第 36 卷第 3 期Vol. 36 No. 3
2006 年 6 月Jun 2006

所属栏目:专论与综述

分子模拟方法在环氧树脂研究中的应用
李楚新; 吴超富; 熊远钦; 徐伟箭(湖南大学化学化工学院高分子研究所; 湖南长沙; 中国石化巴陵有限责任公司; 湖南岳阳)
摘 要:分子模拟方法是一种新型的科学研究的方法,而环氧树脂材料是一类重要的高分子材料。近年来,分子模拟方法被应用于环氧树脂及其固化剂的分子设计中并且引起了极大的关注。笔者根据相关文献从研究的主要问题和方法对分子模拟法在环氧树脂中的应用作一综述。
关键词:分子模拟; 分子设计; 环氧树脂; 固化剂
中图分类号:TQ323.5  文献标识码:A  文章编号:1009-9212(2006)03-0011-03
Application of Molecular Simulation Technology to Study Epoxy Resins
LI Chu-xin1; 2; WU Chao-fu1; XIONG Yuan-qin1; XU Wei-jian1(1.Institute of Polymer Research; Department of Chemistry and Chemical Engineering; Hunan Unversity; Changsha 410082; China; 2.SINOPEC BALING Petrochemical Co.; Ltd.; Yueyang 414014; China)
Abstract:On one hand,molecular simulations have been emerging as a kind of new research methods different from traditional experimental and theoretical ones.On the other hand,epoxy resins represent one of important materials commercially.It would hold great promise to study and design epoxy-related products using molecular simulations.Studies on this issue were reviewed based on the articles during the past two decades.In essences,the general methods and interesting problems were addressed,respectively.
Key words:molecular simulation; molecular design; epoxy resins; curing agents
收稿日期:2006-03-06
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