| Gibbs Ensemble Monte-Carlo方法及其应用 |
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| 引用本文： | 王克纲,SIEPMANN I. Gibbs Ensemble Monte-Carlo方法及其应用[J]. 计算物理, 2000, 17(4): 455-458 |
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| 作者姓名： | 王克纲 SIEPMANN I |
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| 作者单位： | 1. 北京理工大学应用物理系，北京 100081 University of Minnesota,Minnesota,USA
2. University of Minnesota,Minnesota,USA |
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| 摘 要： | 介绍一种新的且非常实用的Ｇｉｂｂｓ Ｅｎｓｅｍｂｌｅ Ｍｏｎｔｅ－Ｃａｒｌｏ模拟技术。并给出模拟甲烷和氟甲烷混合物的液体－液体相图以及Ｌｅｎｎａｒｄ－Ｊｏｎｅｓ混合物相图。将模拟的相图与实验得出的相图进行了对比。
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| 关 键 词： | Monte－Carlo模拟 相图 有机混合物 |
| 文章编号： | 1001-246X(2000)04-0455-04 |
| 修稿时间： | 1998-07-20 |
GIBBS ENSEMBLE MONTE-CARLO SIMULATION AND ITS APPLICATION |
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| SIEPMANN I. GIBBS ENSEMBLE MONTE-CARLO SIMULATION AND ITS APPLICATION[J]. Chinese Journal of Computational Physics, 2000, 17(4): 455-458 |
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| Authors: | SIEPMANN I |
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| Abstract: | It introduces a Gibbs Ensemble Monte-Carlo method,which was recently invented.This method has been applied for studying the phase diagrams of Lennard-Jones mixtures,and Methane and Tetrafluoromethane.The obtained results of simulations are in good agreement with experimental and previous results. |
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| Keywords: | Monte-Carlo simulation phase diagram organic mixtures |
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