III.G.10.a. |
Energy differences between frozen core and full core for MP2/cc-pVTZ
For ()Energy (hartrees) | |
---|---|
frozen core | -353.6431397 |
correlated core | -353.6945192 |
difference | -0.0513794 |
Energy (hartrees) | |
---|---|
frozen core | -353.6431397 |
correlated core | -353.6945192 |
difference | -0.0513795 |
Energy (hartrees) | |
---|---|
frozen core | -353.6431396 |
correlated core | -353.6945192 |
difference | -0.0513796 |
Energy (hartrees) | |
---|---|
frozen core | -353.6431396 |
correlated core | -353.6945192 |
difference | -0.0513796 |
Energy (hartrees) | |
---|---|
frozen core | -353.6431396 |
correlated core | -353.6945192 |
difference | -0.0513796 |
Energy (hartrees) | |
---|---|
frozen core | -353.6431396 |
correlated core | -353.6945192 |
difference | -0.0513796 |