MOLPRO Basis Query, element=Cu, basis=WCV5Z-PP, l=d
Basis Cu d WCV5Z-PP
Primitives | Contractions... |
573.295000 | 0.000112 | -0.000141 | 0.000167 | -0.000235 | -0.000387 | 0.000000 | 0.000000 | 0.000000 |
173.771000 | 0.001178 | -0.001491 | 0.001814 | -0.002771 | -0.002948 | 0.000000 | 0.000000 | 0.000000 |
68.386800 | 0.008099 | -0.010298 | 0.012410 | -0.018145 | -0.027143 | 0.000000 | 0.000000 | 0.000000 |
31.975900 | 0.032069 | -0.041032 | 0.050382 | -0.077377 | -0.090368 | 0.000000 | 0.000000 | 0.000000 |
15.441800 | 0.084304 | -0.111092 | 0.140914 | -0.227286 | -0.405258 | 0.000000 | 0.000000 | 0.000000 |
7.784970 | 0.167902 | -0.224984 | 0.299203 | -0.505980 | -0.472184 | 0.000000 | 0.000000 | 0.000000 |
3.974590 | 0.245275 | -0.284756 | 0.237931 | 0.189781 | 1.407892 | 0.000000 | 0.000000 | 0.000000 |
2.011830 | 0.276679 | -0.138466 | -0.280774 | 0.963839 | -0.198209 | 0.000000 | 0.000000 | 0.000000 |
0.996673 | 0.255087 | 0.178106 | -0.567559 | -0.284036 | -1.414459 | 0.000000 | 0.000000 | 0.000000 |
0.478383 | 0.193724 | 0.388227 | -0.079742 | -0.847792 | 1.173243 | 0.000000 | 0.000000 | 0.000000 |
0.219149 | 0.108839 | 0.342110 | 0.536441 | 0.336220 | 0.188655 | 0.000000 | 0.000000 | 0.000000 |
0.092612 | 0.029078 | 0.121498 | 0.330140 | 0.455023 | -0.661563 | 1.000000 | 0.000000 | 0.000000 |
9.471100 | 0.000000 | 0.000000 | 0.000000 | 0.000000 | 0.000000 | 0.000000 | 1.000000 | 0.000000 |
5.940500 | 0.000000 | 0.000000 | 0.000000 | 0.000000 | 0.000000 | 0.000000 | 0.000000 | 1.000000 |
Comment: basis set of Peterson and Puzzarini, Ref 39, for PP of Ref 37.