MOLPRO Basis Query, element=Cm, basis=cc-pwCVTZ-X2C, l=p
Basis Cm p cc-pwCVTZ-X2C
Primitives | Contractions... |
55192929.000000 | 0.000016 | -0.000020 | 0.000001 | -0.000003 | 0.000001 | -0.000000 | -0.000001 | -0.000001 | -0.000002 | 0.000000 | 0.000000 | 0.000000 |
16836105.000000 | 0.000019 | -0.000023 | 0.000001 | -0.000003 | 0.000002 | -0.000000 | -0.000001 | -0.000002 | -0.000003 | 0.000000 | 0.000000 | 0.000000 |
5482867.500000 | 0.000062 | -0.000077 | 0.000004 | -0.000011 | 0.000005 | -0.000001 | -0.000004 | -0.000006 | -0.000008 | 0.000000 | 0.000000 | 0.000000 |
1904051.300000 | 0.000120 | -0.000149 | 0.000008 | -0.000021 | 0.000010 | -0.000002 | -0.000007 | -0.000011 | -0.000016 | 0.000000 | 0.000000 | 0.000000 |
695769.230000 | 0.000282 | -0.000352 | 0.000020 | -0.000051 | 0.000023 | -0.000005 | -0.000017 | -0.000026 | -0.000038 | 0.000000 | 0.000000 | 0.000000 |
265546.730000 | 0.000610 | -0.000762 | 0.000044 | -0.000110 | 0.000049 | -0.000011 | -0.000037 | -0.000056 | -0.000082 | 0.000000 | 0.000000 | 0.000000 |
105364.280000 | 0.001388 | -0.001739 | 0.000101 | -0.000252 | 0.000112 | -0.000026 | -0.000085 | -0.000128 | -0.000191 | 0.000000 | 0.000000 | 0.000000 |
43376.019000 | 0.003152 | -0.003964 | 0.000234 | -0.000576 | 0.000257 | -0.000058 | -0.000194 | -0.000292 | -0.000426 | 0.000000 | 0.000000 | 0.000000 |
18528.539000 | 0.007351 | -0.009304 | 0.000562 | -0.001357 | 0.000607 | -0.000138 | -0.000458 | -0.000692 | -0.001040 | 0.000000 | 0.000000 | 0.000000 |
8224.678600 | 0.017184 | -0.021963 | 0.001374 | -0.003229 | 0.001442 | -0.000327 | -0.001088 | -0.001636 | -0.002371 | 0.000000 | 0.000000 | 0.000000 |
3798.336000 | 0.039551 | -0.051354 | 0.003383 | -0.007638 | 0.003413 | -0.000774 | -0.002575 | -0.003897 | -0.005913 | 0.000000 | 0.000000 | 0.000000 |
1823.846500 | 0.084943 | -0.113059 | 0.008057 | -0.017141 | 0.007654 | -0.001737 | -0.005773 | -0.008673 | -0.012442 | 0.000000 | 0.000000 | 0.000000 |
907.314860 | 0.158281 | -0.218212 | 0.017160 | -0.033915 | 0.015151 | -0.003438 | -0.011438 | -0.017354 | -0.026808 | 0.000000 | 0.000000 | 0.000000 |
465.420450 | 0.227226 | -0.323131 | 0.027638 | -0.051455 | 0.022960 | -0.005210 | -0.017317 | -0.025883 | -0.035548 | 0.000000 | 0.000000 | 0.000000 |
245.762760 | 0.221980 | -0.257316 | 0.007395 | -0.032834 | 0.014695 | -0.003333 | -0.011103 | -0.017325 | -0.032457 | 0.000000 | 0.000000 | 0.000000 |
132.908900 | 0.178826 | 0.114588 | -0.104611 | 0.070920 | -0.031838 | 0.007259 | 0.024332 | 0.038579 | 0.075045 | 0.000000 | 0.000000 | 0.000000 |
73.615612 | 0.195830 | 0.532520 | -0.292928 | 0.229305 | -0.102942 | 0.023452 | 0.078396 | 0.116929 | 0.144162 | 0.000000 | 0.000000 | 0.000000 |
41.300792 | 0.149626 | 0.440386 | -0.194371 | 0.149126 | -0.066418 | 0.015124 | 0.050467 | 0.081859 | 0.189446 | 0.000000 | 0.000000 | 0.000000 |
22.982101 | 0.039342 | 0.017059 | 0.338707 | -0.263779 | 0.127294 | -0.029541 | -0.101964 | -0.177505 | -0.445869 | 0.000000 | 0.000000 | 0.000000 |
12.935727 | -0.001896 | -0.167036 | 0.623740 | -0.594843 | 0.294754 | -0.068303 | -0.230000 | -0.334551 | -0.265990 | 0.000000 | 0.000000 | 0.000000 |
7.244173 | -0.001566 | -0.072598 | 0.268723 | -0.079525 | 0.012551 | -0.002402 | -0.003126 | -0.018354 | -0.369707 | 1.000000 | 0.000000 | 0.000000 |
3.970920 | -0.000042 | -0.003733 | 0.024028 | 0.647336 | -0.445610 | 0.110333 | 0.394454 | 0.777637 | 2.515940 | 0.000000 | 1.000000 | 0.000000 |
2.123372 | 0.000238 | 0.003386 | -0.001950 | 0.503937 | -0.363038 | 0.091338 | 0.369338 | 0.434394 | -1.956440 | 0.000000 | 0.000000 | 0.000000 |
1.051463 | 0.000023 | 0.000587 | -0.000700 | 0.100361 | 0.256658 | -0.082673 | -0.665633 | -1.829410 | -1.595900 | 0.000000 | 0.000000 | 0.000000 |
0.523563 | 0.000013 | 0.000102 | 0.000052 | 0.018758 | 0.597162 | -0.196447 | -0.536105 | 0.363905 | 3.664000 | 0.000000 | 0.000000 | 0.000000 |
0.252110 | -0.000002 | 0.000023 | -0.000033 | 0.012120 | 0.351605 | -0.163964 | 0.371709 | 1.391480 | -2.312680 | 0.000000 | 0.000000 | 0.000000 |
0.103669 | 0.000002 | 0.000008 | 0.000019 | 0.001023 | 0.050871 | 0.187616 | 0.653379 | -0.670200 | -0.055046 | 0.000000 | 0.000000 | 0.000000 |
0.045006 | -0.000001 | -0.000002 | -0.000007 | 0.000149 | -0.001401 | 0.609185 | 0.206175 | -0.483781 | 0.731450 | 0.000000 | 0.000000 | 0.000000 |
0.019035 | 0.000000 | 0.000001 | 0.000002 | -0.000027 | 0.001098 | 0.359024 | 0.004502 | 0.007510 | -0.030194 | 0.000000 | 0.000000 | 1.000000 |
Comment: R. Feng and K.A. Peterson, J. Chem. Phys. 147, 084108 (2017)
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