✦ LIBER ✦

A dynamical theory of nonadiabatic proton and hydrogen atom transfer reaction rates in solution

✍ Scribed by Daniel C. Borgis; Sangyoub Lee; James T. Hynes

Publisher: Elsevier Science
Year: 1989
Tongue: English
Weight: 627 KB
Volume: 162
Category: Article
ISSN: 0009-2614
DOI: 10.1016/0009-2614(89)85059-6

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✦ Synopsis

A dynamical theory for the rate constant k of hydrogen atom and proton transfer reactions in solution is presented for the nonadiabatic limit, where reaction is dominated by tunneling. Coupling and splitting fluctuation effects arising from intramolecular vibrational and solvent fluctuations are included in the description. Limiting regime analytic results fork are presented for high and low temperature and for weak and strong salvation. Differences between proton and hydrogen atom transfers are indicated, as are the contrasts with electron transfer rates.

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