III.G.10.a. |
Energy differences between frozen core and full core for MP2/6-31+G**
For ()Energy (hartrees) | |
---|---|
frozen core | -280.1970776 |
correlated core | -280.2096406 |
difference | -0.0125630 |
Energy (hartrees) | |
---|---|
frozen core | -280.1970777 |
correlated core | -280.2096406 |
difference | -0.0125629 |
Energy (hartrees) | |
---|---|
frozen core | -280.1970777 |
correlated core | -280.2096406 |
difference | -0.0125629 |
Energy (hartrees) | |
---|---|
frozen core | -280.1970776 |
correlated core | -280.2096406 |
difference | -0.0125630 |
Energy (hartrees) | |
---|---|
frozen core | -280.1970776 |
correlated core | -280.2096406 |
difference | -0.0125630 |
Energy (hartrees) | |
---|---|
frozen core | -280.1970777 |
correlated core | -280.2096406 |
difference | -0.0125629 |
Energy (hartrees) | |
---|---|
frozen core | -280.1970777 |
correlated core | -280.2096406 |
difference | -0.0125629 |
Energy (hartrees) | |
---|---|
frozen core | -280.1970776 |
correlated core | -280.2096406 |
difference | -0.0125630 |