Quasi-classical dynamics and vibrational kinetics of N+N2(ν) system

被引:90
作者
Esposito, F [1 ]
Capitelli, M [1 ]
Gorse, C [1 ]
机构
[1] Univ Bari, CNR, Ctr Studi Chim Plasmi, Dipartimento Chim, I-70126 Bari, Italy
关键词
D O I
10.1016/S0301-0104(00)00155-5
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
Vibrational-translational (V-T) energy transfer and dissociation cross-sections of collisions of nitrogen atoms with rovibrationally excited nitrogen molecules are calculated by a quasi-classical dynamical approach. The results, relative to the whole set of vibrational states and interpolated on rotation, including quasi-bound levels, are used in a kinetic scheme for studying the global rate of dissociation. The kinetic model, which solves a system of 68 vibrational levels submitted to the action of V-T and dissociation processes, reveals some distortions in the resulting vibrational distribution function for nu > 40. The calculated global dissociation rate is in good agreement with the experimental results in a wide temperature range. (C) 2000 Elsevier Science B.V. All rights reserved.
引用
收藏
页码:193 / 202
页数:10
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