III.G.10.a. |
Energy differences between frozen core and full core for CCSD(T)/cc-pVDZ
For ()Energy (hartrees) | |
---|---|
frozen core | -89.8035091 |
correlated core | -89.8059915 |
difference | -0.0024824 |
Energy (hartrees) | |
---|---|
frozen core | -89.8035090 |
correlated core | -89.8059915 |
difference | -0.0024824 |
Energy (hartrees) | |
---|---|
frozen core | -89.8035091 |
correlated core | -89.8059915 |
difference | -0.0024824 |
Energy (hartrees) | |
---|---|
frozen core | -89.8035090 |
correlated core | -89.8059915 |
difference | -0.0024824 |