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Monte-carlo method for simulations of ring polymers in the melt.

作者信息

Vettorel Thomas, Reigh Shang Yik, Yoon Do Y, Kremer Kurt

机构信息

Max Planck Institute for Polymer Research, 10 Ackermannweg, 55128 Mainz, Germany.

出版信息

Macromol Rapid Commun. 2009 Feb 18;30(4-5):345-51. doi: 10.1002/marc.200800627. Epub 2008 Dec 23.

Abstract

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.

摘要

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