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Updated: Jul 7, 2026

Multiscale Sampling of a Heterogeneous Water/Metal Catalyst Interface using Density Functional Theory and Force-Field Molecular Dynamics
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Published on: April 12, 2019

Hydrogen bonding, H-D exchange, and molecular mobility in thin water films on TiO2(110)

Nikolay G Petrik1, Greg A Kimmel

  • 1Chemical and Materials Sciences Division, Pacific Northwest National Laboratory, Richland, WA 99352, USA.

Physical Review Letters
|February 1, 2008
PubMed

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