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Some applications of the transition state method to the calculation of reaction velocities, especially in solution
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This article is published in Transactions of The Faraday Society.The article was published on 1935-01-01. It has received 1414 citations till now.read more
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Brownian motion in a field of force and the diffusion model of chemical reactions
TL;DR: In this article, a particle which is caught in a potential hole and which, through the shuttling action of Brownian motion, can escape over a potential barrier yields a suitable model for elucidating the applicability of the transition state method for calculating the rate of chemical reactions.
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Reaction-rate theory: fifty years after Kramers
TL;DR: In this paper, the authors report, extend, and interpret much of our current understanding relating to theories of noise-activated escape, for which many of the notable contributions are originating from the communities both of physics and of physical chemistry.
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Implicit Solvation Models: Equilibria, Structure, Spectra, and Dynamics.
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Current status of transition-state theory
TL;DR: In this article, the authors present an overview of the current status of transition-state theory and its generalizations, including recent improvements in available methodology for calculations on complex systems, including the interface with electronic structure theory, progress in the theory and application of transitionstate theory to condensed-phase reactions, and insight into the relation of transition state theory to accurate quantum dynamics.
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Variational Transition State Theory
TL;DR: In this article, a more reliable transition state theory that has many of the advantages of conventional TST can also be formulated, and it can be applied to practical problems with an effort that is much closer to that required for conventional transition-state theory than to the effort required for quantal dynamics calculations.