The quantum mechanical calculation of rotational spectra. A comparison of methods for C2H2, HCN, HNC, HCO+, N2H+, CO and N2. Predictions for HCNH+, COH+, HBO, HBNH, and HBF+. | J Chem Phys;80(8): 3720-5, 1984 Apr 15. | MEDLINE

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The quantum mechanical calculation of rotational spectra. A comparison of methods for C2H2, HCN, HNC, HCO+, N2H+, CO and N2. Predictions for HCNH+, COH+, HBO, HBNH, and HBF+.

DeFrees, D J; Binkley, J S; McLean, A D.

Affiliation

DeFrees DJ; Molecular Research Institute, Palo Alto, California 94304, USA.

J Chem Phys ; 80(8): 3720-5, 1984 Apr 15.

Article in En | MEDLINE | ID: mdl-11540824

Subject(s)

Models, Molecular; Quantum Theory; Rotation; Chemical Phenomena; Chemistry; Hydrocarbons; Molecular Structure

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Collection: 01-internacional Database: MEDLINE Main subject: Quantum Theory / Rotation / Models, Molecular Type of study: Prognostic_studies / Risk_factors_studies Language: En Journal: J Chem Phys Year: 1984 Document type: Article Affiliation country: United States Country of publication: United States

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Collection: 01-internacional Database: MEDLINE Main subject: Quantum Theory / Rotation / Models, Molecular Type of study: Prognostic_studies / Risk_factors_studies Language: En Journal: J Chem Phys Year: 1984 Document type: Article Affiliation country: United States Country of publication: United States