MOLPRO Basis Query, element=Nb, basis=ANO-RCC, l=s
Basis Nb s ANO-RCC
Primitives | Contractions... |
21181099.600000 | 0.000186 | -0.000062 | 0.000026 | -0.000010 | 0.000003 | -0.000003 | 0.000010 | -0.000011 | 0.000018 | -0.000037 |
2841051.920000 | 0.000577 | -0.000191 | 0.000080 | -0.000031 | 0.000008 | -0.000011 | 0.000031 | -0.000034 | 0.000055 | -0.000117 |
562837.435000 | 0.001665 | -0.000553 | 0.000232 | -0.000089 | 0.000023 | -0.000031 | 0.000091 | -0.000100 | 0.000160 | -0.000327 |
139100.473000 | 0.004374 | -0.001460 | 0.000613 | -0.000236 | 0.000062 | -0.000081 | 0.000237 | -0.000258 | 0.000418 | -0.000937 |
40196.907800 | 0.011148 | -0.003749 | 0.001577 | -0.000608 | 0.000159 | -0.000210 | 0.000623 | -0.000697 | 0.001098 | -0.002043 |
13059.784300 | 0.028218 | -0.009646 | 0.004064 | -0.001563 | 0.000409 | -0.000537 | 0.001544 | -0.001649 | 0.002731 | -0.006942 |
4646.387380 | 0.070770 | -0.024903 | 0.010542 | -0.004074 | 0.001068 | -0.001410 | 0.004267 | -0.004886 | 0.007520 | -0.011428 |
1773.884910 | 0.165780 | -0.062426 | 0.026653 | -0.010252 | 0.002683 | -0.003517 | 0.009891 | -0.010234 | 0.017609 | -0.053398 |
714.904870 | 0.317037 | -0.137291 | 0.059893 | -0.023332 | 0.006124 | -0.008114 | 0.025297 | -0.030066 | 0.044878 | -0.046240 |
300.783461 | 0.380714 | -0.222029 | 0.101137 | -0.039139 | 0.010247 | -0.013360 | 0.035242 | -0.032897 | 0.064734 | -0.296322 |
130.155285 | 0.179009 | -0.109444 | 0.053541 | -0.022239 | 0.005918 | -0.008178 | 0.035277 | -0.055487 | 0.057984 | 0.318207 |
55.689410 | 0.010035 | 0.431937 | -0.281451 | 0.120422 | -0.032110 | 0.043714 | -0.164014 | 0.237133 | -0.326691 | -0.284184 |
25.328815 | 0.002441 | 0.607942 | -0.589166 | 0.256525 | -0.068188 | 0.088681 | -0.191658 | 0.103421 | -0.381263 | 3.826655 |
11.610865 | -0.001749 | 0.138030 | 0.058953 | -0.015598 | 0.002985 | -0.002130 | -0.138284 | 0.368985 | 0.005714 | -9.480807 |
5.289498 | 0.001029 | 0.006209 | 0.872230 | -0.673878 | 0.198215 | -0.283364 | 1.323924 | -2.327967 | 3.646667 | 11.388582 |
2.380395 | -0.000571 | -0.001028 | 0.336748 | -0.357075 | 0.107167 | -0.128149 | -0.504667 | 2.632793 | -6.986373 | -8.498370 |
0.942089 | 0.000276 | 0.000643 | -0.003486 | 0.939404 | -0.373266 | 0.681571 | -2.018658 | 0.032914 | 7.490751 | 4.928868 |
0.359309 | -0.000149 | -0.000476 | 0.006799 | 0.477151 | -0.369226 | 0.145173 | 2.171921 | -3.528011 | -6.821962 | -3.032463 |
0.143724 | 0.000085 | 0.000270 | -0.003494 | -0.037746 | 0.259063 | -0.648561 | 0.551189 | 5.517643 | 5.338480 | 1.869110 |
0.057489 | -0.000040 | -0.000130 | 0.001650 | 0.022455 | 0.681239 | -1.230013 | -2.232979 | -4.493639 | -3.078675 | -0.930419 |
0.022996 | 0.000012 | 0.000037 | -0.000483 | -0.005844 | 0.318480 | 1.671378 | 1.278013 | 1.726623 | 0.990673 | 0.276705 |
Comment: niobium (21s,18p,13d,6f,4g,2h) -> [10s,9p,8d,5f,4g,2h] converted by Basis Set Exchange