III.G.10.a. |
Energy differences between frozen core and full core for MP2/cc-pV(T+d)Z
For ()Energy (hartrees) | |
---|---|
frozen core | -326.8080265 |
correlated core | -326.9264597 |
difference | -0.1184332 |
Energy (hartrees) | |
---|---|
frozen core | -326.8080265 |
correlated core | -326.9264597 |
difference | -0.1184332 |
Energy (hartrees) | |
---|---|
frozen core | -326.8080265 |
correlated core | -326.9264597 |
difference | -0.1184332 |
Energy (hartrees) | |
---|---|
frozen core | -326.8080265 |
correlated core | -326.9264597 |
difference | -0.1184332 |