III.G.10.a. |
Energy differences between frozen core and full core for MP2/6-31+G**
For ()Energy (hartrees) | |
---|---|
frozen core | -76.2331084 |
correlated core | -76.2358860 |
difference | -0.0027776 |
Energy (hartrees) | |
---|---|
frozen core | -76.2331084 |
correlated core | -76.2358860 |
difference | -0.0027776 |
Energy (hartrees) | |
---|---|
frozen core | -76.2331084 |
correlated core | -76.2358860 |
difference | -0.0027776 |
Energy (hartrees) | |
---|---|
frozen core | -76.2331084 |
correlated core | -76.2358860 |
difference | -0.0027776 |
Energy (hartrees) | |
---|---|
frozen core | -76.2331084 |
correlated core | -76.2358860 |
difference | -0.0027776 |
Energy (hartrees) | |
---|---|
frozen core | -76.2331084 |
correlated core | -76.2358860 |
difference | -0.0027776 |
Energy (hartrees) | |
---|---|
frozen core | -76.2331084 |
correlated core | -76.2358860 |
difference | -0.0027776 |
Energy (hartrees) | |
---|---|
frozen core | -76.2331084 |
correlated core | -76.2358860 |
difference | -0.0027776 |