MOLPRO Basis Query, element=Ti, basis=ANO-RCC, l=p
Basis Ti p ANO-RCC
Primitives | Contractions... |
5181.157000 | 0.000316 | -0.000109 | 0.000038 | -0.000128 | 0.000112 | -0.000130 | 0.000251 | -0.000372 | 0.000341 |
1227.461000 | 0.001940 | -0.000667 | 0.000239 | -0.000826 | 0.000712 | -0.000789 | 0.001034 | -0.000797 | 0.002017 |
398.271200 | 0.009770 | -0.003387 | 0.001188 | -0.003966 | 0.003493 | -0.004112 | 0.008547 | -0.013705 | 0.011578 |
151.586700 | 0.038104 | -0.013352 | 0.004799 | -0.016765 | 0.014656 | -0.016268 | 0.020885 | -0.015436 | 0.045045 |
63.696330 | 0.115232 | -0.041612 | 0.014635 | -0.049387 | 0.044958 | -0.053840 | 0.119192 | -0.206336 | 0.190474 |
28.547330 | 0.254296 | -0.095072 | 0.034815 | -0.126694 | 0.117208 | -0.130989 | 0.153430 | -0.053295 | 0.303635 |
13.261290 | 0.379701 | -0.151193 | 0.052096 | -0.157298 | 0.125304 | -0.153924 | 0.452916 | -0.941605 | 0.398646 |
6.310352 | 0.308345 | -0.112533 | 0.046548 | -0.201576 | 0.122803 | -0.062695 | -0.678974 | 2.710375 | -3.066962 |
2.951875 | 0.086965 | 0.165323 | -0.092520 | 0.630692 | -0.981080 | 1.192823 | -1.202537 | -2.531712 | 5.366659 |
1.365370 | 0.002878 | 0.473335 | -0.208469 | 0.735808 | 0.427496 | -1.066595 | 2.894382 | 0.485738 | -5.922917 |
0.611415 | 0.001281 | 0.422897 | -0.160001 | -0.938770 | 0.926428 | -0.343778 | -2.445876 | 1.628104 | 5.061238 |
0.252548 | -0.000418 | 0.101655 | 0.172559 | -0.568085 | -1.034657 | 1.034161 | 0.603957 | -2.832491 | -3.846700 |
0.101019 | 0.000221 | -0.002298 | 0.717158 | 0.494108 | 0.018428 | -0.139485 | 1.197829 | 3.067569 | 2.800185 |
0.040408 | -0.000106 | 0.002511 | 0.243602 | 0.230717 | -0.001190 | -1.247245 | -1.757248 | -2.283651 | -1.692794 |
0.016163 | 0.000033 | -0.000749 | -0.003947 | 0.020229 | 0.803467 | 1.325987 | 0.822727 | 0.833026 | 0.573796 |
Comment: titanium (21s,15p,10d,6f,4g,2h) -> [10s,9p,8d,6f,4g,2h] converted by Basis Set Exchange