MOLPRO Basis Query, element=Mo, basis=ANO-RCC, l=s
Basis Mo s ANO-RCC
Primitives | Contractions... |
21141179.100000 | 0.000201 | -0.000067 | 0.000028 | -0.000011 | 0.000003 | -0.000004 | 0.000012 | -0.000013 | 0.000017 | -0.000037 |
2848943.470000 | 0.000619 | -0.000206 | 0.000087 | -0.000034 | 0.000009 | -0.000011 | 0.000036 | -0.000040 | 0.000054 | -0.000116 |
565375.230000 | 0.001783 | -0.000595 | 0.000251 | -0.000099 | 0.000025 | -0.000031 | 0.000106 | -0.000117 | 0.000155 | -0.000323 |
139756.777000 | 0.004674 | -0.001567 | 0.000663 | -0.000260 | 0.000066 | -0.000082 | 0.000275 | -0.000302 | 0.000413 | -0.000915 |
40366.317400 | 0.011885 | -0.004014 | 0.001700 | -0.000668 | 0.000170 | -0.000212 | 0.000723 | -0.000807 | 0.001034 | -0.002031 |
13103.517200 | 0.029990 | -0.010312 | 0.004376 | -0.001713 | 0.000435 | -0.000542 | 0.001783 | -0.001938 | 0.002782 | -0.006677 |
4656.699770 | 0.074897 | -0.026524 | 0.011311 | -0.004454 | 0.001133 | -0.001419 | 0.004938 | -0.005590 | 0.006743 | -0.011585 |
1775.008360 | 0.174124 | -0.066281 | 0.028526 | -0.011172 | 0.002840 | -0.003529 | 0.011319 | -0.012097 | 0.018783 | -0.050370 |
713.705909 | 0.327553 | -0.144103 | 0.063440 | -0.025201 | 0.006418 | -0.008069 | 0.029041 | -0.033684 | 0.037075 | -0.048902 |
299.377481 | 0.377134 | -0.226466 | 0.104351 | -0.041109 | 0.010459 | -0.012918 | 0.038356 | -0.038794 | 0.077201 | -0.266327 |
128.919738 | 0.161328 | -0.083260 | 0.040791 | -0.017726 | 0.004571 | -0.006124 | 0.035058 | -0.049348 | -0.002632 | 0.290826 |
54.958573 | 0.006087 | 0.485988 | -0.328616 | 0.144350 | -0.037315 | 0.048150 | -0.208887 | 0.276893 | -0.211015 | -0.129191 |
24.848290 | 0.002685 | 0.578776 | -0.588134 | 0.262178 | -0.068009 | 0.083254 | -0.188072 | 0.140519 | -0.669844 | 3.320242 |
11.351230 | -0.001863 | 0.103889 | 0.180212 | -0.077291 | 0.019819 | -0.022454 | -0.109332 | 0.207593 | 1.012545 | -8.947428 |
5.163845 | 0.001079 | 0.006675 | 0.885216 | -0.762076 | 0.219685 | -0.297102 | 1.653048 | -2.623387 | 1.738854 | 11.321585 |
2.302652 | -0.000594 | -0.002283 | 0.251810 | -0.193698 | 0.054017 | -0.041656 | -1.234977 | 4.047653 | -5.274417 | -9.002976 |
0.932688 | 0.000288 | 0.001175 | -0.004423 | 1.002552 | -0.407678 | 0.653845 | -1.544729 | -2.228783 | 6.685005 | 5.557455 |
0.346789 | -0.000150 | -0.000731 | 0.004830 | 0.370024 | -0.306483 | 0.050980 | 2.526867 | -1.253748 | -6.966641 | -3.562215 |
0.138716 | 0.000087 | 0.000424 | -0.002363 | -0.037440 | 0.350812 | -0.637570 | -0.336082 | 4.014806 | 6.290051 | 2.388377 |
0.055486 | -0.000041 | -0.000205 | 0.001087 | 0.017749 | 0.594147 | -1.141012 | -1.524319 | -3.938687 | -4.017045 | -1.264605 |
0.022195 | 0.000012 | 0.000059 | -0.000321 | -0.005213 | 0.324420 | 1.643254 | 1.012288 | 1.634498 | 1.374671 | 0.390760 |
Comment: molybdenum (21s,18p,13d,6f,4g,2h) -> [10s,9p,9d,6f,4g,2h] converted by Basis Set Exchange