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An accurate, semi-empirical potential function for diatomic molecules

✍ Scribed by M.Keith Matzen; G.V. Calder; D.K. Hoffman


Book ID
113373075
Publisher
Elsevier Science
Year
1973
Tongue
English
Weight
886 KB
Volume
29
Category
Article
ISSN
1386-1425

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A semi-empirical analytical potential fo
✍ J. HernΓ‘ndez-Rojas; J. BretΓ³n; J.M. Gomez Llorente πŸ“‚ Article πŸ“… 1994 πŸ› Elsevier Science 🌐 English βš– 550 KB

A simple analytical semi-empirical potential for the interaction between a diatomic molecule and a spherical fullerene is proposed. The potential assumes a spherical continuum representation for the fullerene cage. Equilibrium positions and vibrational frequencies calculated with our expression are