III.G.10.a. |
Energy differences between frozen core and full core for MP2/cc-pVTZ
For (Carbon monoxide)Energy (hartrees) | |
---|---|
frozen core | -150.0963784 |
correlated core | -150.1203454 |
difference | -0.0239670 |
Energy (hartrees) | |
---|---|
frozen core | -150.0963784 |
correlated core | -150.1203451 |
difference | -0.0239667 |
Energy (hartrees) | |
---|---|
frozen core | -150.0963781 |
correlated core | -150.1203454 |
difference | -0.0239673 |
Energy (hartrees) | |
---|---|
frozen core | -150.0963781 |
correlated core | -150.1203451 |
difference | -0.0239670 |