Graphene on Ir(111): Physisorption with chemical modulation

The non-local van der Waals density functional (vdW-DF) approach is applied to calculate the binding of graphene to Ir(111). The precise agreement of the calculated mean height h = 3.41 Å of the C atoms with their mean height h = (3.38 \pm 0.04) Å as measured by the X-ray standing wave (XSW) techniq...

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Veröffentlicht in:	arXiv.org 2011-06
Hauptverfasser:	Busse, Carsten, Lazić, Predrag, Rabie Djemour, Coraux, Johann, Gerber, Timm, Atodiresei, Nicolae, Caciuc, Vasile, Brako, Radovan, N'Diaye, Alpha T, Blügel, Stefan, Zegenhagen, Jörg, Michely, Thomas
Format:	Artikel
Sprache:	eng
Schlagworte:	Covalent bonds Graphene Mathematical analysis Organic chemistry Physics - Materials Science Standing waves Substrates Unit cell
Online-Zugang:	Volltext
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