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基于改进的Maier-Saupe理论对链状高分子结晶过程的研究
引用本文:张健,姜舟婷.基于改进的Maier-Saupe理论对链状高分子结晶过程的研究[J].宁波教育学院学报,2010,12(6).
作者姓名:张健  姜舟婷
基金项目:浙江省科技厅钱江人才项目
摘    要:以分子动力学对高分子链取向函数S的模拟结果,改进原有的Maier-Saupe平均场理论在液晶小分子体系中的势能表达式,使之适用于高分子单链体系,研究高分子链的结晶过程。得出链状高分子结构的改变主要依靠链段的有序化,非晶态全局取向函数大于零,临界温度随着链柔性的增加而升高的结论,对深入理解高分子的结晶过程提供了理论依据。

关 键 词:链状高分子  结晶  取向函数

The Study on Crystallization Process of a Single Polymer Chain Based on the Improved Maier-Saupe Theory
ZHANG Jian,JIANG Zhou-ting.The Study on Crystallization Process of a Single Polymer Chain Based on the Improved Maier-Saupe Theory[J].Journal of Ningbo Institute of Education,2010,12(6).
Authors:ZHANG Jian  JIANG Zhou-ting
Abstract:The structural information of a single polymer chain during its crystallization process was studied here,by the improved Maier-Saupe theory,and based on the MD simulation result on orientation order parameter S.The original M-S theory was explained the liquid crystal during the N-I transition successfully.In this article,the mean field potential expression of M-S theory was improved to suit the single polymer chain system.It concluded that the paralleled stems are mainly located in the crystal lattice under the low temperature.The value of S is larger than zero under non-crystal state.And the critical temperature TC is increasing with the flexibility of a polymer chain.The theoretical conclusions are helpful to understand the crystallization process of a single polymer chain.
Keywords:polymer chain  crystallization  orientation order parameter
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