MOLPRO Basis Query, element=Ac, basis=cc-pwCVTZ-DK3, l=d
Basis Ac d cc-pwCVTZ-DK3
Primitives | Contractions... |
95122.399000 | 0.000022 | -0.000010 | 0.000005 | -0.000001 | -0.000002 | 0.000003 | 0.000003 | 0.000000 | 0.000000 | 0.000000 |
22502.156000 | 0.000138 | -0.000066 | 0.000031 | -0.000008 | -0.000016 | 0.000016 | 0.000013 | 0.000000 | 0.000000 | 0.000000 |
7339.573500 | 0.000702 | -0.000336 | 0.000156 | -0.000039 | -0.000080 | 0.000105 | 0.000117 | 0.000000 | 0.000000 | 0.000000 |
2865.034300 | 0.003115 | -0.001494 | 0.000694 | -0.000173 | -0.000360 | 0.000353 | 0.000284 | 0.000000 | 0.000000 | 0.000000 |
1260.816300 | 0.012091 | -0.005851 | 0.002727 | -0.000677 | -0.001400 | 0.001832 | 0.002023 | 0.000000 | 0.000000 | 0.000000 |
603.127570 | 0.039888 | -0.019474 | 0.009066 | -0.002255 | -0.004698 | 0.004621 | 0.003751 | 0.000000 | 0.000000 | 0.000000 |
305.893670 | 0.108255 | -0.053960 | 0.025223 | -0.006263 | -0.012950 | 0.017080 | 0.018980 | 0.000000 | 0.000000 | 0.000000 |
162.060170 | 0.227181 | -0.114026 | 0.053200 | -0.013246 | -0.027654 | 0.025789 | 0.019387 | 0.000000 | 0.000000 | 0.000000 |
88.292137 | 0.342465 | -0.166816 | 0.077934 | -0.019317 | -0.039904 | 0.060443 | 0.074400 | 0.000000 | 0.000000 | 0.000000 |
49.198813 | 0.321155 | -0.104382 | 0.043695 | -0.010728 | -0.023293 | -0.003145 | -0.031520 | 0.000000 | 0.000000 | 0.000000 |
27.543902 | 0.148547 | 0.158467 | -0.091807 | 0.023943 | 0.051311 | 0.000275 | 0.059569 | 0.000000 | 0.000000 | 0.000000 |
15.223230 | 0.007104 | 0.430631 | -0.236882 | 0.060417 | 0.125294 | -0.265499 | -0.391382 | 0.000000 | 0.000000 | 0.000000 |
8.418263 | -0.022244 | 0.401637 | -0.194119 | 0.049051 | 0.113245 | 0.062180 | 0.254090 | 0.000000 | 0.000000 | 0.000000 |
4.576062 | -0.008486 | 0.148394 | 0.163799 | -0.054275 | -0.137551 | -0.144529 | -0.424429 | 1.000000 | 0.000000 | 0.000000 |
2.415446 | -0.000746 | 0.013404 | 0.489209 | -0.149615 | -0.330870 | 1.112750 | 1.989440 | 0.000000 | 0.000000 | 0.000000 |
1.243256 | 0.000257 | -0.001703 | 0.402966 | -0.121901 | -0.364619 | -0.734541 | -2.936250 | 0.000000 | 0.000000 | 0.000000 |
0.607713 | 0.000071 | -0.000813 | 0.125334 | 0.127514 | 1.004300 | -0.991844 | 1.810190 | 0.000000 | 0.000000 | 0.000000 |
0.252030 | 0.000010 | -0.000031 | 0.008204 | 0.428365 | 0.255598 | 1.519250 | -0.097375 | 0.000000 | 0.000000 | 0.000000 |
0.099430 | -0.000002 | -0.000011 | -0.000112 | 0.474785 | -0.617030 | -0.492440 | -1.014930 | 0.000000 | 0.000000 | 0.000000 |
0.037224 | 0.000001 | 0.000003 | 0.000097 | 0.209130 | -0.231984 | -0.387596 | 1.018420 | 0.000000 | 1.000000 | 0.000000 |
6.131913 | 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)
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