MOLPRO Basis Query, element=U, basis=cc-pwCVQZ-DK3, l=f
Basis U f cc-pwCVQZ-DK3
Primitives | Contractions... |
2019.266700 | 0.000198 | -0.000059 | 0.000060 | 0.000074 | 0.000085 | 0.000124 | 0.000000 | 0.000000 | 0.000000 | 0.000000 |
675.476730 | 0.001826 | -0.000541 | 0.000558 | 0.000619 | 0.000420 | 0.000624 | 0.000000 | 0.000000 | 0.000000 | 0.000000 |
285.711630 | 0.010569 | -0.003154 | 0.003204 | 0.003909 | 0.004085 | 0.005958 | 0.000000 | 0.000000 | 0.000000 | 0.000000 |
136.473290 | 0.041858 | -0.012471 | 0.012847 | 0.014451 | 0.010585 | 0.015631 | 0.000000 | 0.000000 | 0.000000 | 0.000000 |
69.434275 | 0.118086 | -0.035465 | 0.036065 | 0.043875 | 0.045389 | 0.065631 | 0.000000 | 0.000000 | 0.000000 | 0.000000 |
36.844657 | 0.238845 | -0.070319 | 0.072356 | 0.080348 | 0.054672 | 0.079647 | 0.000000 | 0.000000 | 0.000000 | 0.000000 |
19.848049 | 0.334380 | -0.091747 | 0.089894 | 0.114306 | 0.139753 | 0.191086 | 0.000000 | 0.000000 | 0.000000 | 0.000000 |
10.781526 | 0.314578 | -0.061915 | 0.058815 | 0.043833 | -0.048073 | -0.097462 | 0.000000 | 0.000000 | 0.000000 | 0.000000 |
5.837710 | 0.176471 | 0.058104 | -0.088767 | -0.089162 | 0.055223 | 0.008232 | 0.000000 | 0.000000 | 0.000000 | 0.000000 |
3.103433 | 0.048204 | 0.220866 | -0.234985 | -0.420817 | -0.807762 | -1.357880 | 0.000000 | 0.000000 | 0.000000 | 0.000000 |
1.605261 | 0.004081 | 0.333147 | -0.367079 | -0.364597 | 0.461928 | 2.405830 | 0.000000 | 0.000000 | 0.000000 | 0.000000 |
0.800453 | 0.000276 | 0.331105 | -0.024810 | 0.905857 | 0.998348 | -1.684510 | 0.000000 | 0.000000 | 0.000000 | 0.000000 |
0.380854 | -0.000024 | 0.240833 | 0.436877 | 0.191786 | -1.397400 | 0.187366 | 0.000000 | 0.000000 | 0.000000 | 0.000000 |
0.169622 | 0.000036 | 0.120516 | 0.428470 | -0.550991 | 0.343649 | 0.820126 | 0.000000 | 0.000000 | 0.000000 | 0.000000 |
0.067422 | -0.000004 | 0.028991 | 0.163986 | -0.268517 | 0.537793 | -0.815420 | 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)