A MONTE-CARLO METHOD FOR DETERMINING FREE-ENERGY DIFFERENCES AND TRANSITION-STATE THEORY RATE CONSTANTS

被引：94

作者：

VOTER, AF

机构：

来源：

JOURNAL OF CHEMICAL PHYSICS | 1985年 / 82卷 / 04期

关键词：

D O I：

10.1063/1.448373

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：

引用

页码：1890 / 1899

页数：10

共 50 条

[1] FREE-ENERGY SURFACES AND TRANSITION-STATE THEORY
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[J]. JOURNAL OF CHEMICAL EDUCATION, 1977, 54 (05) : 288 - 291
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