MONTE CARLO COMPUTER SIMULATION OF CHAIN MOLECULES .I.

被引：335

作者：

LAL, M

机构：

[1] Unilever Research Laboratory, Port Sunlight, Birkenhead, Cheshire

来源：

MOLECULAR PHYSICS | 1969年 / 17卷 / 01期

关键词：

D O I：

10.1080/00268976900100781

中图分类号：

O64 [物理化学（理论化学）、化学物理学];

学科分类号：

070304 ; 081704 ;

摘要：

A method for carrying out ‘Monte Carlo’ calculations on chains is described. Close agreement between the present results and those of Wall et al. for chains on a two-choice, plane hexagonal lattice establishes the reliability of the present method. The calculations are extended to the chains whose segments interact in accord with a Lennard-Jones potential. © 1969 Taylor and Francis Group, LLC.

引用

页码：57 / &

共 13 条

[1]

FELLER W, 1966, INTRODUCTION PROBABI, V2

[2] CALCULATION OF CYCLIZATION PROBABILITIES AND OTHER CONFIGURATION PROPERTIES OF ALKANE-TYPE CHAINS BY A MONTE CARLO METHOD [J].