MOLPRO Basis Query, element=I, basis=V5Z-PP, l=s
Basis I s V5Z-PP
| Primitives | Contractions... |
|---|
| 42976.600000 | 0.000013 | -0.000006 | 0.000000 | 0.000000 | 0.000000 | 0.000000 | 0.000000 |
| 6439.010000 | 0.000097 | -0.000047 | 0.000000 | 0.000000 | 0.000000 | 0.000000 | 0.000000 |
| 1455.780000 | 0.000466 | -0.000223 | 0.000000 | 0.000000 | 0.000000 | 0.000000 | 0.000000 |
| 405.361000 | 0.001441 | -0.000712 | 0.000000 | 0.000000 | 0.000000 | 0.000000 | 0.000000 |
| 116.980000 | 0.002674 | -0.001234 | 0.000000 | 0.000000 | 0.000000 | 0.000000 | 0.000000 |
| 29.632600 | -0.058121 | 0.024121 | 0.000000 | 0.000000 | 0.000000 | 0.000000 | 0.000000 |
| 18.510000 | 0.345759 | -0.155642 | 0.000000 | 0.000000 | 0.000000 | 0.000000 | 0.000000 |
| 11.562000 | -0.362272 | 0.188539 | 0.000000 | 0.000000 | 0.000000 | 0.000000 | 0.000000 |
| 6.595070 | -0.634674 | 0.274227 | 0.000000 | 0.000000 | 0.000000 | 0.000000 | 0.000000 |
| 4.053400 | 0.223667 | -0.124708 | 0.000000 | 0.000000 | 0.000000 | 0.000000 | 0.000000 |
| 2.140900 | 0.783273 | -0.473190 | 0.000000 | 0.000000 | 0.000000 | 0.000000 | 0.000000 |
| 1.181640 | 0.452521 | -0.463116 | 1.000000 | 0.000000 | 0.000000 | 0.000000 | 0.000000 |
| 0.600372 | 0.053048 | 0.099724 | 0.000000 | 1.000000 | 0.000000 | 0.000000 | 0.000000 |
| 0.319965 | -0.000891 | 0.605016 | 0.000000 | 0.000000 | 1.000000 | 0.000000 | 0.000000 |
| 0.158769 | 0.000960 | 0.517668 | 0.000000 | 0.000000 | 0.000000 | 1.000000 | 0.000000 |
| 0.075451 | -0.000025 | 0.107669 | 0.000000 | 0.000000 | 0.000000 | 0.000000 | 1.000000 |
Comment: basis set for ECP28MDF by K.A. Peterson et al, Ref 42.