MOLPRO Basis Query, element=Ti, basis=aug-cc-pVQZ, l=p
Basis Ti p aug-cc-pVQZ
Primitives | Contractions... |
25537.330000 | 0.000012 | -0.000004 | 0.000001 | 0.000001 | 0.000002 | -0.000003 | 0.000000 | 0.000000 |
6042.243000 | 0.000104 | -0.000035 | 0.000008 | 0.000010 | 0.000020 | -0.000028 | 0.000000 | 0.000000 |
1962.653000 | 0.000607 | -0.000203 | 0.000049 | 0.000061 | 0.000126 | -0.000134 | 0.000000 | 0.000000 |
751.733800 | 0.002751 | -0.000925 | 0.000221 | 0.000275 | 0.000526 | -0.000736 | 0.000000 | 0.000000 |
319.883300 | 0.010266 | -0.003470 | 0.000836 | 0.001034 | 0.002151 | -0.002293 | 0.000000 | 0.000000 |
146.430000 | 0.032180 | -0.011020 | 0.002641 | 0.003283 | 0.006257 | -0.008752 | 0.000000 | 0.000000 |
70.748610 | 0.084486 | -0.029577 | 0.007151 | 0.008829 | 0.018455 | -0.019226 | 0.000000 | 0.000000 |
35.590880 | 0.178332 | -0.064574 | 0.015530 | 0.019308 | 0.036247 | -0.052589 | 0.000000 | 0.000000 |
18.368930 | 0.288574 | -0.108458 | 0.026479 | 0.032612 | 0.070920 | -0.065894 | 0.000000 | 0.000000 |
9.658655 | 0.328758 | -0.131910 | 0.031980 | 0.039977 | 0.071827 | -0.148112 | 0.000000 | 0.000000 |
5.136730 | 0.211541 | -0.053089 | 0.012561 | 0.015299 | 0.059201 | -0.024124 | 0.000000 | 0.000000 |
2.698872 | 0.055519 | 0.178125 | -0.052994 | -0.062620 | -0.184272 | 0.176979 | 0.000000 | 0.000000 |
1.389703 | 0.002020 | 0.395701 | -0.113039 | -0.138288 | -0.329653 | 1.158428 | 0.000000 | 0.000000 |
0.703163 | -0.001429 | 0.392728 | -0.143698 | -0.176348 | -0.545764 | -0.963458 | 0.000000 | 0.000000 |
0.344123 | -0.000941 | 0.174477 | -0.010336 | -0.055404 | 1.145431 | -1.324508 | 0.000000 | 0.000000 |
0.141361 | -0.000053 | 0.018946 | 0.354736 | 0.559291 | 0.552625 | 2.291373 | 0.000000 | 0.000000 |
0.060863 | -0.000017 | -0.000328 | 0.548101 | 0.533115 | -0.964260 | -1.112932 | 0.000000 | 0.000000 |
0.025907 | 0.000003 | 0.000376 | 0.225296 | 0.038172 | -0.088240 | -0.215631 | 1.000000 | 0.000000 |
0.011030 | 0.000000 | 0.000000 | 0.000000 | 0.000000 | 0.000000 | 0.000000 | 0.000000 | 1.000000 |
Comment: N.B. Balabanov and K.A. Peterson, J. Chem. Phys. 123, 064107 (2005)