III.G.10.a. |
Energy differences between frozen core and full core for MP2/6-31+G**
For ()Energy (hartrees) | |
---|---|
frozen core | -353.2596161 |
correlated core | -353.2711301 |
difference | -0.0115139 |
Energy (hartrees) | |
---|---|
frozen core | -353.2596161 |
correlated core | -353.2711300 |
difference | -0.0115139 |
Energy (hartrees) | |
---|---|
frozen core | -353.2596161 |
correlated core | -353.2711301 |
difference | -0.0115139 |
Energy (hartrees) | |
---|---|
frozen core | -353.2596161 |
correlated core | -353.2711300 |
difference | -0.0115139 |
Energy (hartrees) | |
---|---|
frozen core | -353.2596161 |
correlated core | -353.2711301 |
difference | -0.0115139 |
Energy (hartrees) | |
---|---|
frozen core | -353.2596161 |
correlated core | -353.2711300 |
difference | -0.0115139 |
Energy (hartrees) | |
---|---|
frozen core | -353.2596161 |
correlated core | -353.2711301 |
difference | -0.0115140 |
Energy (hartrees) | |
---|---|
frozen core | -353.2596161 |
correlated core | -353.2711300 |
difference | -0.0115140 |