A recently developed wavepacket method is applied to study the quantum dynamics of the reactions O(1D)+H2→OH+H and O(1D) +HD→OH(OD)+D(H). The abinitio based, global, 1A′ potential energy surface of Ho etal. is employed. The results of three-dimensional, total angular momentum J=0 scattering calculations are presented and discussed, with emphasis on qualitative features of the dynamics.
G. G. Balint-Kurti, A. I. Gonzalez, E. M. Goldfield and S. K. Gray, Faraday Discuss., 1998, 110, 169 DOI: 10.1039/A801712C
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