III.G.10.a. |
Energy differences between frozen core and full core for MP2/cc-pVTZ
For ()Energy (hartrees) | |
---|---|
frozen core | -188.3083640 |
correlated core | -188.3488643 |
difference | -0.0405003 |
Energy (hartrees) | |
---|---|
frozen core | -188.3083640 |
correlated core | -188.3488643 |
difference | -0.0405003 |
Energy (hartrees) | |
---|---|
frozen core | -188.3083638 |
correlated core | -188.3488643 |
difference | -0.0405005 |
Energy (hartrees) | |
---|---|
frozen core | -188.3083640 |
correlated core | -188.3488641 |
difference | -0.0405001 |
Energy (hartrees) | |
---|---|
frozen core | -188.3083640 |
correlated core | -188.3488641 |
difference | -0.0405001 |
Energy (hartrees) | |
---|---|
frozen core | -188.3083638 |
correlated core | -188.3488641 |
difference | -0.0405004 |
Energy (hartrees) | |
---|---|
frozen core | -188.3083640 |
correlated core | -188.3488641 |
difference | -0.0405001 |
Energy (hartrees) | |
---|---|
frozen core | -188.3083640 |
correlated core | -188.3488641 |
difference | -0.0405001 |
Energy (hartrees) | |
---|---|
frozen core | -188.3083638 |
correlated core | -188.3488641 |
difference | -0.0405004 |