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球体表面的向列序和缺陷:蒙特卡罗模拟研究

Nematic ordering and defects on the surface of a sphere: a Monte Carlo simulation study.

作者信息

Bates Martin A

机构信息

Department of Chemistry, University of York, York, UK.

出版信息

J Chem Phys. 2008 Mar 14;128(10):104707. doi: 10.1063/1.2890724.

Abstract

We examine the ordering of hard rods on the surface of a sphere using computer simulations. As predicted by previous theories of thin nematic shells we observe four s = + 1/2 defects. However, the predicted tetrahedral symmetry for the defects and the "baseball" director configuration is not observed. Instead the four defects are located, on average, on a great circle which splits the sphere into two hemispheres, each of which has a splay dominated director configuration. We argue that this result occurs as the bend elastic constant for hard rods is much larger than the splay elastic constant.

摘要

我们使用计算机模拟研究了硬杆在球体表面的排列方式。正如之前向列型薄壳理论所预测的那样,我们观察到了四个(s = + 1/2)缺陷。然而,并未观察到缺陷的预测四面体对称性和“棒球”指向矢构型。相反,这四个缺陷平均位于一个将球体分成两个半球的大圆上,每个半球都具有以展曲为主的指向矢构型。我们认为,这一结果的出现是因为硬杆的弯曲弹性常数远大于展曲弹性常数。

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