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October 1, 1981The Journal of Chemical Physics

The generalized resonating valence bond method: Barrier heights in the HF + D and HCl + D exchange reactions

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Abstract

A method of self-consistent optimization of a resonating wave fuction is developed and applied to the reaction HF+D?H+FD. (AIP)

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Cite This Study

Voter et al. (1981) studied this question.

synapsesocial.com/papers/6a9840d055a55e94cce36d58 https://doi.org/10.1063/1.442436

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Synapse has enriched 5 closely related papers on similar clinical questions. Consider them for comparative context:

1Accurate characterization of the transition state geometry for the HF+H′→H+H′F reactionOriginal Research · 1977 · 45 citations
2Kinetic study of H+HF(v=3): Kinetic isotope effect and temperature dependenceOriginal Research · 1978 · 22 citations
3An accurate three-dimensional potential energy surface for H3Original Research · 1978 · 780 citations
4A survey of reactions involving H',H'', and chlorine atomsOriginal Research · 1979 · 52 citations
5The barriers for abstraction and exchange in H+HClOriginal Research · 1977 · 31 citations