III.G.10.a. |
Energy differences between frozen core and full core for MP4/3-21G
For ()Energy (hartrees) | |
---|---|
frozen core | -37.5151576 |
correlated core | -37.5165102 |
difference | -0.0013526 |
Energy (hartrees) | |
---|---|
frozen core | -37.5151576 |
correlated core | -37.5165102 |
difference | -0.0013526 |
Energy (hartrees) | |
---|---|
frozen core | -37.5151639 |
correlated core | -37.5165102 |
difference | -0.0013462 |
Energy (hartrees) | |
---|---|
frozen core | -37.5151639 |
correlated core | -37.5165102 |
difference | -0.0013462 |
Energy (hartrees) | |
---|---|
frozen core | -37.5151576 |
correlated core | -37.5165102 |
difference | -0.0013526 |
Energy (hartrees) | |
---|---|
frozen core | -37.5151576 |
correlated core | -37.5165102 |
difference | -0.0013526 |