RATE CONSTANTS FOR OZONE FORMATION AND FOR ISOTOPIC EXCHANGE-REACTIONS

被引:28
|
作者
GROSS, A
BILLING, GD
机构
[1] Department of Chemistry, H.C. Ørsted Institute, University of Copenhagen
关键词
D O I
10.1016/0301-0104(93)80155-3
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
Rate constants for the formation of ozone O2+O+M-->O3+M and the isotopic substitution reactions O-16+O-18(2)-->O-16O-18+O-18, and O-18+O-16O-18-->O-18(2)+O-16 have been calculated using two different potential energy surfaces. The calculations have been carried out using a quasiclassical trajectory method in which the classical equations of motion are solved using hyperspherical coordinates for the three-body problem. The ter-molecular rate constant for the formation of ozone has been obtained from the calculated life-times of the ozone molecules formed by the O2 + O colliSionS Using a simple collision model for the O3 + M stabilization.
引用
收藏
页码:393 / 406
页数:14
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