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Updated: Sep 6, 2025

Multiscale Sampling of a Heterogeneous Water/Metal Catalyst Interface using Density Functional Theory and Force-Field Molecular Dynamics
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Multiscale Sampling of a Heterogeneous Water/Metal Catalyst Interface using Density Functional Theory and Force-Field Molecular Dynamics

Published on: April 12, 2019

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Bridging scales between solid mechanics and surface chemistry

Fabien Amiot1

  • 1FEMTO-ST Institute, CNRS-UMR 6174/UBFC, 24 chemin de l'Épitaphe, 25030, Besançon, France. fabien.amiot@femto-st.fr.

Scientific Reports
|June 23, 2022
PubMed

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