MOLPRO Basis Query, element=Br, basis=cc-pwCVTZ, l=s
Basis Br s cc-pwCVTZ
Primitives | Contractions... |
10639000.000000 | 0.000006 | -0.000002 | 0.000001 | -0.000000 | 0.000000 | 0.000000 | 0.000000 | 0.000000 |
1593400.000000 | 0.000046 | -0.000015 | 0.000006 | -0.000002 | 0.000000 | 0.000000 | 0.000000 | 0.000000 |
362610.000000 | 0.000242 | -0.000076 | 0.000030 | -0.000009 | 0.000000 | 0.000000 | 0.000000 | 0.000000 |
102700.000000 | 0.001023 | -0.000321 | 0.000128 | -0.000039 | 0.000000 | 0.000000 | 0.000000 | 0.000000 |
33501.000000 | 0.003711 | -0.001171 | 0.000466 | -0.000143 | 0.000000 | 0.000000 | 0.000000 | 0.000000 |
12093.000000 | 0.011978 | -0.003797 | 0.001510 | -0.000463 | 0.000000 | 0.000000 | 0.000000 | 0.000000 |
4715.900000 | 0.034693 | -0.011231 | 0.004485 | -0.001375 | 0.000000 | 0.000000 | 0.000000 | 0.000000 |
1955.600000 | 0.089124 | -0.029928 | 0.011983 | -0.003678 | 0.000000 | 0.000000 | 0.000000 | 0.000000 |
852.610000 | 0.193456 | -0.071271 | 0.028957 | -0.008898 | 0.000000 | 0.000000 | 0.000000 | 0.000000 |
387.670000 | 0.320902 | -0.140314 | 0.058157 | -0.017953 | 0.000000 | 0.000000 | 0.000000 | 0.000000 |
182.680000 | 0.329923 | -0.203076 | 0.088813 | -0.027573 | 0.000000 | 0.000000 | 0.000000 | 0.000000 |
88.245000 | 0.149412 | -0.096099 | 0.044524 | -0.014095 | 0.000000 | 0.000000 | 0.000000 | 0.000000 |
39.263000 | 0.014994 | 0.355809 | -0.206039 | 0.067256 | 0.000000 | 0.000000 | 0.000000 | 0.000000 |
19.234000 | -0.000916 | 0.592179 | -0.512702 | 0.176693 | 0.000000 | 0.000000 | 0.000000 | 0.000000 |
9.405700 | 0.000438 | 0.221598 | -0.150935 | 0.052886 | 0.000000 | 0.000000 | 0.000000 | 0.000000 |
4.160100 | -0.000240 | 0.013765 | 0.678920 | -0.307596 | 0.000000 | 0.000000 | 0.000000 | 0.000000 |
1.899500 | 0.000074 | 0.000839 | 0.581770 | -0.470066 | 0.000000 | 0.000000 | 0.000000 | 0.000000 |
0.604720 | -0.000037 | -0.000045 | 0.046755 | 0.255876 | 1.000000 | 0.000000 | 0.000000 | 0.000000 |
0.301140 | 0.000024 | -0.000008 | -0.011182 | 0.698034 | 0.000000 | 0.000000 | 0.000000 | 0.000000 |
0.125150 | -0.000006 | -0.000012 | 0.002440 | 0.296726 | 0.000000 | 1.000000 | 0.000000 | 0.000000 |
3.001500 | 0.000000 | 0.000000 | 0.000000 | 0.000000 | 0.000000 | 0.000000 | 1.000000 | 0.000000 |
4.793200 | 0.000000 | 0.000000 | 0.000000 | 0.000000 | 0.000000 | 0.000000 | 0.000000 | 1.000000 |
Comment: N.J. DeYonker, K.A. Peterson, A.K. Wilson, JPC A 111, 11383 (2007)