MOLPRO Basis Query, element=Ti, basis=AV5Z, l=p
Basis Ti p AV5Z
Primitives | Contractions... |
59284.900000 | 0.000003 | -0.000001 | 0.000000 | 0.000000 | 0.000001 | -0.000001 | -0.000001 | 0.000000 | 0.000000 |
14323.600000 | 0.000023 | -0.000008 | 0.000002 | 0.000002 | 0.000004 | -0.000007 | -0.000008 | 0.000000 | 0.000000 |
4537.220000 | 0.000144 | -0.000048 | 0.000012 | 0.000014 | 0.000030 | -0.000030 | -0.000051 | 0.000000 | 0.000000 |
1726.540000 | 0.000660 | -0.000221 | 0.000053 | 0.000066 | 0.000126 | -0.000190 | -0.000216 | 0.000000 | 0.000000 |
741.075000 | 0.002509 | -0.000844 | 0.000203 | 0.000252 | 0.000519 | -0.000530 | -0.000898 | 0.000000 | 0.000000 |
343.807000 | 0.008294 | -0.002802 | 0.000670 | 0.000833 | 0.001602 | -0.002395 | -0.002739 | 0.000000 | 0.000000 |
167.884000 | 0.024247 | -0.008278 | 0.001996 | 0.002474 | 0.005091 | -0.005202 | -0.008851 | 0.000000 | 0.000000 |
85.039400 | 0.062231 | -0.021635 | 0.005189 | 0.006443 | 0.012372 | -0.018507 | -0.021388 | 0.000000 | 0.000000 |
44.382900 | 0.134220 | -0.048047 | 0.011640 | 0.014411 | 0.029814 | -0.029119 | -0.052574 | 0.000000 | 0.000000 |
23.792800 | 0.229050 | -0.084665 | 0.020375 | 0.025315 | 0.047759 | -0.077845 | -0.082505 | 0.000000 | 0.000000 |
13.053600 | 0.300398 | -0.116748 | 0.028714 | 0.035478 | 0.078215 | -0.060778 | -0.134434 | 0.000000 | 0.000000 |
7.268720 | 0.272261 | -0.107129 | 0.025726 | 0.032185 | 0.058260 | -0.182675 | -0.182810 | 0.000000 | 0.000000 |
4.038050 | 0.135082 | 0.019088 | -0.006688 | -0.007732 | 0.005128 | 0.116639 | 0.096233 | 0.000000 | 0.000000 |
2.192940 | 0.026029 | 0.246194 | -0.071985 | -0.086916 | -0.239317 | 0.299361 | 1.445569 | 0.000000 | 0.000000 |
1.161620 | -0.000304 | 0.401378 | -0.118415 | -0.142580 | -0.398902 | 1.232089 | -0.503023 | 0.000000 | 0.000000 |
0.603250 | -0.001434 | 0.341565 | -0.130000 | -0.170435 | -0.311374 | -1.894248 | -2.972236 | 0.000000 | 0.000000 |
0.300174 | -0.000654 | 0.126889 | 0.030711 | 0.006736 | 1.250230 | -0.367319 | 4.273043 | 0.000000 | 0.000000 |
0.130264 | -0.000040 | 0.011320 | 0.379143 | 0.596685 | 0.279048 | 2.010770 | -2.830371 | 0.000000 | 0.000000 |
0.057298 | -0.000010 | 0.000674 | 0.527615 | 0.475338 | -0.898887 | -1.186867 | 0.750008 | 0.000000 | 0.000000 |
0.024952 | 0.000001 | 0.000058 | 0.200715 | 0.030096 | -0.068999 | -0.138248 | 0.366863 | 1.000000 | 0.000000 |
0.010870 | 0.000000 | 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)