PARABOLIC TUNNELING CALCULATIONS

被引：202

作者：

SKODJE, RT

TRUHLAR, DG

机构：

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

[2] UNIV MINNESOTA,PROGRAM CHEM PHYS,MINNEAPOLIS,MN 55455

来源：

JOURNAL OF PHYSICAL CHEMISTRY | 1981年 / 85卷 / 06期

关键词：

D O I：

10.1021/j150606a003

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：624 / 628

页数：5

共 24 条

[1]

[Anonymous], 1966, GAS PHASE REACTION R

[2] THE TUNNEL EFFECT CORRECTION FOR PARABOLIC POTENTIAL BARRIERS [J].

BELL, RP .

TRANSACTIONS OF THE FARADAY SOCIETY, 1959, 55 (01) :1-4

[3] The penetration of a potential barrier by electrons [J].

Eckart, C .

PHYSICAL REVIEW, 1930, 35 (11) :1303-1309

[4] ACCURACY OF TUNNELING CORRECTIONS TO TRANSITION-STATE THEORY FOR THERMAL RATE CONSTANTS OF ATOM TRANSFER-REACTIONS [J].

GARRETT, BC ;

TRUHLAR, DG .

JOURNAL OF PHYSICAL CHEMISTRY, 1979, 83 (01) :200-203

[5] 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

[6]

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

[7] 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

[8] 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

[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] COMPARISON OF VARIATIONAL TRANSITION-STATE THEORY AND THE UNIFIED STATISTICAL-MODEL WITH VIBRATIONALLY ADIABATIC TRANSMISSION COEFFICIENTS TO ACCURATE COLLINEAR RATE CONSTANTS FOR T+HD-]TH+D [J].

GARRETT, BC ;

TRUHLAR, DG ;

GREV, RS ;

WALKER, RB .

JOURNAL OF CHEMICAL PHYSICS, 1980, 73 (01) :235-240

← 1 2 3 →