Effect of bending potential on calculated product-state distributions for the reaction H+D2 → HD+D
- 1 March 1985
- journal article
- research article
- Published by AIP Publishing in The Journal of Chemical Physics
- Vol. 82 (5) , 2300-2304
- https://doi.org/10.1063/1.448325
Abstract
We have calculated trajectories for H+D2 → HD+D using two potential energy surfaces that are identical for collinear geometries but differ for bent geometries. Weakening the bend potential has a negligible effect on the shape of the opacity function and product vibrational distribution but shifts the final rotational distribution upwards.Keywords
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