most citedAb Initio Free Energy Surfaces for Coupled Ion-Electron Transfer

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Ab Initio Free Energy Surfaces for Coupled Ion-Electron Transfer

Ethan Abraham, Martin Z. Bazant, Troy Van Voorhis

Although coupled ion-electron transfer (CIET) has emerged as a powerful framework to rationalize the kinetics of Faradaic reactions, its mechanism has lacked a fully microscopic, f…

physics.chem-ph2026

Resolving the Marcus-Rehm-Weller Paradox in Electron Transfer

Ethan Abraham

Marcus theory famously predicts that electron-transfer rates decrease once the thermodynamic driving force exceeds the reorganization energy. Yet many systems instead exhibit Rehm-…