III.G.10.a. |
Energy differences between frozen core and full core for MP4/cc-pVQZ
For ()Energy (hartrees) | |
---|---|
frozen core | -99.6499220 |
correlated core | -99.6812560 |
difference | -0.0313340 |
Energy (hartrees) | |
---|---|
frozen core | -99.6499220 |
correlated core | -99.6812560 |
difference | -0.0313340 |
Energy (hartrees) | |
---|---|
frozen core | -99.6499220 |
correlated core | -99.6812560 |
difference | -0.0313340 |
Energy (hartrees) | |
---|---|
frozen core | -99.6499220 |
correlated core | -99.6812560 |
difference | -0.0313340 |