MOLPRO Basis Query, element=Cr, basis=aug-cc-pwCV5Z-DK, l=d
Basis Cr d aug-cc-pwCV5Z-DK
Primitives | Contractions... |
408.623000 | 0.000160 | -0.000181 | -0.000261 | -0.000383 | 0.000437 | 0.000000 | 0.000000 | 0.000000 | 0.000000 |
120.761000 | 0.001448 | -0.001643 | -0.002355 | -0.003279 | 0.004589 | 0.000000 | 0.000000 | 0.000000 | 0.000000 |
46.446000 | 0.007823 | -0.008927 | -0.012960 | -0.019090 | 0.022717 | 0.000000 | 0.000000 | 0.000000 | 0.000000 |
20.239000 | 0.028185 | -0.032346 | -0.047265 | -0.067796 | 0.099616 | 0.000000 | 0.000000 | 0.000000 | 0.000000 |
9.363810 | 0.077290 | -0.091250 | -0.138633 | -0.224564 | 0.305845 | 0.000000 | 0.000000 | 0.000000 | 0.000000 |
4.530940 | 0.164114 | -0.192849 | -0.286413 | -0.406011 | 0.477461 | 0.000000 | 0.000000 | 0.000000 | 0.000000 |
2.231400 | 0.254864 | -0.264541 | -0.287513 | -0.027750 | -0.932518 | 0.000000 | 0.000000 | 0.000000 | 0.000000 |
1.087760 | 0.302226 | -0.186740 | 0.181679 | 0.997375 | -0.475300 | 0.000000 | 0.000000 | 0.000000 | 0.000000 |
0.517384 | 0.279228 | 0.126928 | 0.689862 | -0.169764 | 1.874247 | 0.000000 | 0.000000 | 0.000000 | 0.000000 |
0.237164 | 0.187048 | 0.450372 | 0.034368 | -1.039789 | -1.568873 | 0.000000 | 0.000000 | 0.000000 | 0.000000 |
0.103308 | 0.070899 | 0.381895 | -0.633534 | 0.671079 | 0.223873 | 0.000000 | 0.000000 | 0.000000 | 0.000000 |
0.041448 | 0.006636 | 0.070120 | -0.166588 | 0.263959 | 0.516152 | 1.000000 | 0.000000 | 0.000000 | 0.000000 |
5.196700 | 0.000000 | 0.000000 | 0.000000 | 0.000000 | 0.000000 | 0.000000 | 1.000000 | 0.000000 | 0.000000 |
3.119400 | 0.000000 | 0.000000 | 0.000000 | 0.000000 | 0.000000 | 0.000000 | 0.000000 | 1.000000 | 0.000000 |
0.016630 | 0.000000 | 0.000000 | 0.000000 | 0.000000 | 0.000000 | 0.000000 | 0.000000 | 0.000000 | 1.000000 |
Comment: basis set from gbasis database