MOLPRO Basis Query, element=Sm, basis=cc-pwCVTZ-X2C, l=s
Basis Sm s cc-pwCVTZ-X2C
| Primitives | Contractions... |
|---|
| 70028000.000000 | 0.000335 | -0.000172 | 0.000099 | -0.000023 | 0.000012 | -0.000007 | -0.000011 | 0.000015 | 0.000019 | 0.000000 | 0.000000 | 0.000000 |
| 18466450.000000 | 0.000288 | -0.000148 | 0.000085 | -0.000020 | 0.000010 | -0.000006 | -0.000009 | 0.000013 | 0.000017 | 0.000000 | 0.000000 | 0.000000 |
| 6208803.000000 | 0.000851 | -0.000437 | 0.000251 | -0.000059 | 0.000031 | -0.000017 | -0.000028 | 0.000038 | 0.000049 | 0.000000 | 0.000000 | 0.000000 |
| 2297529.000000 | 0.001168 | -0.000600 | 0.000345 | -0.000081 | 0.000043 | -0.000023 | -0.000039 | 0.000053 | 0.000068 | 0.000000 | 0.000000 | 0.000000 |
| 915314.700000 | 0.002401 | -0.001236 | 0.000711 | -0.000167 | 0.000088 | -0.000048 | -0.000079 | 0.000108 | 0.000138 | 0.000000 | 0.000000 | 0.000000 |
| 381655.200000 | 0.003911 | -0.002019 | 0.001164 | -0.000273 | 0.000144 | -0.000078 | -0.000130 | 0.000178 | 0.000233 | 0.000000 | 0.000000 | 0.000000 |
| 165555.300000 | 0.007308 | -0.003786 | 0.002187 | -0.000514 | 0.000271 | -0.000147 | -0.000244 | 0.000333 | 0.000420 | 0.000000 | 0.000000 | 0.000000 |
| 74198.400000 | 0.012790 | -0.006665 | 0.003866 | -0.000910 | 0.000479 | -0.000260 | -0.000435 | 0.000593 | 0.000790 | 0.000000 | 0.000000 | 0.000000 |
| 34266.590000 | 0.023551 | -0.012381 | 0.007221 | -0.001702 | 0.000896 | -0.000486 | -0.000805 | 0.001099 | 0.001354 | 0.000000 | 0.000000 | 0.000000 |
| 16260.400000 | 0.042362 | -0.022577 | 0.013282 | -0.003142 | 0.001655 | -0.000898 | -0.001506 | 0.002054 | 0.002818 | 0.000000 | 0.000000 | 0.000000 |
| 7912.114000 | 0.076082 | -0.041476 | 0.024749 | -0.005880 | 0.003092 | -0.001676 | -0.002766 | 0.003778 | 0.004461 | 0.000000 | 0.000000 | 0.000000 |
| 3939.601000 | 0.129311 | -0.073260 | 0.044735 | -0.010727 | 0.005644 | -0.003066 | -0.005170 | 0.007051 | 0.010128 | 0.000000 | 0.000000 | 0.000000 |
| 2003.503000 | 0.199200 | -0.120965 | 0.076890 | -0.018679 | 0.009802 | -0.005310 | -0.008701 | 0.011898 | 0.012944 | 0.000000 | 0.000000 | 0.000000 |
| 1038.855000 | 0.249167 | -0.170417 | 0.115344 | -0.028749 | 0.015096 | -0.008214 | -0.014033 | 0.019139 | 0.030385 | 0.000000 | 0.000000 | 0.000000 |
| 548.076600 | 0.214458 | -0.172899 | 0.126925 | -0.032573 | 0.016995 | -0.009173 | -0.014562 | 0.020010 | 0.013397 | 0.000000 | 0.000000 | 0.000000 |
| 293.254000 | 0.104925 | -0.047672 | 0.023864 | -0.005352 | 0.002939 | -0.001707 | -0.004383 | 0.005713 | 0.033917 | 0.000000 | 0.000000 | 0.000000 |
