CANONICAL UNIFIED STATISTICAL-MODEL - CLASSICAL MECHANICAL THEORY AND APPLICATIONS TO COLLINEAR REACTIONS

被引：80

作者：

GARRETT, BC ^{[1
]}

TRUHLAR, DG ^{[1
]}

机构：

[1] UNIV MINNESOTA,DEPT CHEM,MINNEAPOLIS,MN 55455

来源：

JOURNAL OF CHEMICAL PHYSICS | 1982年 / 76卷 / 04期

关键词：

D O I：

10.1063/1.443157

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：1853 / 1858

页数：6

共 37 条

[1] MILLER UNIFIED STATISTICAL-THEORY OF EXCHANGE-REACTIONS IS (ALMOST) THE MOST PROBABLE RESULT FOR THE INFORMATION GIVEN [J].

DAVIS, JP .

JOURNAL OF CHEMICAL PHYSICS, 1981, 75 (04) :2011-2012

[2] EFFECT OF CURVATURE OF REACTION PATH ON DYNAMIC EFFECTS IN ENDOTHERMIC CHEMICAL-REACTIONS AND PRODUCT ENERGIES IN EXOTHERMIC REACTIONS [J].

DUFF, JW ;

TRUHLAR, DG .

JOURNAL OF CHEMICAL PHYSICS, 1975, 62 (06) :2477-2491

[3] GENERALIZED TRANSITION-STATE THEORY CALCULATIONS FOR THE REACTIONS D+H2 AND H+D2 USING AN ACCURATE POTENTIAL-ENERGY SURFACE - EXPLANATION OF THE KINETIC ISOTOPE EFFECT [J].

GARRETT, BC ;

TRUHLAR, DG .

JOURNAL OF CHEMICAL PHYSICS, 1980, 72 (06) :3460-3471

[4] VARIATIONAL TRANSITION-STATE THEORY, VIBRATIONALLY ADIABATIC TRANSMISSION COEFFICIENTS, AND THE UNIFIED STATISTICAL-MODEL TESTED AGAINST ACCURATE QUANTAL RATE CONSTANTS FOR COLLINEAR F+H2, H+F2, AND ISOTOPIC ANALOGS [J].

GARRETT, BC ;

TRUHLAR, DG ;

GREV, RS ;

MAGNUSON, AW ;

CONNOR, JNL .

JOURNAL OF CHEMICAL PHYSICS, 1980, 73 (04) :1721-1728

[5]

GARRETT BC, 1979, J PHYS CHEM-US, V83, P3058, DOI 10.1021/j100486a600

[6] GENERALIZED TRANSITION-STATE THEORY - QUANTUM EFFECTS FOR COLLINEAR REACTIONS OF HYDROGEN MOLECULES AND ISOTOPICALLY SUBSTITUTED HYDROGEN MOLECULES [J].

GARRETT, BC ;

TRUHLAR, DG .

JOURNAL OF PHYSICAL CHEMISTRY, 1979, 83 (08) :1079-1112

[7] IMPROVED TREATMENT OF THRESHOLD CONTRIBUTIONS IN VARIATIONAL TRANSITION-STATE THEORY [J].

GARRETT, BC ;

TRUHLAR, DG ;

GREV, RS ;

MAGNUSON, AW .

JOURNAL OF PHYSICAL CHEMISTRY, 1980, 84 (13) :1730-1748

[8] GENERALIZED TRANSITION-STATE THEORY - CLASSICAL MECHANICAL THEORY AND APPLICATIONS TO COLLINEAR REACTIONS OF HYDROGEN MOLECULES [J].

GARRETT, BC ;

TRUHLAR, DG .

JOURNAL OF PHYSICAL CHEMISTRY, 1979, 83 (08) :1052-1078

[9] APPLICATION OF VARIATIONAL TRANSITION-STATE THEORY AND THE UNIFIED STATISTICAL-MODEL TO H+CI2-]HCI+CI [J].

GARRETT, BC ;

TRUHLAR, DG ;

GREV, RS .

JOURNAL OF PHYSICAL CHEMISTRY, 1980, 84 (13) :1749-1752

[10] CORRECTION [J].

GARRETT, BC .

JOURNAL OF PHYSICAL CHEMISTRY, 1980, 84 (06) :682-682

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