Surface Science · 2014 · 10 citations · 25 references
EngineeringPhysicsSurface ChemistryNatural SciencesSurface ScienceApplied PhysicsCondensed Matter PhysicsRepulsive ContributionsChemisorptionPhysical ChemistryAdsorptionChemistryAdsorbate–adsorbate InteractionsPolar Adsorbates
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Projector augmented-wave method
Peter E. Blöchl · Physical review. B, Condensed matter · 1994 · 87.4K citations
Special points for Brillouin-zone integrations
Hendrik J. Monkhorst, J.D. Pack · Physical review. B, Solid state · 1976 · 68.3K citations