Vibrational-rotational energy transfer in H2-H2 collisions II.: The relative roles of the initial rotational excitation of both diatoms

被引:12
作者
Zenevich, VA
Billing, GD [1 ]
Jolicard, G
机构
[1] Univ Copenhagen, Dept Chem, HC Orsted Inst, DK-2100 Copenhagen, Denmark
[2] CNRS, UPREA 6091, Astrophys Lab, Observ Besancon, F-25010 Besancon, France
关键词
D O I
10.1016/S0009-2614(99)00975-6
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
A recently proposed [J. Chem. Phys. 111 (1999) 2401] new semi-classical decoupling procedure for rotational projection states in ro-vibrationally inelastic atom-diatom and diatom-diatom collisions is extended and applied to inelastic collisions in molecular hydrogen. The role of initial rotational excitation of both collision partners in the ro-vibrational transitions, attached to the vibrational (10 --> 00) transition in para-H-2, is analyzed in detail. The computed vibrational self-relaxation rate constant for para-H-2, is in a good quantitative agreement (within a factor of 2) with experimental data over the whole experimentally investigated temperature range, 50-3000 K. (C) 1999 Elsevier Science B.V. All rights reserved.
引用
收藏
页码:530 / 535
页数:6
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