MOLPRO Basis Query, element=Sm, basis=cc-pwCVTZ-X2C, l=d
Basis Sm d cc-pwCVTZ-X2C
Primitives | Contractions... |
10634.740000 | 0.000080 | -0.000036 | 0.000009 | 0.000015 | -0.000015 | -0.000016 | 0.000000 | 0.000000 | 0.000000 |
2769.339000 | 0.000650 | -0.000299 | 0.000077 | 0.000124 | -0.000180 | -0.000240 | 0.000000 | 0.000000 | 0.000000 |
992.710100 | 0.003798 | -0.001746 | 0.000451 | 0.000715 | -0.000729 | -0.000794 | 0.000000 | 0.000000 | 0.000000 |
418.737100 | 0.017069 | -0.007922 | 0.002049 | 0.003278 | -0.004660 | -0.006135 | 0.000000 | 0.000000 | 0.000000 |
194.720500 | 0.058761 | -0.027515 | 0.007125 | 0.011278 | -0.011692 | -0.012916 | 0.000000 | 0.000000 | 0.000000 |
96.414910 | 0.153622 | -0.073477 | 0.019076 | 0.030464 | -0.043995 | -0.058522 | 0.000000 | 0.000000 | 0.000000 |
49.752430 | 0.287686 | -0.136350 | 0.035356 | 0.056306 | -0.053133 | -0.054254 | 0.000000 | 0.000000 | 0.000000 |
26.274590 | 0.363785 | -0.161452 | 0.041539 | 0.068424 | -0.127435 | -0.190151 | 0.000000 | 0.000000 | 0.000000 |
14.079780 | 0.256622 | -0.020663 | 0.000475 | 0.000975 | 0.079777 | 0.151492 | 1.000000 | 0.000000 | 0.000000 |
7.458231 | 0.076966 | 0.288269 | -0.089381 | -0.144280 | 0.064845 | 0.090159 | 0.000000 | 1.000000 | 0.000000 |
3.849903 | 0.003215 | 0.464814 | -0.142052 | -0.256751 | 0.687347 | 1.136860 | 0.000000 | 0.000000 | 0.000000 |
1.936653 | -0.002085 | 0.311502 | -0.059327 | -0.153201 | -0.624330 | -2.390070 | 0.000000 | 0.000000 | 0.000000 |
0.912537 | -0.000662 | 0.076635 | 0.199899 | 0.869714 | -0.906475 | 1.662810 | 0.000000 | 0.000000 | 0.000000 |
0.387734 | 0.000016 | 0.003453 | 0.449377 | 0.203974 | 1.414620 | -0.110378 | 0.000000 | 0.000000 | 0.000000 |
0.153581 | -0.000009 | 0.000539 | 0.432885 | -0.646525 | -0.353743 | -0.927184 | 0.000000 | 0.000000 | 0.000000 |
0.056267 | 0.000007 | -0.000078 | 0.156119 | -0.263902 | -0.489132 | 0.919676 | 0.000000 | 0.000000 | 1.000000 |
Comment: Q. Lu and K.A. Peterson, J. Chem. Phys. 145, 054111 (2016)
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