MOLPRO Basis Query, element=Gd, basis=cc-pwCVQZ-DK3, l=f
Basis Gd f cc-pwCVQZ-DK3
Primitives | Contractions... |
568.799800 | 0.000233 | -0.000236 | 0.000262 | -0.000408 | -0.000520 | 0.000000 | 0.000000 | 0.000000 | 0.000000 |
195.613700 | 0.002128 | -0.002213 | 0.002511 | -0.002873 | -0.003040 | 0.000000 | 0.000000 | 0.000000 | 0.000000 |
84.208710 | 0.011289 | -0.011577 | 0.012968 | -0.018930 | -0.023529 | 0.000000 | 0.000000 | 0.000000 | 0.000000 |
40.745210 | 0.038121 | -0.039742 | 0.045007 | -0.052075 | -0.057811 | 0.000000 | 0.000000 | 0.000000 | 0.000000 |
20.914980 | 0.094905 | -0.097861 | 0.110756 | -0.167247 | -0.207514 | 0.000000 | 0.000000 | 0.000000 | 0.000000 |
11.155410 | 0.182275 | -0.188713 | 0.206184 | -0.222849 | -0.218629 | 1.000000 | 0.000000 | 0.000000 | 0.000000 |
5.963908 | 0.263882 | -0.230698 | 0.179784 | -0.253531 | -0.199278 | 0.000000 | 0.000000 | 0.000000 | 0.000000 |
3.124400 | 0.300102 | -0.171621 | 0.028031 | 0.528033 | 1.313470 | 0.000000 | 0.000000 | 0.000000 | 0.000000 |
1.583183 | 0.264100 | 0.146496 | -0.597016 | 0.600649 | -0.990512 | 0.000000 | 0.000000 | 0.000000 | 0.000000 |
0.765105 | 0.176728 | 0.435032 | -0.232290 | -0.943151 | -0.409627 | 0.000000 | 0.000000 | 0.000000 | 0.000000 |
0.347670 | 0.079751 | 0.353315 | 0.491245 | -0.086575 | 1.175760 | 0.000000 | 0.000000 | 0.000000 | 0.000000 |
0.147138 | 0.016918 | 0.153260 | 0.419409 | 0.601698 | -0.690347 | 0.000000 | 0.000000 | 0.000000 | 0.000000 |
0.053545 | 0.000741 | 0.015078 | 0.061836 | 0.131989 | -0.250927 | 0.000000 | 1.000000 | 0.000000 | 0.000000 |
6.535968 | 0.000000 | 0.000000 | 0.000000 | 0.000000 | 0.000000 | 0.000000 | 0.000000 | 1.000000 | 0.000000 |
3.653029 | 0.000000 | 0.000000 | 0.000000 | 0.000000 | 0.000000 | 0.000000 | 0.000000 | 0.000000 | 1.000000 |
Comment: Q. Lu and K.A. Peterson, J. Chem. Phys. 145, 054111 (2016)
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