Optimal control of electrostatic self-assembly of binary monolayers

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Abstract

A simple macroscopic model is used to determine an optimal annealing schedule for self-assembly of binary monolayers of spherical particles. The model assumes that a single rate-controlling mechanism is responsible for the formation of spatially ordered structures and that its rate follows an Arrhenius form. The optimal schedule is derived in an analytical form using classical optimization methods. Molecular dynamics simulations of the self-assembly demonstrate that the proposed schedule outperforms other schedules commonly used for simulated annealing. © IOP Publishing Ltd and Deutsche Physikalische Gesellschaft.

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Shestopalov, N. V., Henkelman, G., Powell, C. T., & Rodin, G. J. (2009). Optimal control of electrostatic self-assembly of binary monolayers. New Journal of Physics, 11. https://doi.org/10.1088/1367-2630/11/5/053014

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