MOLPRO Basis Query, element=Mn, basis=DZVP-DFT-orb, l=s
Basis Mn s DZVP-DFT-orb
Primitives | Contractions... |
58745.692000 | 0.001684 | 0.000000 | 0.000000 | 0.000000 | 0.000000 |
8803.039300 | 0.012910 | 0.000000 | 0.000000 | 0.000000 | 0.000000 |
1994.933000 | 0.064723 | 0.000000 | 0.000000 | 0.000000 | 0.000000 |
559.353630 | 0.224266 | 0.000000 | 0.000000 | 0.000000 | 0.000000 |
180.122700 | 0.469695 | 0.000000 | 0.000000 | 0.000000 | 0.000000 |
61.262134 | 0.369805 | 0.000000 | 0.000000 | 0.000000 | 0.000000 |
118.528030 | 0.000000 | 0.104277 | 0.000000 | 0.000000 | 0.000000 |
13.504946 | 0.000000 | -0.614000 | 0.000000 | 0.000000 | 0.000000 |
5.443183 | 0.000000 | -0.459897 | 0.000000 | 0.000000 | 0.000000 |
9.856955 | 0.000000 | 0.000000 | 0.217555 | 0.000000 | 0.000000 |
1.555216 | 0.000000 | 0.000000 | -0.710886 | 0.000000 | 0.000000 |
0.604618 | 0.000000 | 0.000000 | -0.418370 | 0.000000 | 0.000000 |
0.862966 | 0.000000 | 0.000000 | 0.000000 | 0.143761 | 0.000000 |
0.116719 | 0.000000 | 0.000000 | 0.000000 | -0.600901 | 0.000000 |
0.042859 | 0.000000 | 0.000000 | 0.000000 | 0.000000 | 1.000000 |
Comment: DZVP (DFT Orbital)