III.G.10.a. |
Energy differences between frozen core and full core for MP2/cc-pVDZ
For ()Energy (hartrees) | |
---|---|
frozen core | -89.2914627 |
correlated core | -89.2943115 |
difference | -0.0028488 |
Energy (hartrees) | |
---|---|
frozen core | -89.2914627 |
correlated core | -89.2943115 |
difference | -0.0028488 |
Energy (hartrees) | |
---|---|
frozen core | -89.2914627 |
correlated core | -89.2943115 |
difference | -0.0028488 |
Energy (hartrees) | |
---|---|
frozen core | -89.2914627 |
correlated core | -89.2943115 |
difference | -0.0028488 |