Quasiclassical Trajectory study of the reaction O(3P) + HBr → OH + Br
✍ Scribed by Michael Broida; Mira Tamir; Avigdor Persky
- Publisher
- Elsevier Science
- Year
- 1986
- Tongue
- English
- Weight
- 925 KB
- Volume
- 110
- Category
- Article
- ISSN
- 0301-0104
No coin nor oath required. For personal study only.
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Energy drstrrbutions in the products of the ion-molecule reaction Cl-+ HBr -HCI + Br-have been studied using quasiclassical trajectories on a semi-empirical collinear potential energy surface. Vibrational energy is favored in the products. While some trajectories are long-lived, the kinematic factor
## Strong oscillations m the reactivity as a function of collision energy were found in collinear quasiclassical trajectory calculations for the reaction 0( 3 P)+ HCl( v = 0) + OH + Cl. Oscillations were also observed m 3D calculations for IICl( v = 0, J = 0) under the special conditions of near-z