Please use this identifier to cite or link to this item: http://repositorio.unicamp.br/jspui/handle/REPOSIP/98727
Type: Artigo de periódico
Title: Nonadiabatic Generator-coordinate Calculation Of H2+
Author: Tostes J.G.R.
Piza A.F.R.D.T.
Abstract: We report on a nonadiabatic calculation of the few lowest J=0 states in the H2+ molecule done within the framework of the generator-coordinate method. Substantial accuracy is achieved with the diagonalization of matrices of very modest dimensions. The resulting wave functions are strongly dominated by just a few basis states. The computational scheme is set up so as to take the best advantage of good analytical approximations to existing adiabatic molecular wave functions. © 1983 The American Physical Society.
Editor: 
Rights: aberto
Identifier DOI: 10.1103/PhysRevA.28.538
Address: http://www.scopus.com/inward/record.url?eid=2-s2.0-21544445474&partnerID=40&md5=2c182362af8b6f4e2dee1a4a6d1e5e7c
Date Issue: 1983
Appears in Collections:Unicamp - Artigos e Outros Documentos

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