III.G.10.a. |
Energy differences between frozen core and full core for CCSD(T)/cc-pVDZ
For (Carbon monoxide)Energy (hartrees) | |
---|---|
frozen core | -1923.8564868 |
correlated core | -1923.8637156 |
difference | -0.0072288 |
Energy (hartrees) | |
---|---|
frozen core | -1923.8564868 |
correlated core | -1923.8637156 |
difference | -0.0072288 |
Energy (hartrees) | |
---|---|
frozen core | -1923.8564868 |
correlated core | -1923.8637155 |
difference | -0.0072287 |
Energy (hartrees) | |
---|---|
frozen core | -1923.8564868 |
correlated core | -1923.8637155 |
difference | -0.0072287 |