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The Transition State in a Noisy Environment

Thomas Bartsch·Rigoberto Hernandez·T. Uzer
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Abstract

Transition State Theory overestimates reaction rates in solution because conventional dividing surfaces between reagents and products are crossed many times by the same reactive trajectory. We describe a recipe for constructing a time-dependent dividing surface free of such recrossings in the presence of noise. The no-recrossing limit of Transition State Theory thus becomes generally available for the description of reactions in a fluctuating environment.

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Thomas Bartsch, Rigoberto Hernandez, T. Uzer. 2005-06-09. The Transition State in a Noisy Environment. https://doi.org/10.1103/physrevlett.95.058301

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