Monte-Carlo Method for Simulations of Ring Polymers in the Melt

被引：29
|
作者：
Vettorel, Thomas [1 ]
Reigh, Shang Yik [2 ]
Yoon, Do Y. [2 ]
Kremer, Kurt [1 ]
机构：
[1] Max Planck Inst Polymer Res, D-55128 Mainz, Germany
[2] Seoul Natl Univ, Dept Chem, Seoul 151747, South Korea
来源：
MACROMOLECULAR RAPID COMMUNICATIONS | 2009年 / 30卷 / 4-5期
关键词：
melt; Monte-Carlo simulation; relaxation; ring polymers; STATISTICS; DYNAMICS;
D O I：
10.1002/marc.200800627
中图分类号：
O63 [高分子化学（高聚物）];
学科分类号：
070305 ; 080501 ; 081704 ;
摘要：
A detailed analysis of the efficiency of a Monte-Carlo (MC) method employing non-local moves for simple lattice ring polymers is presented. While the introduction of kink-translocation moves for linear chains results in the expected speedup by a factor of the order of the number of sites, this is significantly reduced for a melt of rings.
引用
收藏
页码：345 / 351
页数：7
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