Please use this identifier to cite or link to this item: http://www.repositorio.ufop.br/handle/123456789/1645
Title: Computational simulation of binary compounds of carbon nanotubes and amphiphilics in aqueous solution by Monte Carlo method.
Authors: Hermsdorff, Leandro Lopes
Pinheiro, Carlos Felipe Saraiva
Bernardes, Américo Tristão
Keywords: Monte Carlo methods
Amphiphilics
Dissociation
Carbonnanotubes
Issue Date: 2012
Citation: HERMSDORFF, L. L.; PINHEIRO, C. F. S.; BERNARDES, A. T. Computational simulation of binary compounds of carbon nanotubes and amphiphilics in aqueous solution by Monte Carlo method. Computational Materials Science, v. 59, p. 121-127, jun. 2012. Disponível em: <https://www.sciencedirect.com/science/article/pii/S0927025612001206>. Acesso em: 16 out. 2012.
Abstract: Carbonnanotubes have been subject of intensive research because of their outstanding physical properties. The problem of dissolving the aggregation of tubes in bundles formed by strong van der Waals force is addressed in this study. A complete understanding about carbonnanotubes properties is necessary in order to obtain a process of detachment that cause no damage to the tubes. Detachment can be promoted by means of amphiphilic adsorption in water solution. We have studied this phenomenon by means MonteCarlosimulation. The algorithm used was Metropolis algorithm. The analysis of equilibrium was done by means of structure function.
URI: http://www.repositorio.ufop.br/handle/123456789/1645
ISSN: 09270256
metadata.dc.rights.license: O periódico Computational Materials Science concede permissão para depósito do artigo no Repositório Institucional da UFOP. Número da licença: 3460290879092.
Appears in Collections:DEFIS - Artigos publicados em periódicos

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