most citedHydrogen on graphene: Electronic structure, total energy, structural distortions, and magnetism from first-principles calculations

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cond-mat.mtrl-sci2007★ 861 cited

Hydrogen on graphene: Electronic structure, total energy, structural distortions, and magnetism from first-principles calculations

D. W. Boukhvalov, M. I. Katsnelson, A. I. Lichtenstein

Density functional calculations of electronic structure, total energy, structural distortions, and magnetism for hydrogenated single-layer, bilayer, and multi-layer graphene are pe…