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

T Vettorel, SY Reigh, DY Yoon… - Macromolecular rapid …, 2009 - Wiley Online Library
T Vettorel, SY Reigh, DY Yoon, K Kremer
Macromolecular rapid communications, 2009Wiley Online Library
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.
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.
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