Adsorption of polyelectrolytes onto oppositely charged cylindrical macroions


Autoria(s): De Carvalho, Sidney Jurado; Caetano, Daniel Lucas Zago
Contribuinte(s)

Universidade Estadual Paulista (UNESP)

Data(s)

27/05/2014

27/05/2014

28/06/2013

Resumo

In this work we investigate the adsorption of polyelectrolyte chains onto uniformly charged cylindrical macroions by means of the Metropolis Monte Carlo simulations and weighted histogram analysis method. Adopting a simplified model for macromolecules and treating the electrolytic solution in the Debye-Hückel level, conformational properties of the adsorbed chain, such as the radius of gyration and the thickness of the adsorbed layer, are provided as a function of ionic strength and macroion charge density. By analysis of the free energy profile as a function of the radius of gyration it was possible to identify first-order-like transitions between adsorbed and desorbed states and obtain a macroion charge density dependence of the critical ionic strength in good agreement with experiments. © 2013 AIP Publishing LLC.

Identificador

http://dx.doi.org/10.1063/1.4811842

Journal of Chemical Physics, v. 138, n. 24, 2013.

0021-9606

http://hdl.handle.net/11449/75725

10.1063/1.4811842

WOS:000321148200057

2-s2.0-84879924684

Idioma(s)

eng

Relação

Journal of Chemical Physics

Direitos

closedAccess

Palavras-Chave #Conformational properties #Density dependence #Electrolytic solution #Macroion charges #Metropolis Monte Carlo simulations #Polyelectrolyte chain #Radius of gyration #Weighted histogram analysis method #Ionic strength #Monte Carlo methods #Polyelectrolytes #Adsorption
Tipo

info:eu-repo/semantics/article