MOLPRO Basis Query, element=U, basis=cc-pVQZ-X2C, l=d
Basis U d cc-pVQZ-X2C
| Primitives | Contractions... |
|---|
| 533180.910000 | 0.000002 | -0.000001 | 0.000000 | -0.000000 | -0.000000 | -0.000000 | -0.000000 | -0.000000 | 0.000000 |
| 123237.630000 | 0.000012 | -0.000004 | 0.000003 | -0.000001 | -0.000001 | -0.000002 | -0.000002 | -0.000002 | 0.000000 |
| 38642.364000 | 0.000059 | -0.000021 | 0.000013 | -0.000004 | -0.000007 | -0.000007 | -0.000007 | -0.000012 | 0.000000 |
| 14357.187000 | 0.000250 | -0.000090 | 0.000056 | -0.000016 | -0.000028 | -0.000036 | -0.000044 | -0.000032 | 0.000000 |
| 6012.793600 | 0.000968 | -0.000350 | 0.000219 | -0.000061 | -0.000108 | -0.000115 | -0.000109 | -0.000192 | 0.000000 |
| 2754.366700 | 0.003481 | -0.001262 | 0.000791 | -0.000219 | -0.000392 | -0.000505 | -0.000617 | -0.000444 | 0.000000 |
| 1351.967900 | 0.011489 | -0.004205 | 0.002630 | -0.000728 | -0.001296 | -0.001395 | -0.001334 | -0.002266 | 0.000000 |
| 699.798050 | 0.033795 | -0.012491 | 0.007804 | -0.002161 | -0.003874 | -0.004957 | -0.006030 | -0.004488 | 0.000000 |
| 377.011410 | 0.086365 | -0.032598 | 0.020302 | -0.005627 | -0.010004 | -0.010757 | -0.010289 | -0.017436 | 0.000000 |
| 209.739410 | 0.182218 | -0.069793 | 0.043393 | -0.012025 | -0.021584 | -0.028046 | -0.034729 | -0.024296 | 0.000000 |
| 119.301910 | 0.297272 | -0.112252 | 0.069920 | -0.019383 | -0.034447 | -0.034992 | -0.030079 | -0.067024 | 0.000000 |
| 69.111714 | 0.342251 | -0.110625 | 0.069961 | -0.019268 | -0.035096 | -0.054492 | -0.079991 | -0.023255 | 0.000000 |
| 40.432415 | 0.226317 | 0.028089 | -0.013610 | 0.004488 | 0.008963 | 0.035032 | 0.075876 | -0.051682 | 0.000000 |
| 23.654239 | 0.042406 | 0.271885 | -0.154999 | 0.044730 | 0.078639 | 0.049782 | -0.008397 | 0.254529 | 0.000000 |
| 13.806399 | -0.057288 | 0.424110 | -0.250772 | 0.072275 | 0.137026 | 0.258250 | 0.435692 | 0.068225 | 0.000000 |
| 8.072398 | -0.050544 | 0.307105 | -0.119244 | 0.030264 | 0.049752 | -0.091855 | -0.355853 | 0.362380 | 0.000000 |
| 4.684482 | -0.016897 | 0.101048 | 0.224342 | -0.080724 | -0.153226 | 0.024519 | 0.362452 | -1.070550 | 0.000000 |
| 2.656077 | -0.001637 | 0.010216 | 0.457682 | -0.164686 | -0.329984 | -0.948706 | -2.129790 | -0.817693 | 0.000000 |
| 1.476407 | 0.000219 | -0.001102 | 0.360190 | -0.114390 | -0.303991 | 0.390642 | 3.118000 | 4.027150 | 0.000000 |
| 0.788980 | 0.000120 | -0.000565 | 0.131879 | 0.098580 | 0.749389 | 1.470880 | -1.184500 | -4.968690 | 0.000000 |
| 0.386455 | 0.000014 | -0.000088 | 0.016506 | 0.339279 | 0.554874 | -1.281190 | -1.279290 | 3.619080 | 0.000000 |
| 0.182040 | 0.000002 | -0.000003 | 0.000351 | 0.421408 | -0.404001 | -0.386554 | 1.927530 | -1.582880 | 0.000000 |
| 0.082602 | -0.000000 | -0.000002 | 0.000102 | 0.293333 | -0.459363 | 0.675865 | -0.780894 | -0.207642 | 0.000000 |
| 0.035690 | 0.000000 | -0.000000 | -0.000047 | 0.080970 | -0.116585 | 0.168859 | -0.316249 | 0.721608 | 1.000000 |
Comment: R. Feng and K.A. Peterson, J. Chem. Phys. 147, 084108 (2017)
| 