First-principles calculation of the graphene Dirac band on semi-infinite Ir(111)
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DOI: 10.1103/physrevb.102.195425
Abstract: We study the energy dispersion relation of the $\ensuremath{\pi}$ and ${\ensuremath{\pi}}^{*}$ bands in epitaxial monolayer graphene on a semi-infinite Ir(111) substrate by a first-principles density-functional calculation. For this purpose, we employ a realistic surface structure… read more here.
Keywords: energy; principles calculation; band; infinite 111 ... See more keywords