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Molecular Crystals and Liquid Crystals Volume 545, 2011 - Issue 1: Proceedings of the 23rd International Liquid Crystal Conference (ILCC 2010) Part VI of VIII
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Simulations and Molecular Modeling

The Modeling with Free Boundary

M. E. Agelmenev The Institute of Organic Synthesis and Chemistry of Coal of the Republic of Kazakhstan, Karaganda, Republic of KazakhstanCorrespondence[email protected]
Pages 190/[1414]-203/[1427] | Published online: 30 Jun 2011
 
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Abstract

In this work the results of modeling of the liquid crystals that have different types of the mesomorphism are presented. The simulation was done by the method of the molecular dynamics without setting boundary conditions, which is allowed for recording the liquid aggregate state.

Acknowledgment

This work has been done in scope of the plan of the fundamental researches of the Ministry of Education and Science of the Republic of Kazakhstan.

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