MOLPRO Basis Query, element=Ca, basis=def2-QZVP, l=p
Basis Ca p def2-QZVP
Primitives | Contractions... |
4064.223280 | 0.000198 | 0.000000 |
962.915506 | 0.001731 | 0.000000 |
312.345010 | 0.009530 | 0.000000 |
118.760560 | 0.038387 | 0.000000 |
49.816153 | 0.116793 | 0.000000 |
22.259679 | 0.256372 | 0.000000 |
10.286094 | 0.379862 | 0.000000 |
4.860698 | 0.308058 | 0.000000 |
2.252568 | 0.085756 | 0.000000 |
31.467555 | 0.000000 | -0.004244 |
10.657589 | 0.000000 | -0.019579 |
2.050556 | 0.000000 | 0.212375 |
0.943621 | 0.000000 | 0.462779 |
0.427091 | 0.000000 | 0.391775 |
0.177882 | 0.000000 | 0.000000 |
0.086000 | 0.000000 | 0.000000 |
0.041500 | 0.000000 | 0.000000 |
0.020000 | 0.000000 | 0.000000 |
Comment: F. Weigend, F. Furche, R. Ahlrichs: JCP 119, 12753 (2003)
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