摘要
运用四位置模型对具有排除体积的两维高分子链进行MonteCarlo模拟和标度分析.为了提高长链的抽样效率,还提出了被称为“链段伸展法”的抽样方法.对单个自避行走(SAW)链的模拟结果表明,两维SAW链有着明显不同于无规飞行(RW)链以及三维SAW链的特点.多链体系中,排除体积效应随浓度上升而被逐渐屏蔽.两维高分子亚浓溶液中的链尺寸与溶液浓度成反比.
Two dimensional macromolecular chains with excluded volume are studied withMonte Carlo simulation based on four-site bond fluctuation model and corresponding scalinganalysis is carried out. A novel sampling method,called'segment extension method', is putforward in order to enhance the sampling effciency of long chain. A simulation for single selfavoiding walk(SAW)chain show that two-dimensional SAW chain has a quite different character with both RW chain and three-dimensional SAW chain. The excluded volume effect inthe multiple-chain system is gradually screened out with increasing the segment Concentration. The chain size in the semi-dilute solution is in inverse proportion to the segment concentration for the two-dimensional SAw chains.
出处
《复旦学报(自然科学版)》
CAS
CSCD
北大核心
1997年第4期361-369,共9页
Journal of Fudan University:Natural Science
基金
国家"攀登计划"资助
国家自然科学基金
国家科委青年基金
国家教委博士点专项基金
关键词
标度律
排除体积效应
高分子链
蒙特卡罗模拟
scaling law
excluded volume effect
Monte Carlo simulationl four-site model
segment extension method