III.G.10.a. |
Energy differences between frozen core and full core for MP3/6-31G*
For H2CS- (Magnesium monofluoride)Energy (hartrees) | |
---|---|
frozen core | -56.7135708 |
correlated core | -56.7166868 |
difference | -0.0031160 |
Energy (hartrees) | |
---|---|
frozen core | -56.7135708 |
correlated core | -56.7166868 |
difference | -0.0031160 |
Energy (hartrees) | |
---|---|
frozen core | -56.7135708 |
correlated core | -56.7166871 |
difference | -0.0031164 |
Energy (hartrees) | |
---|---|
frozen core | -56.7135708 |
correlated core | -56.7166871 |
difference | -0.0031164 |