| 156.205400 | 0.058616 | 0.213736 | -0.287231 | 0.094541 | -0.049128 | 0.026957 | 0.048621 | -0.066544 | -0.144529 | 0.000000 | 0.000000 | 0.000000 |
| 85.374450 | 0.069376 | 0.349885 | -0.622673 | 0.234450 | -0.120344 | 0.065024 | 0.103402 | -0.144872 | -0.074710 | 0.000000 | 0.000000 | 0.000000 |
| 46.849260 | 0.040913 | 0.202495 | -0.431931 | 0.185765 | -0.097691 | 0.054415 | 0.105196 | -0.143727 | -0.417669 | 0.000000 | 0.000000 | 0.000000 |
| 24.804110 | 0.024304 | 0.158944 | 0.391077 | -0.296916 | 0.159184 | -0.090021 | -0.181859 | 0.252780 | 0.819359 | 0.000000 | 0.000000 | 0.000000 |
| 14.133790 | 0.027323 | 0.194835 | 0.744537 | -0.803564 | 0.444094 | -0.244874 | -0.416170 | 0.671032 | 0.227195 | 0.000000 | 0.000000 | 0.000000 |
| 7.862377 | 0.010116 | 0.071920 | 0.265523 | -0.191311 | 0.099204 | -0.060262 | -0.148172 | 0.094484 | 1.216870 | 0.000000 | 0.000000 | 0.000000 |
| 4.139846 | 0.000218 | 0.000588 | -0.025805 | 0.782615 | -0.566929 | 0.345590 | 0.942409 | -1.762090 | -5.929260 | 0.000000 | 0.000000 | 0.000000 |
| 2.189944 | -0.000249 | -0.002485 | -0.031850 | 0.560097 | -0.636612 | 0.397586 | 0.620602 | -0.326834 | 6.221970 | 0.000000 | 0.000000 | 0.000000 |
| 0.993552 | -0.000054 | -0.000480 | -0.004169 | 0.083501 | 0.211120 | -0.148094 | -1.455360 | 4.327340 | -0.214291 | 0.000000 | 0.000000 | 0.000000 |
| 0.518820 | -0.000003 | -0.000059 | -0.001505 | 0.059490 | 0.668558 | -0.595134 | -0.963607 | -3.523390 | -5.291100 | 0.000000 | 0.000000 | 0.000000 |
| 0.251264 | -0.000009 | -0.000087 | -0.000809 | 0.026898 | 0.240245 | -0.365339 | 1.563330 | -0.303568 | 5.023660 | 0.000000 | 0.000000 | 0.000000 |
| 0.064753 | 0.000000 | 0.000000 | -0.000100 | 0.005847 | 0.158328 | 0.484871 | 1.034840 | 2.665260 | -2.997480 | 0.000000 | 0.000000 | 0.000000 |
| 0.033686 | -0.000002 | -0.000017 | -0.000117 | 0.005539 | 0.149061 | 0.503478 | -1.158630 | -1.744990 | 1.229950 | 0.000000 | 0.000000 | 0.000000 |
| 0.016692 | 0.000000 | -0.000001 | -0.000032 | 0.001876 | 0.052832 | 0.170889 | -0.194920 | -0.238741 | 0.394496 | 1.000000 | 0.000000 | 0.000000 |
| 10.083970 | 0.000000 | 0.000000 | 0.000000 | 0.000000 | 0.000000 | 0.000000 | 0.000000 | 0.000000 | 0.000000 | 0.000000 | 1.000000 | 0.000000 |
| 6.350805 | 0.000000 | 0.000000 | 0.000000 | 0.000000 | 0.000000 | 0.000000 | 0.000000 | 0.000000 | 0.000000 | 0.000000 | 0.000000 | 1.000000 |
Comment: Q. Lu and K.A. Peterson, J. Chem. Phys. 145, 054111 (2016)
| 