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Atomistic simulation of sulfur mustard adsorption on graphene and graphene oxide: Conformational, structural, and

Ali Khanlarkhani1

  • 1Department of Nanotechnology and Advanced Materials, Materials and Energy Research Center, P.O. Box, Karaj, 31787-316, Iran. a.khanlarkhani@merc.ac.ir.

Journal of Molecular Modeling
|June 24, 2026
PubMed
Abstract

Keywords:
Adsorption behaviourConformational dynamicsGraphene oxideMolecular dynamicsSulfur mustard

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