MOLPRO Basis Query, element=O, basis=ANO-RCC, l=s
Basis O s ANO-RCC
Primitives | Contractions... |
105374.950000 | 0.000124 | -0.000028 | 0.000026 | -0.000051 | 0.000052 | -0.000108 | 0.000283 | -0.000743 |
15679.240000 | 0.000512 | -0.000116 | 0.000107 | -0.000200 | 0.000196 | -0.000524 | 0.001299 | -0.002342 |
3534.544700 | 0.002153 | -0.000491 | 0.000460 | -0.000920 | 0.000993 | -0.001540 | 0.004322 | -0.015916 |
987.365160 | 0.008528 | -0.001946 | 0.001796 | -0.003202 | 0.002977 | -0.009994 | 0.023870 | -0.026545 |
315.978750 | 0.030180 | -0.007005 | 0.006676 | -0.013600 | 0.015641 | -0.017422 | 0.052551 | -0.259142 |
111.654280 | 0.090997 | -0.021678 | 0.020534 | -0.033923 | 0.032319 | -0.125140 | 0.290613 | -0.102830 |
42.699451 | 0.217794 | -0.056412 | 0.058286 | -0.116855 | 0.160123 | -0.059848 | 0.201680 | -2.134798 |
17.395596 | 0.368625 | -0.112705 | 0.121297 | -0.140403 | 0.153869 | -0.783308 | 1.518373 | 6.050819 |
7.438309 | 0.336671 | -0.158912 | 0.226415 | -0.475467 | 0.938863 | 0.919007 | -5.380300 | -7.468505 |
3.222862 | 0.096576 | -0.033551 | -0.042387 | 0.833501 | -3.164427 | 1.503360 | 6.657121 | 5.731313 |
1.253877 | 0.002145 | 0.353190 | -1.010455 | 1.301861 | 2.945454 | -4.171664 | -5.490755 | -3.439188 |
0.495155 | 0.001194 | 0.553420 | -0.153869 | -2.481758 | -0.467243 | 5.188024 | 3.958986 | 1.980947 |
0.191665 | 0.000539 | 0.230184 | 0.993453 | 0.811347 | -1.595038 | -4.103870 | -2.262986 | -0.922072 |
0.067083 | 0.000210 | 0.011273 | 0.185873 | 0.582104 | 1.344035 | 1.751984 | 0.796377 | 0.260771 |
Comment: oxygen (14s,9p,4d,3f,2g) -> [8s,7p,4d,3f,2g] converted by Basis Set Exchange