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Updated: Jun 29, 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

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Dissociation of H2O2 on water surfaces (ice and water droplets)

Amit Kumar1, Pradeep Kumar1

  • 1Department of Chemistry, Malaviya National Institute of Technology Jaipur, Jaipur, 302017, India. pradeep.chy@mnit.ac.in.

Physical Chemistry Chemical Physics : PCCP
|April 2, 2024
PubMed

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