MOLPRO Basis Query, element=S, basis=ROOS, l=s
Basis S s ROOS
Primitives | Contractions... |
346348.230000 | 0.000064 | -0.000018 | 0.000005 | -0.000004 | 0.000006 | -0.000009 | 0.000016 |
49391.146000 | 0.000449 | -0.000124 | 0.000036 | -0.000027 | 0.000041 | -0.000057 | 0.000094 |
14610.990000 | 0.001471 | -0.000408 | 0.000120 | -0.000088 | 0.000137 | -0.000233 | 0.000419 |
5187.209500 | 0.004984 | -0.001382 | 0.000403 | -0.000307 | 0.000453 | -0.000562 | 0.000863 |
1980.967600 | 0.015252 | -0.004276 | 0.001258 | -0.000915 | 0.001442 | -0.002578 | 0.004724 |
784.631390 | 0.044944 | -0.012816 | 0.003748 | -0.002867 | 0.004210 | -0.005069 | 0.007671 |
317.327790 | 0.120353 | -0.036110 | 0.010695 | -0.007780 | 0.012315 | -0.022315 | 0.041543 |
130.019760 | 0.269083 | -0.089873 | 0.026655 | -0.020539 | 0.030166 | -0.035702 | 0.055018 |
53.738208 | 0.407225 | -0.177289 | 0.054547 | -0.039568 | 0.064497 | -0.128002 | 0.256823 |
22.345896 | 0.258319 | -0.173120 | 0.054628 | -0.046005 | 0.062680 | -0.021459 | -0.040498 |
9.333251 | 0.027147 | 0.168871 | -0.056924 | 0.060983 | -0.087617 | -0.018906 | -0.071515 |
3.911187 | 0.004009 | 0.631155 | -0.296586 | 0.205758 | -0.394347 | 1.290606 | -2.897299 |
1.643207 | -0.001927 | 0.361032 | -0.329327 | 0.405709 | -0.551807 | -0.885569 | 6.965042 |
0.691746 | 0.001346 | 0.001841 | 0.304708 | -0.818993 | 1.999936 | -2.714876 | -8.363035 |
0.291674 | -0.000812 | 0.010697 | 0.673836 | -0.444713 | -0.278298 | 5.689387 | 6.887842 |
0.123144 | 0.000364 | -0.004323 | 0.277484 | 0.187358 | -2.352825 | -4.928902 | -3.917652 |
0.049258 | -0.000099 | 0.001242 | 0.013048 | 1.007226 | 1.792327 | 1.866541 | 1.185957 |
Comment: P.-O. Widmark, B.J. Persson and B.O. Roos, Theor. Chim. Acta (1991)