MOLPRO Basis Query, element=Es, basis=ECP60MHF_GUESS, l=s
Basis Es s ECP60MHF_GUESS
| Primitives | Contractions... |
|---|
| 17331.343000 | 0.000007 | -0.000003 | 0.000001 |
| 2753.323100 | 0.000006 | -0.000009 | 0.000004 |
| 505.859500 | 0.000467 | -0.000158 | 0.000055 |
| 149.875500 | -0.010062 | 0.003657 | -0.001359 |
| 87.301737 | 0.070653 | -0.029678 | 0.011738 |
| 50.904626 | -0.333329 | 0.157879 | -0.064694 |
| 29.749972 | 0.882161 | -0.454867 | 0.189512 |
| 14.350475 | -1.385967 | 0.798206 | -0.337279 |
| 3.810059 | 1.142800 | -1.048576 | 0.460274 |
| 1.906201 | 0.367968 | -0.353315 | 0.193700 |
| 0.848777 | 0.009169 | 0.869987 | -0.529822 |
| 0.367442 | 0.000765 | 0.514176 | -0.437318 |
| 0.070860 | -0.000374 | 0.106678 | 0.739053 |
| 0.028062 | -0.000094 | 0.052080 | 0.449088 |
Comment: ECP60MWB_GUESS: Startorbitale fuer ECP60MWB mit Basis ECP60MWB_ANO