III.G.10.a. |
Energy differences between frozen core and full core for MP2/6-31+G**
For ()Energy (hartrees) | |
---|---|
frozen core | -116.2740361 |
correlated core | -116.2893593 |
difference | -0.0153232 |
Energy (hartrees) | |
---|---|
frozen core | -116.2740361 |
correlated core | -116.2893593 |
difference | -0.0153232 |
Energy (hartrees) | |
---|---|
frozen core | -116.2740361 |
correlated core | -116.2893593 |
difference | -0.0153232 |
Energy (hartrees) | |
---|---|
frozen core | -116.2740361 |
correlated core | -116.2893593 |
difference | -0.0153232 |
Energy (hartrees) | |
---|---|
frozen core | -116.2740361 |
correlated core | -116.2893593 |
difference | -0.0153232 |
Energy (hartrees) | |
---|---|
frozen core | -116.2740361 |
correlated core | -116.2893593 |
difference | -0.0153231 |
Energy (hartrees) | |
---|---|
frozen core | -116.2740361 |
correlated core | -116.2893593 |
difference | -0.0153231 |
Energy (hartrees) | |
---|---|
frozen core | -116.2740361 |
correlated core | -116.2893593 |
difference | -0.0153232 |