Monte Carlo simulation of diblock copolymer microphases by means of a fast off-lattice model

被引：17

作者：

Besold, G

Hassager, O

Mouritsen, OG

机构：

[1] Tech Univ Denmark, Dept Chem, Membrane & Stat Phys Grp, DK-2800 Lyngby, Denmark

[2] Tech Univ Denmark, Dept Chem Engn, DK-2800 Lyngby, Denmark

[3] Tech Univ Denmark, Danish Polymer Ctr, DK-2800 Lyngby, Denmark

来源：

COMPUTER PHYSICS COMMUNICATIONS | 1999年 / 121卷

关键词：

D O I：

10.1016/S0010-4655(99)00402-6

中图分类号：

TP39 [计算机的应用];

学科分类号：

081203 ; 0835 ;

摘要：

We present a mesoscopic off-lattice model for the simulation of diblock copolymer melts by Monte Carlo techniques. A single copolymer molecule is modeled as a discrete Edwards chain consisting of two blocks with vertices of type A and B, respectively. The volume interaction is formulated in terms of coarse-grained densities of the A and B vertices. The model allows the study of equilibrium conformational properties of diblock copolymer microphases for sufficiently large system sizes. (C) 1999 Elsevier Science B.V. All rights reserved.

引用

页码：542 / 544

页数：3

共 23 条

[11] MONTE-CARLO SIMULATION OF CONCENTRATED DIBLOCK COPOLYMERS IN A SELECTIVE SOLVENT - ANISOTROPY OF THE DIFFUSION [J].