Please use this identifier to cite or link to this item: http://repositorio.unicamp.br/jspui/handle/REPOSIP/107190
Type: Artigo de periódico
Title: Computer Modelling Of Solid Alkali Metal Carboxylates
Author: Barreto L.S.
Mort K.A.
Jackson R.A.
Alves O.L.
Abstract: A computational study of solid lithium acetate dihydrate and anhydrous sodium acetate is presented. Interatomic potentials are obtained by empirical fitting to experimental structural data for both materials and the resulting potentials were found to be transferable to different phases of the same materials, giving good agreement with the experimental structure.
Editor: IOP, Bristol, United Kingdom
Rights: fechado
Identifier DOI: 10.1088/0953-8984/12/45/302
Address: http://www.scopus.com/inward/record.url?eid=2-s2.0-0034319607&partnerID=40&md5=2e496856aa278c4baa9f155691263d9c
Date Issue: 2000
Appears in Collections:Unicamp - Artigos e Outros Documentos

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