III.G.10.a. |
Energy differences between frozen core and full core for CCSD/cc-pVTZ
For ()Energy (hartrees) | |
---|---|
frozen core | -76.3245565 |
correlated core | -76.3380105 |
difference | -0.0134540 |
Energy (hartrees) | |
---|---|
frozen core | -76.3245565 |
correlated core | -76.3380103 |
difference | -0.0134538 |
Energy (hartrees) | |
---|---|
frozen core | -76.3245565 |
correlated core | -76.3380105 |
difference | -0.0134541 |
Energy (hartrees) | |
---|---|
frozen core | -76.3245562 |
correlated core | -76.3380105 |
difference | -0.0134543 |
Energy (hartrees) | |
---|---|
frozen core | -76.3245562 |
correlated core | -76.3380103 |
difference | -0.0134541 |
Energy (hartrees) | |
---|---|
frozen core | -76.3245562 |
correlated core | -76.3380105 |
difference | -0.0134543 |
Energy (hartrees) | |
---|---|
frozen core | -76.3245565 |
correlated core | -76.3380105 |
difference | -0.0134540 |
Energy (hartrees) | |
---|---|
frozen core | -76.3245565 |
correlated core | -76.3380103 |
difference | -0.0134538 |
Energy (hartrees) | |
---|---|
frozen core | -76.3245565 |
correlated core | -76.3380105 |
difference | -0.0134541 |