MOLPRO Basis Query, element=Hf, basis=augccpwCVTZ-DK3, l=d
Basis Hf d augccpwCVTZ-DK3
Primitives | Contractions... |
33377.420000 | 0.000028 | -0.000014 | 0.000003 | -0.000003 | 0.000004 | 0.000000 | 0.000000 | 0.000000 | 0.000000 |
9004.266000 | 0.000180 | -0.000090 | 0.000018 | -0.000020 | 0.000025 | 0.000000 | 0.000000 | 0.000000 | 0.000000 |
3049.558000 | 0.001035 | -0.000517 | 0.000103 | -0.000113 | 0.000147 | 0.000000 | 0.000000 | 0.000000 | 0.000000 |
1228.148000 | 0.004789 | -0.002395 | 0.000479 | -0.000526 | 0.000662 | 0.000000 | 0.000000 | 0.000000 | 0.000000 |
562.129700 | 0.017898 | -0.009039 | 0.001809 | -0.001984 | 0.002582 | 0.000000 | 0.000000 | 0.000000 | 0.000000 |
281.733600 | 0.052895 | -0.026930 | 0.005400 | -0.005933 | 0.007456 | 0.000000 | 0.000000 | 0.000000 | 0.000000 |
150.030200 | 0.126615 | -0.065803 | 0.013226 | -0.014516 | 0.018992 | 0.000000 | 0.000000 | 0.000000 | 0.000000 |
82.877580 | 0.234486 | -0.121470 | 0.024424 | -0.026847 | 0.033440 | 0.000000 | 0.000000 | 0.000000 | 0.000000 |
46.605270 | 0.325525 | -0.162926 | 0.032546 | -0.035636 | 0.047480 | 0.000000 | 0.000000 | 0.000000 | 0.000000 |
26.291490 | 0.292584 | -0.093103 | 0.016301 | -0.017584 | 0.017621 | 0.000000 | 0.000000 | 0.000000 | 0.000000 |
14.710360 | 0.135626 | 0.155150 | -0.040808 | 0.046326 | -0.055956 | 0.000000 | 0.000000 | 0.000000 | 0.000000 |
8.088891 | 0.028133 | 0.394664 | -0.094402 | 0.105104 | -0.149162 | 0.000000 | 0.000000 | 0.000000 | 0.000000 |
4.337181 | 0.003869 | 0.396747 | -0.092082 | 0.101051 | -0.108413 | 0.000000 | 0.000000 | 0.000000 | 0.000000 |
2.250717 | 0.001366 | 0.185148 | 0.013876 | -0.026779 | 0.030388 | 0.000000 | 0.000000 | 0.000000 | 0.000000 |
1.090234 | 0.000184 | 0.031697 | 0.194979 | -0.258818 | 0.536193 | 0.000000 | 0.000000 | 0.000000 | 0.000000 |
0.499375 | 0.000033 | 0.000996 | 0.347610 | -0.461268 | 0.368130 | 0.000000 | 0.000000 | 0.000000 | 0.000000 |
0.218006 | -0.000007 | 0.000376 | 0.384623 | -0.033675 | -1.074661 | 0.000000 | 0.000000 | 0.000000 | 0.000000 |
0.091044 | 0.000003 | -0.000097 | 0.265767 | 0.631032 | 0.077965 | 0.000000 | 0.000000 | 0.000000 | 0.000000 |
0.035728 | -0.000001 | 0.000037 | 0.064673 | 0.328258 | 0.701087 | 1.000000 | 0.000000 | 0.000000 | 0.000000 |
2.273800 | 0.000000 | 0.000000 | 0.000000 | 0.000000 | 0.000000 | 0.000000 | 1.000000 | 0.000000 | 0.000000 |
0.532700 | 0.000000 | 0.000000 | 0.000000 | 0.000000 | 0.000000 | 0.000000 | 0.000000 | 1.000000 | 0.000000 |
0.014000 | 0.000000 | 0.000000 | 0.000000 | 0.000000 | 0.000000 | 0.000000 | 0.000000 | 0.000000 | 1.000000 |
Comment: basis set from gbasis database