Effect of reaction heat on Maxwellian distribution functions and rate of reactions

被引:6
作者
Kremer, Gilberto M. [1 ]
Soares, Ana Jacinta [2 ]
机构
[1] Univ Fed Parana, Dept Fis, BR-80060000 Curitiba, Parana, Brazil
[2] Univ Minho, Dept Matemat, Braga, Portugal
关键词
chemical kinetics; kinetic theory of gases and liquids;
D O I
10.1088/1742-5468/2007/12/P12003
中图分类号
O3 [力学];
学科分类号
08 ; 0801 ;
摘要
A binary gaseous mixture undergoing a reversible reaction of type A + A reversible arrow B + B is modeled with the chemical kinetic Boltzmann equation, assuming hard sphere cross sections for elastic collisions, and two different models with activation energy for reactive interactions, namely the line-of-centers and step cross-section models. The Chapman-Enskog method and Sonine polynomial representation of the distribution functions are used to obtain the solution of the Boltzmann equation in a chemical regime for which the reactive interactions are less frequent than the elastic collisions, i.e. in the early stage of the reaction when the constituent A is in a large amount with respect to B and the affinity of the reaction tends to infinity. The aim of this paper is twofold: (i) to evaluate the effect of the reaction heat on the Maxwellian distribution functions and on the production terms of both particle number densities and mixture energy density; (ii) to analyze spatially homogeneous solutions for the particle number density and temperature of the reactants when the chemical reaction advances. It is shown that the reaction heat changes the Maxwellian distribution functions, the production terms and hence the trend to equilibrium of the particle number density and temperature of the reactants. Moreover, these changes differ for exothermic and endothermic reactions.
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页数:16
相关论文
共 34 条
[1]   APPLICATION OF THE GENERALIZED CHAPMAN-ENSKOG METHOD TO THE TRANSPORT-COEFFICIENT CALCULATION IN A REACTING GAS-MIXTURE [J].
ALEXEEV, BV ;
CHIKHAOUI, A ;
GRUSHIN, IT .
PHYSICAL REVIEW E, 1994, 49 (04) :2809-2825
[2]   Effect of chemical reactions on the transport coefficients of binary mixtures [J].
Alves, GM ;
Kremer, GM .
JOURNAL OF CHEMICAL PHYSICS, 2002, 117 (05) :2205-2215
[3]  
ALVES GM, 2005, P 24 INT S RAR GAS D
[4]   VALIDITY OF MACROSCOPIC RATE-EQUATIONS IN EXOTHERMIC CHEMICAL-SYSTEMS [J].
BARAS, F ;
MANSOUR, MM .
PHYSICAL REVIEW LETTERS, 1989, 63 (21) :2429-2432
[5]  
Brilliantov N., 2004, Kinetic theory of Granular Gases
[6]  
Chapman S., 1970, The Mathematical Theory of Non-Uniform Gases, V3rd
[7]  
CHOU DP, 1982, COMBUST FLAME, V47, P215, DOI 10.1016/0010-2180(82)90102-X
[8]  
Cukrowski AS, 2006, ACTA PHYS POL B, V37, P1715
[9]  
Cukrowski AS, 2003, ACTA PHYS POL B, V34, P3607
[10]   Nonequilibrium effects on the rate of bimolecular chemical reaction in a dilute gas [J].
Cukrowski, AS ;
Fritzsche, S ;
Fort, J .
CHEMICAL PHYSICS LETTERS, 2001, 341 (5-6) :585-593