MOLPRO Basis Query, element=No, basis=cc-pwCVDZ-DK3, l=p
Basis No p cc-pwCVDZ-DK3
| Primitives | Contractions... |
|---|
| 32522823.000000 | 0.000050 | -0.000064 | 0.000002 | -0.000010 | 0.000004 | -0.000001 | -0.000003 | 0.000000 | 0.000000 |
| 7563967.800000 | 0.000094 | -0.000122 | 0.000004 | -0.000018 | 0.000008 | -0.000002 | -0.000007 | 0.000000 | 0.000000 |
| 2023481.900000 | 0.000256 | -0.000332 | 0.000012 | -0.000049 | 0.000022 | -0.000004 | -0.000018 | 0.000000 | 0.000000 |
| 595535.700000 | 0.000597 | -0.000775 | 0.000029 | -0.000116 | 0.000051 | -0.000010 | -0.000042 | 0.000000 | 0.000000 |
| 188841.320000 | 0.001470 | -0.001916 | 0.000073 | -0.000287 | 0.000125 | -0.000026 | -0.000104 | 0.000000 | 0.000000 |
| 63815.270000 | 0.003640 | -0.004769 | 0.000188 | -0.000717 | 0.000313 | -0.000064 | -0.000259 | 0.000000 | 0.000000 |
| 22888.077000 | 0.009310 | -0.012303 | 0.000510 | -0.001861 | 0.000813 | -0.000166 | -0.000675 | 0.000000 | 0.000000 |
| 8717.035000 | 0.024028 | -0.032167 | 0.001412 | -0.004919 | 0.002149 | -0.000437 | -0.001771 | 0.000000 | 0.000000 |
| 3529.862300 | 0.060310 | -0.082517 | 0.004053 | -0.012809 | 0.005599 | -0.001140 | -0.004662 | 0.000000 | 0.000000 |
| 1516.332100 | 0.134937 | -0.190860 | 0.010599 | -0.030425 | 0.013283 | -0.002700 | -0.010908 | 0.000000 | 0.000000 |
| 685.477740 | 0.234460 | -0.345711 | 0.022701 | -0.056637 | 0.024765 | -0.005049 | -0.020784 | 0.000000 | 0.000000 |
| 323.229070 | 0.260746 | -0.341592 | 0.010723 | -0.050285 | 0.021885 | -0.004428 | -0.017316 | 0.000000 | 0.000000 |
| 157.215810 | 0.213190 | 0.123838 | -0.121146 | 0.087640 | -0.038252 | 0.007753 | 0.029949 | 0.000000 | 0.000000 |
| 79.354219 | 0.235171 | 0.650927 | -0.355631 | 0.290226 | -0.128344 | 0.026392 | 0.113019 | 0.000000 | 0.000000 |
| 40.743695 | 0.139210 | 0.362308 | -0.053396 | 0.060368 | -0.022859 | 0.004224 | 0.005242 | 0.000000 | 0.000000 |
| 20.448832 | 0.013076 | -0.154009 | 0.668163 | -0.637902 | 0.305001 | -0.062664 | -0.241840 | 0.000000 | 0.000000 |
| 10.644818 | -0.002565 | -0.143387 | 0.479310 | -0.357979 | 0.165348 | -0.035318 | -0.178315 | 0.000000 | 0.000000 |
| 5.072294 | -0.000273 | -0.010189 | 0.048949 | 0.747627 | -0.536640 | 0.120135 | 0.618886 | 0.000000 | 0.000000 |
| 2.442858 | 0.000305 | 0.004080 | -0.004146 | 0.525566 | -0.283419 | 0.057631 | 0.097916 | 0.000000 | 0.000000 |
| 0.913622 | -0.000023 | 0.000225 | 0.000303 | 0.060940 | 0.600002 | -0.156167 | -1.062710 | 0.000000 | 0.000000 |
| 0.367082 | 0.000019 | 0.000075 | -0.000153 | 0.011764 | 0.573612 | -0.222073 | 0.424054 | 0.000000 | 0.000000 |
| 0.098604 | -0.000005 | -0.000004 | 0.000055 | 0.002753 | 0.064750 | 0.311013 | 0.771820 | 0.000000 | 0.000000 |
| 0.032216 | 0.000002 | 0.000002 | -0.000018 | -0.000588 | -0.008530 | 0.808000 | 0.030799 | 1.000000 | 0.000000 |
| 5.999243 | 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)