physica status solidi (b) · 1975 · 480 citations · 21 references
Natural SciencesMaterials SciencePhysicsCondensed Matter PhysicsSemiconductor MaterialsSolid State PhysicsAb Initio MethodsDensity Functional TheoryElectronic Band StructureElectronic Structure Of SolidsBand Structure CalculationBand TheoryDiamond SemiconductorsTight-binding ApproximationTight-binding ModelsTight-binding TheoryValence BandValence Band Structure
Abstract Using the tight‐binding method, the valence band structures and densities of states for C, Si, Ge, GaAs, and ZnSe are calculated. Very good agreement is obtained with other calculations when all nearest‐ and one second‐nearest‐neighbor interactions are included. The effects of the various interactions on the density of states are discussed.
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Simplified LCAO Method for the Periodic Potential Problem
J. C. Slater, G. F. Koster · Physical Review · 1954 · 5.2K citations