One-way catalysis in a solvable lattice model
Sara Mahdavi, Yann Sakref, Olivier Rivoire

TL;DR
This paper investigates the possibility of strictly unidirectional catalysis using an exactly solvable lattice model, revealing how asymmetric transition rates can produce directional catalysis and relating it to equilibrium fluxes.
Contribution
It introduces a simple, exactly solvable lattice model that demonstrates the existence of strictly one-way catalysts and explores the mathematical relationship between asymmetry and equilibrium fluxes.
Findings
Examples of strictly one-way catalysts are provided.
A mathematical relationship between asymmetric rates and equilibrium fluxes is established.
Different catalytic mechanisms obey distinct scaling laws.
Abstract
Catalysts speed up chemical reactions with no energy input and without being transformed in the process, therefore leaving equilibrium constants unchanged. Some catalysts, however, are much more efficient at accelerating one direction of a reaction. Is it possible for catalysis to be strictly unidirectional, accelerating only one direction of a reaction? Can we observe directional catalysis by analyzing the microscopic trajectory of a single reactant undergoing conversions between a substrate and a product state? We use the framework of a simple but exactly solvable lattice model to study these questions. The model provides examples of strictly one-way catalysts and illustrates a mathematical relationship between the asymmetric transition rates that underlie directional catalysis and the symmetric transition fluxes that underlie chemical equilibrium. The degree of directionality…
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Taxonomy
TopicsSpectroscopy and Quantum Chemical Studies · Opinion Dynamics and Social Influence · Theoretical and Computational Physics
