MOLPRO Basis Query, element=Pm, basis=cc-pwCVQZ-DK3, l=d
Basis Pm d cc-pwCVQZ-DK3
Primitives | Contractions... |
30863.710000 | 0.000014 | -0.000006 | 0.000002 | -0.000003 | 0.000003 | 0.000002 | -0.000005 | 0.000000 | 0.000000 | 0.000000 |
7659.255000 | 0.000099 | -0.000045 | 0.000012 | -0.000018 | 0.000025 | 0.000038 | -0.000031 | 0.000000 | 0.000000 | 0.000000 |
2645.791000 | 0.000554 | -0.000253 | 0.000066 | -0.000104 | 0.000106 | 0.000082 | -0.000192 | 0.000000 | 0.000000 | 0.000000 |
1087.119000 | 0.002613 | -0.001195 | 0.000312 | -0.000485 | 0.000656 | 0.000996 | -0.000815 | 0.000000 | 0.000000 | 0.000000 |
498.683800 | 0.010428 | -0.004796 | 0.001254 | -0.001978 | 0.002056 | 0.001718 | -0.003574 | 0.000000 | 0.000000 | 0.000000 |
246.534000 | 0.034220 | -0.015858 | 0.004148 | -0.006449 | 0.008610 | 0.012787 | -0.010938 | 0.000000 | 0.000000 | 0.000000 |
128.193800 | 0.091342 | -0.042995 | 0.011276 | -0.017732 | 0.018385 | 0.015356 | -0.031942 | 0.000000 | 0.000000 | 0.000000 |
69.226000 | 0.191058 | -0.090921 | 0.023858 | -0.037095 | 0.051077 | 0.079232 | -0.064125 | 0.000000 | 0.000000 | 0.000000 |
38.230350 | 0.298288 | -0.138995 | 0.036428 | -0.058364 | 0.055205 | 0.027724 | -0.106347 | 0.000000 | 0.000000 | 0.000000 |
21.445720 | 0.325115 | -0.134261 | 0.034450 | -0.054275 | 0.101777 | 0.217260 | -0.137344 | 0.000000 | 0.000000 | 0.000000 |
12.113730 | 0.205134 | 0.021297 | -0.011393 | 0.012651 | -0.079009 | -0.268237 | 0.039297 | 1.000000 | 0.000000 | 0.000000 |
6.789844 | 0.060765 | 0.277902 | -0.086677 | 0.148759 | -0.106455 | 0.078496 | 0.694276 | 0.000000 | 1.000000 | 0.000000 |
3.735401 | 0.003548 | 0.418658 | -0.129249 | 0.203885 | -0.491202 | -1.263990 | 0.681160 | 0.000000 | 0.000000 | 0.000000 |
2.022622 | -0.002136 | 0.308553 | -0.074520 | 0.248352 | 0.061072 | 1.938920 | -3.494080 | 0.000000 | 0.000000 | 0.000000 |
1.055424 | -0.000853 | 0.107120 | 0.116176 | -0.637237 | 1.414040 | -0.168740 | 4.258180 | 0.000000 | 0.000000 | 0.000000 |
0.505052 | -0.000085 | 0.012567 | 0.338948 | -0.573669 | -0.975320 | -1.743780 | -2.926530 | 0.000000 | 0.000000 | 0.000000 |
0.230595 | 0.000001 | 0.000378 | 0.422340 | 0.384415 | -0.609160 | 1.893610 | 1.116160 | 0.000000 | 0.000000 | 0.000000 |
0.100830 | 0.000005 | 0.000130 | 0.288963 | 0.489286 | 0.701900 | -0.638358 | 0.328403 | 0.000000 | 0.000000 | 0.000000 |
0.041650 | 0.000001 | -0.000005 | 0.073203 | 0.124094 | 0.209157 | -0.363524 | -0.671625 | 0.000000 | 0.000000 | 1.000000 |
Comment: Q. Lu and K.A. Peterson, J. Chem. Phys. 145, 054111 (2016)
|