III.G.10.a. |
Energy differences between frozen core and full core for MP2/cc-pVTZ
For ()Energy (hartrees) | |
---|---|
frozen core | -56.0819209 |
correlated core | -56.0967413 |
difference | -0.0148203 |
Energy (hartrees) | |
---|---|
frozen core | -56.0819209 |
correlated core | -56.0967413 |
difference | -0.0148204 |
Energy (hartrees) | |
---|---|
frozen core | -56.0819209 |
correlated core | -56.0967413 |
difference | -0.0148204 |
Energy (hartrees) | |
---|---|
frozen core | -56.0819209 |
correlated core | -56.0967413 |
difference | -0.0148204 |