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The calculation of force constants and normal coordinates IV: XH4 and XH3 molecules

Duncan, J. L. and Mills, I. (1964) The calculation of force constants and normal coordinates IV: XH4 and XH3 molecules. Spectrochimica Acta, 20 (3). pp. 523-546. ISSN 0371-1951

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To link to this article DOI: 10.1016/0371-1951(64)80047-3

Abstract/Summary

Normal coordinate calculations of XH4 and XH3 molecules are reviewed and discussed. It is shown that for most of these molecules the true values of the force constants in the most General Harmonic Force Field can be uniquely determined only by making use of vibration-rotation interaction constants. It is emphasized that without these extra data the GFF is not determined. The results are compared with various model force fields for these molecules.

Item Type:Article
Refereed:Yes
Divisions:Faculty of Life Sciences > School of Chemistry, Food and Pharmacy > Department of Chemistry
ID Code:7329
Publisher:Elsevier

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