III.G.10.b. |
Molecule problem. Defaulted to H2CO |
Bond Length differences between CCSD(T) (frozen core) and CCSD(T)=FULL (all electrons correlated)
Choose the bonds for H2CO+ (formaldehyde cation)Species | Name | Level |
---|---|---|
H2CO+ | formaldehyde cation | HF/6-31G* |
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