Adsorption of dihalogen molecules on pristine graphene surface: Monte Carlo and molecular dynamics simulation studies

Berkay Sütay; Mine Yurtsever

doi:10.1007/s00894-017-3311-2

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Adsorption of dihalogen molecules on pristine graphene surface: Monte Carlo and molecular dynamics simulation studies

Berkay Sütay Mine Yurtsever

Year: 2017 Journal: Journal of Molecular Modeling Vol: 23 (5)Pages: 150-150 Publisher: Springer Science+Business Media

DOI: 10.1007/s00894-017-3311-2

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Keywords:

Graphene Adsorption Molecular dynamics Chemical physics van der Waals force Materials science Monolayer Molecule Langmuir adsorption model Bilayer graphene Physical chemistry Computational chemistry Chemistry Nanotechnology Organic chemistry

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Graphene research and applications

Physical Sciences → Materials Science → Materials Chemistry

nanoparticles nucleation surface interactions

Physical Sciences → Earth and Planetary Sciences → Atmospheric Science

Thermal properties of materials

Physical Sciences → Materials Science → Materials Chemistry

Adsorption of dihalogen molecules on pristine graphene surface: Monte Carlo and molecular dynamics simulation studies

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