THERMAL RATE-CONSTANT FOR H+CH3-]CH4 RECOMBINATION - COMPARISON OF QUASICLASSICAL TRAJECTORY AND VARIATIONAL TRANSITION-STATE THEORY

被引：85

作者：

HASE, WL

DUCHOVIC, RJ

机构：

来源：

JOURNAL OF CHEMICAL PHYSICS | 1985年 / 83卷 / 07期

关键词：

D O I：

10.1063/1.449149

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

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页码：3448 / 3453

页数：6

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共 34 条

[21] THEORETICAL TREATMENT ON BEHAVIOR OF HYDROGEN-BONDED PROTON IN MALONALDEHYDE
KATO, S
KATO, H
FUKUI, K
[J]. JOURNAL OF THE AMERICAN CHEMICAL SOCIETY, 1977, 99 (03) : 684 - 691
[22] NEW TUNNELING PATH FOR REACTIONS SUCH AS H+H2-]H2+H
MARCUS, RA
COLTRIN, ME
[J]. JOURNAL OF CHEMICAL PHYSICS, 1977, 67 (06) : 2609 - 2613
[23] THE KINETICS OF THE RECOMBINATION OF METHYL RADICALS AND IODINE ATOMS
MARCUS, RA
RICE, OK
[J]. JOURNAL OF PHYSICAL AND COLLOID CHEMISTRY, 1951, 55 (06) : 894 - 908
[24] REACTION-PATH HAMILTONIAN FOR POLYATOMIC-MOLECULES
MILLER, WH
HANDY, NC
ADAMS, JE
[J]. JOURNAL OF CHEMICAL PHYSICS, 1980, 72 (01) : 99 - 112
[25] MOROKUMA K, 1981, POTENTIAL ENERGY SUR, P243
[26] TWO-DIMENSIONAL HINDERED INTERNAL ROTATIONS IN ACTIVATED COMPLEXES OF THE FORM XH2
PACEY, PD
WAGNER, BD
[J]. JOURNAL OF CHEMICAL PHYSICS, 1984, 80 (04) : 1477 - 1481
[27] PARTICIPATION OF TWO-DIMENSIONAL HINDERED INTERNAL ROTATIONS IN ACTIVATED COMPLEXES
PACEY, PD
[J]. JOURNAL OF CHEMICAL PHYSICS, 1982, 77 (07) : 3540 - 3550
[28] QUANTITATIVE COMPARISON BETWEEN DETAILED (STATE SELECTED) RELATIVE RATE DATA AND AVERAGED (THERMAL) ABSOLUTE RATE DATA FOR COMPLEX-FORMING REACTIONS
QUACK, M
[J]. JOURNAL OF PHYSICAL CHEMISTRY, 1979, 83 (01) : 150 - 158
[29] SPECIFIC RATE CONSTANTS OF UNIMOLECULAR PROCESSES .2. ADIABATIC CHANNEL MODEL
QUACK, M
TROE, J
[J]. BERICHTE DER BUNSEN-GESELLSCHAFT-PHYSICAL CHEMISTRY CHEMICAL PHYSICS, 1974, 78 (03): : 240 - 252
[30] VARIATIONAL TRANSITION-STATE THEORY CALCULATIONS FOR AN ATOM-RADICAL REACTION WITH NO SADDLE-POINT - O+OH
RAI, SN
TRUHLAR, DG
[J]. JOURNAL OF CHEMICAL PHYSICS, 1983, 79 (12) : 6046 - 6059

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