MOLPRO Basis Query, element=I, basis=aug-cc-pV5Z-PP_old, l=p
Basis I p aug-cc-pV5Z-PP_old
Primitives | Contractions... |
560.159000 | 0.000116 | -0.000044 | 0.000000 | 0.000000 | 0.000000 | 0.000000 | 0.000000 | 0.000000 |
129.165000 | 0.000721 | -0.000253 | 0.000000 | 0.000000 | 0.000000 | 0.000000 | 0.000000 | 0.000000 |
31.782600 | -0.003045 | 0.000541 | 0.000000 | 0.000000 | 0.000000 | 0.000000 | 0.000000 | 0.000000 |
19.851600 | 0.062672 | -0.020666 | 0.000000 | 0.000000 | 0.000000 | 0.000000 | 0.000000 | 0.000000 |
11.193300 | -0.219237 | 0.081259 | 0.000000 | 0.000000 | 0.000000 | 0.000000 | 0.000000 | 0.000000 |
6.120870 | -0.097928 | 0.021429 | 0.000000 | 0.000000 | 0.000000 | 0.000000 | 0.000000 | 0.000000 |
3.776590 | 0.375004 | -0.143475 | 0.000000 | 0.000000 | 0.000000 | 0.000000 | 0.000000 | 0.000000 |
2.028180 | 0.542050 | -0.244620 | 0.000000 | 0.000000 | 0.000000 | 0.000000 | 0.000000 | 0.000000 |
1.077970 | 0.270909 | -0.115753 | 1.000000 | 0.000000 | 0.000000 | 0.000000 | 0.000000 | 0.000000 |
0.518204 | 0.035765 | 0.245412 | 0.000000 | 1.000000 | 0.000000 | 0.000000 | 0.000000 | 0.000000 |
0.252270 | 0.000669 | 0.477876 | 0.000000 | 0.000000 | 1.000000 | 0.000000 | 0.000000 | 0.000000 |
0.118330 | 0.001194 | 0.377335 | 0.000000 | 0.000000 | 0.000000 | 1.000000 | 0.000000 | 0.000000 |
0.053691 | 0.000009 | 0.097073 | 0.000000 | 0.000000 | 0.000000 | 0.000000 | 1.000000 | 0.000000 |
0.022900 | 0.000000 | 0.000000 | 0.000000 | 0.000000 | 0.000000 | 0.000000 | 0.000000 | 1.000000 |
Comment: aug-cc-pV5Z (17s14p14d4f3g2h)/[8s8p6d4f3g2h] basis set for ECP28oldMDF by K.A. Peterson et al, Ref 36.