III.G.10.a. |
Energy differences between frozen core and full core for MP2/cc-pVTZ
For ()Energy (hartrees) | |
---|---|
frozen core | -152.6470117 |
correlated core | -152.6745281 |
difference | -0.0275165 |
Energy (hartrees) | |
---|---|
frozen core | -152.6470117 |
correlated core | -152.6745281 |
difference | -0.0275165 |
Energy (hartrees) | |
---|---|
frozen core | -152.6470115 |
correlated core | -152.6745281 |
difference | -0.0275167 |
Energy (hartrees) | |
---|---|
frozen core | -152.6470117 |
correlated core | -152.6745274 |
difference | -0.0275157 |
Energy (hartrees) | |
---|---|
frozen core | -152.6470117 |
correlated core | -152.6745274 |
difference | -0.0275157 |
Energy (hartrees) | |
---|---|
frozen core | -152.6470115 |
correlated core | -152.6745274 |
difference | -0.0275159 |