MOLPRO Basis Query, element=Cr, basis=aug-cc-pwCV5Z, l=d
Basis Cr d aug-cc-pwCV5Z
Primitives | Contractions... |
384.324000 | 0.000166 | -0.000187 | -0.000270 | -0.000398 | 0.000453 | 0.000000 | 0.000000 | 0.000000 | 0.000000 |
115.621000 | 0.001533 | -0.001736 | -0.002491 | -0.003488 | 0.004853 | 0.000000 | 0.000000 | 0.000000 | 0.000000 |
44.847800 | 0.008273 | -0.009425 | -0.013690 | -0.020248 | 0.024155 | 0.000000 | 0.000000 | 0.000000 | 0.000000 |
19.612900 | 0.029628 | -0.033969 | -0.049752 | -0.071954 | 0.105467 | 0.000000 | 0.000000 | 0.000000 | 0.000000 |
9.100830 | 0.080432 | -0.094962 | -0.144596 | -0.236258 | 0.323814 | 0.000000 | 0.000000 | 0.000000 | 0.000000 |
4.418320 | 0.168255 | -0.197213 | -0.292208 | -0.409404 | 0.454221 | 0.000000 | 0.000000 | 0.000000 | 0.000000 |
2.182870 | 0.257347 | -0.263968 | -0.277469 | 0.016740 | -1.009370 | 0.000000 | 0.000000 | 0.000000 | 0.000000 |
1.068400 | 0.301301 | -0.177122 | 0.205770 | 1.007032 | -0.342841 | 0.000000 | 0.000000 | 0.000000 | 0.000000 |
0.510624 | 0.275430 | 0.138805 | 0.686880 | -0.242290 | 1.830297 | 0.000000 | 0.000000 | 0.000000 | 0.000000 |
0.235141 | 0.182077 | 0.452633 | 0.006800 | -1.004623 | -1.631699 | 0.000000 | 0.000000 | 0.000000 | 0.000000 |
0.102836 | 0.067534 | 0.374204 | -0.631493 | 0.690958 | 0.302450 | 0.000000 | 0.000000 | 0.000000 | 0.000000 |
0.041425 | 0.006111 | 0.066200 | -0.157142 | 0.244496 | 0.483827 | 1.000000 | 0.000000 | 0.000000 | 0.000000 |
5.204900 | 0.000000 | 0.000000 | 0.000000 | 0.000000 | 0.000000 | 0.000000 | 1.000000 | 0.000000 | 0.000000 |
3.140900 | 0.000000 | 0.000000 | 0.000000 | 0.000000 | 0.000000 | 0.000000 | 0.000000 | 1.000000 | 0.000000 |
0.016690 | 0.000000 | 0.000000 | 0.000000 | 0.000000 | 0.000000 | 0.000000 | 0.000000 | 0.000000 | 1.000000 |
Comment: basis set from gbasis database