Dependence of Potential Energy on Inter-bond Angles in Simple Molecules

Autor:	M. K. Rudra Warier, T. R. Ananthakrishnan, C. M. Paul, K. Indira
Rok vydání:	1992
Předmět:	chemistry.chemical_classification Molecular geometry Symmetric systems Chemistry Simple (abstract algebra) General Physics and Astronomy Molecule Mineralogy Physical and Theoretical Chemistry Inorganic compound Potential energy Molecular physics Mathematical Physics
Zdroj:	Zeitschrift für Naturforschung A. 47:765-767
ISSN:	1865-7109 0932-0784
DOI:	10.1515/zna-1992-0608
Popis:	A method is developed to investigate the variation of potential energy contributions (Vstretch, Vbend, Vstretch-bend and Vstretch-stretch) in simple molecules when their inter-bond angles θ are varied arbitrarily. Applied to XY2 bend symmetric systems, the V - θ plots suggest that the actual equilibrium configuration in these molecules lies in the premises of minimum Vbend and zero Vstretch-bend.
Databáze:	OpenAIRE
Externí odkaz:	https://explore.openaire.eu/search/publication?articleId=doi_________::18c7a8c360945b49320be9c681f1bc78 https://doi.org/10.1515/zna-1992-0608 Zobrazit plný text záznamu