III.G.10.a. |
Energy differences between frozen core and full core for MP2/cc-pVDZ
For ()Energy (hartrees) | |
---|---|
frozen core | -114.9940154 |
correlated core | -114.9988309 |
difference | -0.0048154 |
Energy (hartrees) | |
---|---|
frozen core | -114.9940154 |
correlated core | -114.9988308 |
difference | -0.0048154 |
Energy (hartrees) | |
---|---|
frozen core | -114.9940154 |
correlated core | -114.9988309 |
difference | -0.0048155 |
Energy (hartrees) | |
---|---|
frozen core | -114.9940154 |
correlated core | -114.9988308 |
difference | -0.0048154 |
Energy (hartrees) | |
---|---|
frozen core | -114.9951145 |
correlated core | -114.9999548 |
difference | -0.0048403 |