Dynamics of association and decay. A model study of Cl−+Cl2 ⇄ Cl−*3 using quasiclassical trajectories
- 1 March 1983
- journal article
- research article
- Published by AIP Publishing in The Journal of Chemical Physics
- Vol. 78 (5), 2394-2401
- https://doi.org/10.1063/1.445041
Abstract
Quasiclassical trajectories on a model potential‐energy surface have been used to study Cl−+Cl2 ⇄ [Cl−3]*. Rate coefficients are reported for both the forward and backward processes. Decay rate constants as a function of energy and thermal rate coefficients for forming [Cl−3]* complexes that live for a given number of inner turning points in the Cl−+Cl2 relative motion are reported.Keywords
This publication has 21 references indexed in Scilit:
- Dynamics of ion–molecule recombination. II. An alkali ion and a water moleculeThe Journal of Chemical Physics, 1982
- Ion–molecule reactions of Cl2 with Cl− and F−The Journal of Chemical Physics, 1982
- Dynamics of ion solvation. Li++H2O→Li+(H2O)*The Journal of Chemical Physics, 1981
- Negative ion-molecule reactions in sulfuryl halidesJournal of the American Chemical Society, 1979
- Kinetics and thermodynamics of ion-molecule association reactions of water, hydrogen sulfide, and benzene. Comments on intermolecular entropy effectsJournal of the American Chemical Society, 1979
- Ion Thermochemistry and Solvation From Gas Phase Ion EquilibriaAnnual Review of Physical Chemistry, 1977
- A calculation of the electronic states of the trihalide anionsMolecular Physics, 1977
- Theoretical study of the O(1D) + H2(1Σg+) reactive quenching processMolecular Physics, 1976
- Quasiclassical selection of initial coordinates and momenta for a rotating Morse oscillatorThe Journal of Chemical Physics, 1975
- Capture Collisions between Ions and Polar MoleculesThe Journal of Chemical Physics, 1967