Field-theoretic polymer simulations

被引:137
作者
Ganesan, V [1 ]
Fredrickson, GH
机构
[1] Univ Calif Santa Barbara, Dept Chem Engn, Santa Barbara, CA 93106 USA
[2] Univ Calif Santa Barbara, Mat Res Lab, Santa Barbara, CA 93106 USA
来源
EUROPHYSICS LETTERS | 2001年 / 55卷 / 06期
关键词
D O I
10.1209/epl/i2001-00353-8
中图分类号
O4 [物理学];
学科分类号
0702 ;
摘要
A method is presented for numerically sampling functional integrals in field theory models of polymer solutions and melts. The approach effectively relaxes the mean-field approximation in self-consistent field theories of equilibrium polymer phases. Viewed from another perspective, the method provides an alternative to conventional particle-based simulations of coarse-grained models of polymers. We demonstrate the technique by applying it to examine fluctuation effects on the order-disorder transition in symmetric diblock copolymer melts. Extensions to more complex polymer blends, copolymers, and solutions are outlined.
引用
收藏
页码:814 / 820
页数:7
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