Combining transition state theory with quasiclassical trajectory calculations: application to the nitrogen exchange reaction N+N2(v)
- 31 December 1987
- journal article
- Published by Elsevier in Chemical Physics Letters
- Vol. 140 (5) , 499-505
- https://doi.org/10.1016/0009-2614(87)80476-1
Abstract
No abstract availableKeywords
This publication has 12 references indexed in Scilit:
- The effect of reagent rotation on reaction cross sections for O(3P) + HCl → OH + Cl: a rationale for contradictory predictionsChemical Physics, 1987
- Combining transition state calculations with quasiclassical trajectory calculationsChemical Physics, 1987
- Deactivation of vibrationally excited nitrogen molecules by collision with nitrogen atomsThe Journal of Physical Chemistry, 1987
- Vibrational Kinetics, Dissociation, and Ionization of Diatomic Molecules Under Nonequilibrium ConditionsPublished by Springer Nature ,1986
- Semiclassical determination of adiabatic barriers on a three-dimensional potential energy surfaceThe Journal of Chemical Physics, 1983
- Quasiclassical trajectory studies of the H+H2 reaction on an accurate potential-energy surface. III. Comparison of rate constants and cross sections with experimentThe Journal of Chemical Physics, 1981
- Combining transition state theory with quasiclassical trajectory calculations. Part 1.—Collinear collisionsJournal of the Chemical Society, Faraday Transactions 2: Molecular and Chemical Physics, 1981
- Rate constants from Monte Carlo quasi-classical trajectory calculations. A procedure for importance samplingThe Journal of Physical Chemistry, 1979
- Importance sampling and histogrammic representations of reactivity functions and product distributions in Monte Carlo quasiclassical trajectory calculationsThe Journal of Chemical Physics, 1978
- Exchange Reactions with Activation Energy. I. Simple Barrier Potential for (H, H2)The Journal of Chemical Physics, 1965