The chemical kinetics and dynamics of the prototypical reaction:: OH+H2→H2O+H

被引:39
作者
Smith, IWM [1 ]
Crim, FF
机构
[1] Univ Birmingham, Sch Chem Sci, Birmingham B15 2TT, W Midlands, England
[2] Univ Wisconsin, Dept Chem, Madison, WI 53706 USA
关键词
D O I
10.1039/b200985b
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
During the last decade, in studies of bimolecular reaction dynamics by both experimentalists and theoreticians, there has been increasing emphasis on reactions beyond the three-atom case, traditionally represented by A + BC --> AB + C. As part of this progress, four-atom reactions of the type AB + CD --> ABC + D have attracted much attention. Within this class of reactions, for both theoretical and experimental reasons, the system: OH + H-2 reversible arrow H2O + H has emerged as a prototype. In reactions involving four atoms, this reaction now occupies the place held by the H + H-2 --> H-2 + H and F + H-2 reversible arrow HF + H reactions amongst three-atom reactions. In this article, we review the experimental data for the kinetics and reaction dynamics that are available for the forward and reverse reactions, OH + H-2 reversible arrow H2O + H and compare these results with the current state of theory for this prototypical system. We also suggest future experimental and theoretical studies that are needed to bring our understanding of this reactive system to the level of that for the H-3 and FH2 systems.
引用
收藏
页码:3543 / 3551
页数:9
相关论文
共 63 条
[1]   INTEGRAL RATE-CONSTANT MEASUREMENTS OF THE REACTION H+D2O-]HD(V',J')+OD [J].
ADELMAN, DE ;
FILSETH, SV ;
ZARE, RN .
JOURNAL OF CHEMICAL PHYSICS, 1993, 98 (06) :4636-4643
[2]   The dynamics of the reaction OH+D-2->HOD+D: Crossed beam experiments and quantum mechanical scattering calculations on ab initio potential energy surfaces [J].
Alagia, M ;
Balucani, N ;
Casavecchia, P ;
Stranges, D ;
Volpi, GG ;
Clary, DC ;
Kliesch, A ;
Werner, HJ .
CHEMICAL PHYSICS, 1996, 207 (2-3) :389-409
[3]   CROSSED BEAM STUDIES OF 4-ATOM REACTIONS - THE DYNAMICS OF OH+D2 [J].
ALAGIA, M ;
BALUCANI, N ;
CASAVECCHIA, P ;
STRANGES, D ;
VOLPI, GG .
JOURNAL OF CHEMICAL PHYSICS, 1993, 98 (03) :2459-2462
[4]   Rate coefficients for the reaction and relaxation of H2O in specific vibrational states with H atoms and H2O [J].
Barnes, PW ;
Sharkey, P ;
Sims, IR ;
Smith, IWM .
FARADAY DISCUSSIONS, 1999, 113 :167-180
[5]   The branching ratio between reaction and relaxation in the removal of H2O from its |04⟩- vibrational state in collisions with H atoms [J].
Barnes, PW ;
Sims, IR ;
Smith, IWM ;
Lendvay, G ;
Schatz, GC .
JOURNAL OF CHEMICAL PHYSICS, 2001, 115 (10) :4586-4592
[6]   Ab initio potential energy surface for the reactions between H2O and H [J].
Bettens, RPA ;
Collins, MA ;
Jordan, MJT ;
Zhang, DH .
JOURNAL OF CHEMICAL PHYSICS, 2000, 112 (23) :10162-10172
[7]   BOND-SPECIFIC CHEMISTRY - OD-OH PRODUCT RATIOS FOR THE REACTIONS H+HOD(100) AND H+HOD(001) [J].
BRONIKOWSKI, MJ ;
SIMPSON, WR ;
GIRARD, B ;
ZARE, RN .
JOURNAL OF CHEMICAL PHYSICS, 1991, 95 (11) :8647-8648
[8]   COMPARISON OF REAGENT STRETCH VS BEND EXCITATION IN THE H+D2O REACTION - AN EXAMPLE OF MODE-SELECTIVE CHEMISTRY [J].
BRONIKOWSKI, MJ ;
SIMPSON, WR ;
ZARE, RN .
JOURNAL OF PHYSICAL CHEMISTRY, 1993, 97 (10) :2204-2208
[9]   EFFECT OF REAGENT VIBRATION ON THE H+HOD REACTION - AN EXAMPLE OF BOND-SPECIFIC CHEMISTRY [J].
BRONIKOWSKI, MJ ;
SIMPSON, WR ;
ZARE, RN .
JOURNAL OF PHYSICAL CHEMISTRY, 1993, 97 (10) :2194-2203
[10]   The H+H2O→OH+H2 reaction:: OH state-resolved differential cross-sections and H2 internal energy disposals [J].
Brouard, M ;
Burak, I ;
Markillie, GAJ ;
McGrath, K ;
Vallance, C .
CHEMICAL PHYSICS LETTERS, 1997, 281 (1-3) :97-104