Experimental and modelling study of the recombination reaction H+O2(+ M) →HO2(+ M) between 300 and 900 K, 1.5 and 950 bar, and in the bath gases M = He, Ar, and N2

被引:90
作者
Fernandes, R. X. [1 ]
Luther, K. [1 ]
Troe, J. [1 ]
Ushakov, V. G. [1 ]
机构
[1] Univ Gottingen, Inst Phys Chem, D-37077 Gottingen, Germany
关键词
D O I
10.1039/b804553d
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
The recombination reaction H + O-2 (+ M)-HO2 (+ M) was studied by laser. ash photolysis in a high pressure flow cell, over the temperature range 300-900 K, the pressure range 1.5-950 bar and in the bath gases M = He and N-2. Earlier experiments by Hahn et al. ( Phys. Chem. Chem. Phys. 2004, 6, 1997) in the bath gas M = Ar were also extended. The data were analyzed in terms of unimolecular rate theory employing new calculations of relevant molecular parameters. Improved energy transfer parameters for the bath gases M = He, Ar, N-2, and H2O could thus be obtained and complete fallo. curves were constructed. In the case of water, the high pressure rates well connect with pulse radiolysis results obtained in supercritical water by Janik et al.
引用
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页码:4313 / 4321
页数:9
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