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Toward a Unified Theory of Catalysis

2025/05/02 by Frank Nelson Crespilho, Crespilho, Frank Nelson
Chemical Engineering · #Catalysis and Oxidation Reactions #Chemical Physics (physics.chem-ph) #FOS: Physical sciences

paper · pdf · doi:10.48550/arxiv.2505.01213

openalex publication_date 2025/05/02 · openalex created_date 2025/10/10 · openalex updated_date 2026/07/28

Abstract

Catalysis lies at the heart of chemical reactivity, yet its foundational principles remain fragmented across the distinct domains of homogeneous, heterogeneous, and enzymatic systems Here, we propose a unifying theoretical model that integrates spatial and temporal dimensions into a single framework, offering a cohesive understanding of catalytic activity across diverse materials and conditions. This model builds upon established kinetic theories, incorporating local site density distributions, time-dependent modulations, and intrinsic reaction rates to deliver a comprehensive description of catalytic performance. By applying this approach, we demonstrate how seemingly disparate catalytic processes, from molecular complexes and single-atom catalysts to complex enzyme systems, can be interpreted through shared physical and chemical principles.

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