Collinear hydrogen atom transfer probabilities, O+HBr→OH+Br
- 1 January 1973
- journal article
- Published by AIP Publishing in The Journal of Chemical Physics
- Vol. 58 (1) , 232-236
- https://doi.org/10.1063/1.1678911
Abstract
Quantum mechanical calculations of a collinear model of the reaction O+HBr → OH+Br have been performed using a semiempiricalpotential energy surface. At thermal energies this simple model predicts OH to be produced in its ground state and first excited state with population ratios 0.4 to 0.6, giving a moderate inversion over a considerable range of reactant kinetic energy.Keywords
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