MOLPRO Basis Query, element=Sc, basis=AV5Z, l=d
Basis Sc d AV5Z
Primitives | Contractions... |
205.606000 | 0.000238 | -0.000243 | -0.000322 | -0.000453 | -0.000524 | 0.000000 | 0.000000 |
61.022700 | 0.002167 | -0.002214 | -0.002876 | -0.003796 | -0.006793 | 0.000000 | 0.000000 |
23.363000 | 0.010849 | -0.011107 | -0.014818 | -0.020773 | -0.026319 | 0.000000 | 0.000000 |
9.963460 | 0.035881 | -0.036970 | -0.048438 | -0.065446 | -0.121932 | 0.000000 | 0.000000 |
4.489450 | 0.093491 | -0.097815 | -0.130758 | -0.194342 | -0.249820 | 0.000000 | 0.000000 |
2.117950 | 0.181076 | -0.184567 | -0.242842 | -0.314714 | -0.618169 | 0.000000 | 0.000000 |
1.012018 | 0.257593 | -0.247279 | -0.284431 | -0.251628 | 0.998918 | 0.000000 | 0.000000 |
0.481045 | 0.291855 | -0.205377 | 0.103726 | 1.085315 | 0.596245 | 0.000000 | 0.000000 |
0.226488 | 0.269006 | 0.103672 | 0.743028 | -0.012918 | -2.138243 | 0.000000 | 0.000000 |
0.105057 | 0.188174 | 0.461898 | 0.095337 | -1.243783 | 1.973082 | 0.000000 | 0.000000 |
0.047682 | 0.073243 | 0.383400 | -0.665117 | 0.772399 | -0.652737 | 0.000000 | 0.000000 |
0.020660 | 0.006441 | 0.066680 | -0.178850 | 0.235334 | -0.231400 | 1.000000 | 0.000000 |
0.008950 | 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)