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Updated: Dec 9, 2025

Scanning-probe Single-electron Capacitance Spectroscopy
Published on: July 30, 2013
Spin-resolved charge displacement analysis as an intuitive tool for the evaluation of cPCET and HAT scenarios
Lorenzo D'Amore1, Leonardo Belpassi2, Johannes E M N Klein3
1IQCC and Dept. Chem., Universitat de Girona, Campus Montilivi, 17003 Girona, Spain.
Abstract:
We introduce here the spin-resolved version of the charge displacement function, which is applied to two competing pathways of proton-coupled electron transfer in oxidation catalysis (hydrogen-atom transfer, concerted proton-coupled electron transfer). The difference in charge displacement between the two mechanisms is directly observable and can be translated to electron flow using this new analysis tool.
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