MOLPRO Basis Query, element=U, basis=cc-pwCVQZ-X2C, l=f
Basis U f cc-pwCVQZ-X2C
Primitives | Contractions... |
2019.266700 | 0.000196 | -0.000058 | 0.000059 | 0.000074 | 0.000084 | 0.000123 | 0.000000 | 0.000000 | 0.000000 | 0.000000 |
675.476730 | 0.001823 | -0.000540 | 0.000556 | 0.000619 | 0.000418 | 0.000623 | 0.000000 | 0.000000 | 0.000000 | 0.000000 |
285.711630 | 0.010566 | -0.003156 | 0.003198 | 0.003911 | 0.004080 | 0.005961 | 0.000000 | 0.000000 | 0.000000 | 0.000000 |
136.473290 | 0.041858 | -0.012478 | 0.012825 | 0.014466 | 0.010573 | 0.015638 | 0.000000 | 0.000000 | 0.000000 | 0.000000 |
69.434275 | 0.118088 | -0.035487 | 0.036006 | 0.043904 | 0.045331 | 0.065680 | 0.000000 | 0.000000 | 0.000000 | 0.000000 |
36.844657 | 0.238846 | -0.070361 | 0.072236 | 0.080432 | 0.054613 | 0.079677 | 0.000000 | 0.000000 | 0.000000 | 0.000000 |
19.848049 | 0.334380 | -0.091802 | 0.089752 | 0.114347 | 0.139592 | 0.191219 | 0.000000 | 0.000000 | 0.000000 | 0.000000 |
10.781526 | 0.314577 | -0.061951 | 0.058720 | 0.043951 | -0.047928 | -0.097620 | 0.000000 | 0.000000 | 0.000000 | 0.000000 |
5.837710 | 0.176471 | 0.058140 | -0.088572 | -0.089410 | 0.055231 | 0.008366 | 0.000000 | 0.000000 | 0.000000 | 0.000000 |
3.103433 | 0.048205 | 0.221003 | -0.234625 | -0.420539 | -0.806745 | -1.357970 | 0.000000 | 0.000000 | 0.000000 | 0.000000 |
1.605261 | 0.004081 | 0.333390 | -0.366452 | -0.365180 | 0.459474 | 2.404400 | 0.000000 | 0.000000 | 0.000000 | 0.000000 |
0.800453 | 0.000276 | 0.331253 | -0.025264 | 0.904313 | 1.000500 | -1.680810 | 0.000000 | 0.000000 | 0.000000 | 0.000000 |
0.380854 | -0.000024 | 0.240572 | 0.435866 | 0.193787 | -1.396360 | 0.182902 | 0.000000 | 0.000000 | 0.000000 | 0.000000 |
0.169622 | 0.000036 | 0.119992 | 0.429221 | -0.550061 | 0.340460 | 0.822743 | 0.000000 | 0.000000 | 0.000000 | 0.000000 |
0.067422 | -0.000004 | 0.028774 | 0.165068 | -0.269492 | 0.539031 | -0.815356 | 1.000000 | 0.000000 | 0.000000 | 0.000000 |
13.289700 | 0.000000 | 0.000000 | 0.000000 | 0.000000 | 0.000000 | 0.000000 | 0.000000 | 1.000000 | 0.000000 | 0.000000 |
7.397300 | 0.000000 | 0.000000 | 0.000000 | 0.000000 | 0.000000 | 0.000000 | 0.000000 | 0.000000 | 1.000000 | 0.000000 |
4.117400 | 0.000000 | 0.000000 | 0.000000 | 0.000000 | 0.000000 | 0.000000 | 0.000000 | 0.000000 | 0.000000 | 1.000000 |
Comment: R. Feng and K.A. Peterson, J. Chem. Phys. 147, 084108 (2017)
|