Volume 106, Issue 13 pp. 2587-2596

Determination of electronic energy levels for the heteromolecular ions HeH2+, LiH3+, and BeH4+ from the Hamilton–Jacobi equation

J. A. Campos

J. A. Campos

Instituto de Fisica, Universidade de Brasília, C.P. 04455, 70919-970, Brasília DF, Brazil

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D. L. Nascimento

D. L. Nascimento

Department de Matemática, IE, Universidade de Brasília, 70910-900, Brasília DF, Brazil

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D. T. Cavalcante

D. T. Cavalcante

Instituto de Fisica, Universidade de Brasília, C.P. 04455, 70919-970, Brasília DF, Brazil

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A. L. A. Fonseca

Corresponding Author

A. L. A. Fonseca

Instituto de Fisica, Universidade de Brasília, C.P. 04455, 70919-970, Brasília DF, Brazil

Instituto de Fisica, Universidade de Brasília, C.P. 04455, 70919-970, Brasília DF, BrazilSearch for more papers by this author
A. O. C. Nunes

A. O. C. Nunes

Instituto de Fisica, Universidade de Brasília, C.P. 04455, 70919-970, Brasília DF, Brazil

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First published: 17 April 2006
Citations: 14

Abstract

By making use of the Hamilton–Jacobi equation, we obtain the exact value of the electronic energy levels for the heteromolecular ions HeH2+, LiH3+, and BeH4+ as a function of nuclear distance. The Hylleraas method in association with the series established by Wind–Jaffé was applied to these molecular ions. The results are in good agreement with those found in the literature. © 2006 Wiley Periodicals, Inc. Int J Quantum Chem, 2006

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