III.G.10.a. |
Energy differences between frozen core and full core for CCSD(T)/cc-pCVDZ
For (Selenium Dichloride)Energy (hartrees) | |
---|---|
frozen core | -164.3884239 |
correlated core | -164.5012196 |
difference | -0.1127957 |
Energy (hartrees) | |
---|---|
frozen core | -164.3884239 |
correlated core | -164.5012196 |
difference | -0.1127957 |
Energy (hartrees) | |
---|---|
frozen core | -164.3884239 |
correlated core | -164.5012196 |
difference | -0.1127957 |
Energy (hartrees) | |
---|---|
frozen core | -164.3884239 |
correlated core | -164.5012196 |
difference | -0.1127957 |