Surface Science · 1996 · 128 citations · 81 references
Natural SciencesMaterials SciencePhysicsCrystal StructureSurface ChemistrySurface ScienceHydrogen AtomPotential Energy SurfacesSurface Chemistry Of SolidsSurface CrystallographySurface EnergeticsSurface PhysicsDangling Bond DefectsDiamond Nitrogen-vacancy CentersElectronic Structure AnalysisSurface Atomic StructureSurface Electronic StructureSurface Reconstruction EffectsSurface Structure DeterminationSurface Substructure Analysis
81
Self-Consistent Equations Including Exchange and Correlation Effects
W. Kohn, L. J. Sham · Physical Review · 1965 · 63.2K citations · Full text
<i>Ab initio</i>molecular dynamics for liquid metals
Georg Kresse, J. Häfner · Physical review. B, Condensed matter · 1993 · 44.9K citations
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