MOLPRO Basis Query, element=Np, basis=cc-pVQZ-DK3, l=d
Basis Np d cc-pVQZ-DK3
| Primitives | Contractions... |
|---|
| 539084.770000 | 0.000003 | -0.000001 | 0.000001 | -0.000000 | -0.000000 | -0.000000 | -0.000000 | -0.000001 | 0.000000 |
| 124643.230000 | 0.000015 | -0.000005 | 0.000003 | -0.000001 | -0.000002 | -0.000002 | -0.000002 | -0.000002 | 0.000000 |
| 38909.275000 | 0.000068 | -0.000024 | 0.000016 | -0.000004 | -0.000008 | -0.000009 | -0.000009 | -0.000015 | 0.000000 |
| 14401.660000 | 0.000279 | -0.000099 | 0.000064 | -0.000018 | -0.000032 | -0.000041 | -0.000047 | -0.000031 | 0.000000 |
| 6010.590400 | 0.001057 | -0.000379 | 0.000243 | -0.000068 | -0.000119 | -0.000132 | -0.000139 | -0.000240 | 0.000000 |
| 2746.210500 | 0.003748 | -0.001348 | 0.000863 | -0.000240 | -0.000428 | -0.000553 | -0.000642 | -0.000416 | 0.000000 |
| 1346.381900 | 0.012242 | -0.004446 | 0.002844 | -0.000792 | -0.001398 | -0.001548 | -0.001629 | -0.002777 | 0.000000 |
| 696.943950 | 0.035689 | -0.013095 | 0.008363 | -0.002328 | -0.004152 | -0.005346 | -0.006208 | -0.004140 | 0.000000 |
| 375.869600 | 0.090289 | -0.033860 | 0.021558 | -0.006008 | -0.010598 | -0.011690 | -0.012280 | -0.021130 | 0.000000 |
| 209.455460 | 0.188005 | -0.071457 | 0.045402 | -0.012648 | -0.022596 | -0.029587 | -0.034742 | -0.020654 | 0.000000 |
| 119.347530 | 0.302232 | -0.113034 | 0.072020 | -0.020075 | -0.035360 | -0.036929 | -0.037255 | -0.083160 | 0.000000 |
| 69.255700 | 0.340797 | -0.106711 | 0.069147 | -0.019113 | -0.034791 | -0.054385 | -0.070727 | 0.003695 | 0.000000 |
| 40.534639 | 0.217839 | 0.039853 | -0.020418 | 0.006483 | 0.012971 | 0.039460 | 0.062847 | -0.097351 | 0.000000 |
| 23.700006 | 0.033415 | 0.285139 | -0.165291 | 0.048050 | 0.083288 | 0.058500 | 0.038650 | 0.371085 | 0.000000 |
| 13.854938 | -0.061233 | 0.425494 | -0.255494 | 0.074033 | 0.141477 | 0.265933 | 0.382803 | -0.109536 | 0.000000 |
| 8.113048 | -0.049962 | 0.294706 | -0.103340 | 0.025196 | 0.034949 | -0.112736 | -0.276164 | 0.663872 | 0.000000 |
| 4.719714 | -0.015846 | 0.091773 | 0.247899 | -0.089655 | -0.161111 | 0.014268 | 0.159323 | -1.750530 | 0.000000 |
| 2.683786 | -0.001392 | 0.008524 | 0.462499 | -0.168628 | -0.352581 | -1.024990 | -1.963070 | 0.234458 | 0.000000 |
| 1.491991 | 0.000193 | -0.001050 | 0.345099 | -0.104481 | -0.248384 | 0.632088 | 3.304020 | 3.099930 | 0.000000 |
| 0.796343 | 0.000109 | -0.000493 | 0.119123 | 0.116308 | 0.781714 | 1.295830 | -1.656900 | -4.590220 | 0.000000 |
| 0.389461 | 0.000008 | -0.000071 | 0.013996 | 0.351274 | 0.496613 | -1.331070 | -0.871079 | 3.736910 | 0.000000 |
| 0.182734 | 0.000002 | -0.000002 | 0.000371 | 0.417934 | -0.427814 | -0.274117 | 1.780880 | -1.920900 | 0.000000 |
| 0.082695 | -0.000001 | -0.000001 | 0.000059 | 0.279250 | -0.442785 | 0.657008 | -0.826626 | 0.088898 | 0.000000 |
| 0.035715 | 0.000000 | -0.000000 | -0.000034 | 0.072301 | -0.105884 | 0.147749 | -0.268168 | 0.608216 | 1.000000 |
Comment: R. Feng and K.A. Peterson, J. Chem. Phys. 147, 084108 (2017)
| 