MOLPRO Basis Query, element=Ir, basis=seg-cc-pVDZ-PP, l=s
Basis Ir s seg-cc-pVDZ-PP
Primitives | Contractions... |
36.057700 | 0.028454 | 0.000000 | 0.000000 | 0.000000 | 0.000000 |
22.551600 | -0.222912 | 0.000000 | 0.000000 | 0.000000 | 0.000000 |
14.111600 | 0.554809 | 0.000000 | 0.000000 | 0.000000 | 0.000000 |
5.044750 | -1.306345 | 0.000000 | 0.000000 | 0.000000 | 0.000000 |
1.244170 | 0.000000 | 1.000000 | 0.000000 | 0.000000 | 0.000000 |
0.576924 | 0.000000 | 0.000000 | 1.000000 | 0.000000 | 0.000000 |
0.139466 | 0.000000 | 0.000000 | 0.000000 | 1.000000 | 0.000000 |
0.049740 | 0.000000 | 0.000000 | 0.000000 | 0.000000 | 1.000000 |
Comment: G. Schoendorf and J. Boatz, J. Chem. Phys. 156, 064102 (2002)