MOLPRO Basis Query, element=Sm, basis=cc-pwCVDZ-DK3, l=s
Basis Sm s cc-pwCVDZ-DK3
Primitives | Contractions... |
58530070.000000 | 0.000308 | -0.000168 | 0.000092 | -0.000021 | 0.000011 | -0.000006 | 0.000011 | 0.000000 | 0.000000 |
13135360.000000 | 0.000484 | -0.000264 | 0.000144 | -0.000033 | 0.000018 | -0.000009 | 0.000017 | 0.000000 | 0.000000 |
3661042.000000 | 0.001262 | -0.000688 | 0.000376 | -0.000086 | 0.000046 | -0.000024 | 0.000043 | 0.000000 | 0.000000 |
1128646.000000 | 0.002546 | -0.001391 | 0.000762 | -0.000174 | 0.000093 | -0.000049 | 0.000088 | 0.000000 | 0.000000 |
378548.100000 | 0.005367 | -0.002940 | 0.001614 | -0.000368 | 0.000196 | -0.000104 | 0.000186 | 0.000000 | 0.000000 |
135789.800000 | 0.010731 | -0.005910 | 0.003259 | -0.000744 | 0.000397 | -0.000210 | 0.000380 | 0.000000 | 0.000000 |
51661.460000 | 0.021532 | -0.011953 | 0.006626 | -0.001517 | 0.000808 | -0.000429 | 0.000762 | 0.000000 | 0.000000 |
20689.740000 | 0.042640 | -0.024028 | 0.013479 | -0.003092 | 0.001648 | -0.000874 | 0.001590 | 0.000000 | 0.000000 |
8671.098000 | 0.083531 | -0.048206 | 0.027453 | -0.006351 | 0.003379 | -0.001792 | 0.003149 | 0.000000 | 0.000000 |
3782.888000 | 0.154668 | -0.093558 | 0.055133 | -0.012835 | 0.006837 | -0.003627 | 0.006704 | 0.000000 | 0.000000 |
1710.037000 | 0.247765 | -0.163095 | 0.101039 | -0.024119 | 0.012781 | -0.006780 | 0.011634 | 0.000000 | 0.000000 |
797.642900 | 0.283265 | -0.220060 | 0.150547 | -0.036768 | 0.019544 | -0.010368 | 0.020033 | 0.000000 | 0.000000 |
380.833500 | 0.176454 | -0.142176 | 0.099158 | -0.025587 | 0.013346 | -0.007087 | 0.009421 | 0.000000 | 0.000000 |
173.997400 | 0.078935 | 0.182677 | -0.245873 | 0.079605 | -0.040972 | 0.021794 | -0.030711 | 0.000000 | 0.000000 |
87.234260 | 0.086735 | 0.392486 | -0.710891 | 0.257586 | -0.134438 | 0.071505 | -0.151490 | 0.000000 | 0.000000 |
44.360350 | 0.050128 | 0.212355 | -0.401647 | 0.178370 | -0.091200 | 0.048911 | -0.048594 | 0.000000 | 0.000000 |
20.871940 | 0.037697 | 0.220707 | 0.697960 | -0.601112 | 0.317824 | -0.172493 | 0.244646 | 0.000000 | 0.000000 |
10.800170 | 0.029534 | 0.173195 | 0.664338 | -0.727729 | 0.414754 | -0.226851 | 0.613968 | 0.000000 | 0.000000 |
4.640278 | 0.002603 | 0.015539 | 0.023853 | 0.702419 | -0.523509 | 0.301304 | -1.142510 | 1.000000 | 0.000000 |
2.260313 | -0.000836 | -0.006246 | -0.052048 | 0.715882 | -0.691892 | 0.426379 | -0.292094 | 0.000000 | 0.000000 |
0.665983 | 0.000011 | 0.000117 | -0.003148 | 0.101047 | 0.679990 | -0.537993 | 2.582580 | 0.000000 | 0.000000 |
0.298409 | -0.000037 | -0.000304 | -0.001536 | 0.031152 | 0.441737 | -0.506513 | -2.068070 | 0.000000 | 0.000000 |
0.050569 | 0.000004 | 0.000034 | -0.000118 | 0.008846 | 0.238918 | 0.782221 | -0.606717 | 0.000000 | 0.000000 |
0.021312 | -0.000003 | -0.000029 | -0.000082 | 0.001404 | 0.093808 | 0.347483 | 1.026090 | 0.000000 | 1.000000 |
Comment: Q. Lu and K.A. Peterson, J. Chem. Phys. 145, 054111 (2016)
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