MOLPRO Basis Query, element=I, basis=DZVP-DFT-orb, l=s
Basis I s DZVP-DFT-orb
Primitives | Contractions... |
274845.460000 | -0.001621 | 0.000000 | 0.000000 | 0.000000 | 0.000000 | 0.000000 |
41233.188000 | -0.012398 | 0.000000 | 0.000000 | 0.000000 | 0.000000 | 0.000000 |
9366.733300 | -0.062201 | 0.000000 | 0.000000 | 0.000000 | 0.000000 | 0.000000 |
2638.408100 | -0.216294 | 0.000000 | 0.000000 | 0.000000 | 0.000000 | 0.000000 |
858.774400 | -0.462395 | 0.000000 | 0.000000 | 0.000000 | 0.000000 | 0.000000 |
296.302520 | -0.384842 | 0.000000 | 0.000000 | 0.000000 | 0.000000 | 0.000000 |
561.837220 | 0.000000 | 0.114228 | 0.000000 | 0.000000 | 0.000000 | 0.000000 |
69.040146 | 0.000000 | -0.632291 | 0.000000 | 0.000000 | 0.000000 | 0.000000 |
29.980635 | 0.000000 | -0.442018 | 0.000000 | 0.000000 | 0.000000 | 0.000000 |
54.869684 | 0.000000 | 0.000000 | -0.270799 | 0.000000 | 0.000000 | 0.000000 |
9.995458 | 0.000000 | 0.000000 | 0.842647 | 0.000000 | 0.000000 | 0.000000 |
4.588868 | 0.000000 | 0.000000 | 0.309166 | 0.000000 | 0.000000 | 0.000000 |
9.120826 | 0.000000 | 0.000000 | 0.000000 | -0.341022 | 0.000000 | 0.000000 |
2.119679 | 0.000000 | 0.000000 | 0.000000 | 0.810065 | 0.000000 | 0.000000 |
0.970893 | 0.000000 | 0.000000 | 0.000000 | 0.396754 | 0.000000 | 0.000000 |
1.587997 | 0.000000 | 0.000000 | 0.000000 | 0.000000 | 0.262971 | 0.000000 |
0.295336 | 0.000000 | 0.000000 | 0.000000 | 0.000000 | -0.751041 | 0.000000 |
0.116402 | 0.000000 | 0.000000 | 0.000000 | 0.000000 | 0.000000 | 1.000000 |
Comment: DZVP (DFT Orbital)