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Cellular Automata Simulation of the Spatial Conformations of Polyelectrolytes

C. Echeverria·W. Olivares-Rivas·K. Tucci
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Abstract

We carried out a Cellular Automata simulation of a model polyelectrolyte solution at infinite dilution, in order to reproduce qualitatively its conformational properties. Our results predict the so called \emph{pearl necklace} structures, which compare favorably with the more elaborated and costly Molecular Dynamics simulations.

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C. Echeverria, W. Olivares-Rivas, K. Tucci. 2006-12-04. Cellular Automata Simulation of the Spatial Conformations of Polyelectrolytes. https://arxiv.org/abs/cond-mat/0612098

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