MOLPRO Basis Query, element=Ti, basis=def2-QZVPP, l=p
Basis Ti p def2-QZVPP
Primitives | Contractions... |
5169.675543 | 0.000188 | 0.000000 |
1225.096164 | 0.001647 | 0.000000 |
397.600519 | 0.009110 | 0.000000 |
151.361547 | 0.036987 | 0.000000 |
63.613322 | 0.113763 | 0.000000 |
28.514560 | 0.253452 | 0.000000 |
13.248003 | 0.380194 | 0.000000 |
6.304881 | 0.309891 | 0.000000 |
2.949353 | 0.087419 | 0.000000 |
40.738772 | 0.000000 | -0.007323 |
14.062358 | 0.000000 | -0.034283 |
2.746068 | 0.000000 | 0.356550 |
1.271369 | 0.000000 | 0.761120 |
0.576100 | 0.000000 | 0.627167 |
0.239818 | 0.000000 | 0.000000 |
0.110000 | 0.000000 | 0.000000 |
0.050000 | 0.000000 | 0.000000 |
0.023000 | 0.000000 | 0.000000 |
Comment: F. Weigend, F. Furche, R. Ahlrichs: JCP 119, 12753 (2003)