basis Query, element=Zr, basis=seg-cc-pVQZ-PP, l=s
Basis Zr s seg-cc-pVQZ-PP
Primitives | Contractions... |
5675.240000 | 0.000056 | 0.960628 | 0.000000 | 0.000000 | 0.000000 | 0.000000 | 0.000000 |
863.134000 | 0.000406 | 0.752381 | 0.000000 | 0.000000 | 0.000000 | 0.000000 | 0.000000 |
190.340000 | 0.001763 | -1.241004 | 0.000000 | 0.000000 | 0.000000 | 0.000000 | 0.000000 |
26.909000 | 0.061031 | 0.000000 | 0.000000 | 0.000000 | 0.000000 | 0.000000 | 0.000000 |
16.803900 | -0.464129 | 0.000000 | 0.000000 | 0.000000 | 0.000000 | 0.000000 | 0.000000 |
10.495700 | 1.387928 | 0.000000 | 0.000000 | 0.000000 | 0.000000 | 0.000000 | 0.000000 |
3.931680 | 0.000000 | 0.000000 | 0.000000 | 0.000000 | 0.000000 | 0.000000 | 0.000000 |
2.406530 | 0.000000 | 0.000000 | 0.000000 | 0.000000 | 0.000000 | 0.000000 | 0.000000 |
1.056280 | 0.000000 | 0.000000 | 0.000000 | 0.000000 | 0.000000 | 0.000000 | 0.000000 |
0.571027 | 0.000000 | 0.000000 | 1.000000 | 0.000000 | 0.000000 | 0.000000 | 0.000000 |
0.295858 | 0.000000 | 0.000000 | 0.000000 | 1.000000 | 0.000000 | 0.000000 | 0.000000 |
0.104325 | 0.000000 | 0.000000 | 0.000000 | 0.000000 | 1.000000 | 0.000000 | 0.000000 |
0.048563 | 0.000000 | 0.000000 | 0.000000 | 0.000000 | 0.000000 | 1.000000 | 0.000000 |
0.022356 | 0.000000 | 0.000000 | 0.000000 | 0.000000 | 0.000000 | 0.000000 | 1.000000 |
Comment: G. Schoendorf and J. Boatz, J. Chem. Phys. 156, 064102 (2002)