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Item hits:
Preview | Title | Author(s) | Program | Method(s) | Basis Set | Energy | Solv. | Vibr. |
---|---|---|---|---|---|---|---|---|
/opt Acetic_acid | Sharma, Akhilesh Kumar | Gaussian; 09; EM64L-G09RevD.01 | RB3LYP | 6-31G(D) GENECP | -229.084611091; Eh |
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