III.G.10.a. |
Energy differences between frozen core and full core for MP2/cc-pVTZ
For ()Energy (hartrees) | |
---|---|
frozen core | -89.3706114 |
correlated core | -89.3900834 |
difference | -0.0194720 |
Energy (hartrees) | |
---|---|
frozen core | -89.3706114 |
correlated core | -89.3900834 |
difference | -0.0194719 |
Energy (hartrees) | |
---|---|
frozen core | -89.3706114 |
correlated core | -89.3900834 |
difference | -0.0194720 |
Energy (hartrees) | |
---|---|
frozen core | -89.3706114 |
correlated core | -89.3900834 |
difference | -0.0194720 |