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Issue 56, 2020
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Measuring and modelling mechanochemical reaction kinetics

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Abstract

Quasi-static density functional theory calculations of the rate of mechanochemical decomposition of methyl thiolate species adsorbed on Cu(100) accurately reproduce the experimental normal-stress dependent rates measured in ultrahigh vacuum by an atomic force microscopy tip. This allows precise analytical models for mechanochemical reaction kinetics to be developed.

Graphical abstract: Measuring and modelling mechanochemical reaction kinetics

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Supplementary files

Article information


Submitted
05 May 2020
Accepted
15 Jun 2020
First published
19 Jun 2020

Chem. Commun., 2020,56, 7730-7733
Article type
Communication

Measuring and modelling mechanochemical reaction kinetics

A. Boscoboinik, D. Olson, H. Adams, N. Hopper and W. T. Tysoe, Chem. Commun., 2020, 56, 7730
DOI: 10.1039/D0CC02992K

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