MOLPRO Basis Query, element=Nb, basis=ANO-RCC, l=p
Basis Nb p ANO-RCC
Primitives | Contractions... |
399867.073000 | 0.000036 | -0.000016 | 0.000006 | -0.000002 | 0.000006 | -0.000006 | 0.000010 | -0.000013 | 0.000024 |
59010.249400 | 0.000171 | -0.000074 | 0.000026 | -0.000009 | 0.000027 | -0.000028 | 0.000041 | -0.000060 | 0.000144 |
13374.654500 | 0.000761 | -0.000330 | 0.000117 | -0.000042 | 0.000122 | -0.000135 | 0.000232 | -0.000267 | 0.000345 |
3948.342850 | 0.003231 | -0.001404 | 0.000501 | -0.000179 | 0.000510 | -0.000496 | 0.000667 | -0.001136 | 0.003426 |
1395.162440 | 0.012737 | -0.005590 | 0.001993 | -0.000717 | 0.002087 | -0.002390 | 0.004308 | -0.004593 | 0.004051 |
556.689395 | 0.044166 | -0.019683 | 0.007058 | -0.002525 | 0.007168 | -0.006798 | 0.008636 | -0.016195 | 0.054406 |
241.938170 | 0.125633 | -0.058022 | 0.020844 | -0.007515 | 0.022024 | -0.025923 | 0.048533 | -0.049969 | 0.035514 |
111.670396 | 0.268796 | -0.130135 | 0.047364 | -0.016953 | 0.047956 | -0.043114 | 0.047565 | -0.113000 | 0.454516 |
53.703482 | 0.380463 | -0.196446 | 0.071860 | -0.026094 | 0.077915 | -0.102912 | 0.220477 | -0.169261 | -0.267002 |
26.497073 | 0.278837 | -0.092882 | 0.030134 | -0.010098 | 0.022180 | 0.028360 | -0.201192 | 0.038719 | 0.976059 |
12.880721 | 0.072909 | 0.275607 | -0.133042 | 0.049198 | -0.148447 | 0.080778 | 0.121626 | 0.523212 | -4.430318 |
6.283478 | 0.002715 | 0.537546 | -0.276712 | 0.105620 | -0.325227 | 0.567069 | -1.608445 | 0.945451 | 7.188770 |
3.081540 | 0.001125 | 0.300446 | -0.142468 | 0.050632 | -0.119182 | -0.391793 | 2.666297 | -3.391890 | -6.312025 |
1.360582 | -0.000349 | 0.034073 | 0.495161 | -0.252391 | 1.251882 | -1.145894 | -1.324968 | 4.192525 | 3.790742 |
0.544233 | 0.000134 | -0.000852 | 0.596957 | -0.283094 | -0.521919 | 1.854941 | -0.792396 | -3.900846 | -2.166801 |
0.217693 | -0.000077 | 0.000670 | 0.102109 | 0.217385 | -0.877833 | -0.798483 | 2.242871 | 3.331218 | 1.336730 |
0.087077 | 0.000035 | -0.000278 | 0.009034 | 0.632199 | 0.293644 | -0.915206 | -2.394505 | -2.288374 | -0.742674 |
0.034831 | -0.000011 | 0.000084 | -0.002034 | 0.326619 | 0.515480 | 1.117195 | 1.240277 | 0.935894 | 0.266164 |
Comment: niobium (21s,18p,13d,6f,4g,2h) -> [10s,9p,8d,5f,4g,2h] converted by Basis Set Exchange