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Computer Simulations and Experimental Dynamical Characterization of a Composite Liquid Crystal-Polymer System

机译:复合液晶-聚合物体系的计算机模拟和实验动力学表征

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摘要

We present a Monte Carlo study of a liquid crystal-polymer interface, focusing on a single cell with boundary conditions tailored to mimic the main features of the system and we examine the effect of an external applied field. A simple lattice spin model, based on the Lebwohl-Lasher hamiltonian, has been employed to represent the nematic and the polymer molecules. The orientations of the spins representing the low molar mass nematic molecules are updated during the simulations while the polymer chain units are kept frozen. The model allows us to investigate the molecular organization and the ordering expected across the cell. Moreover the response to the change in external field intensity and duration pulse is also studied.
机译:我们介绍了液晶聚合物界面的蒙特卡洛研究,重点关注边界条件经过定制的单个单元,以模拟系统的主要特征,并研究了外部应用场的影响。基于Lebwohl-Lasher汉密尔顿方程的简单晶格自旋模型已用于表示向列和聚合物分子。代表低摩尔质量向列分子的自旋的方向在模拟过程中进行了更新,同时聚合物链单元保持冻结状态。该模型使我们能够研究整个细胞的分子组织和预期的有序性。此外,还研究了对外部场强和持续时间脉冲变化的响应。

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