Semiquantal modeling of thermal vibrational relaxation of diatomic molecules

被引:4
作者
Bieniek, RJ [1 ]
Lipson, SJ [1 ]
机构
[1] PHILLIPS LAB, GEOPHYS DIRECTORATE, BEDFORD, MA 01731 USA
关键词
D O I
10.1016/S0009-2614(96)01158-X
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
Vibrationally excited molecules play an important role in the spectroscopy, energetics, and chemical behavior of a wide range of gaseous systems of scientific and applied interest. Unfortunately, many desired collisional relaxation rates have not yet been experimentally measured, and current theoretical methods are often inadequate or too cumbersome for practical application. We report a semiquantal two-parameter scaling method for predicting relaxation rates that is very simple to employ, and impressively fits the temperature and vibrational dependencies of quantum mechanical and experimental collisional relaxation rates for several diatonic molecules (e.g., N-2, HF, OH, NO) over many orders of magnitude.
引用
收藏
页码:276 / 282
页数:7
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