Computational Materials Science · 2001 · 12 citations · 20 references
Natural SciencesChemistryMaterials ScienceSemiconductor MaterialsSurface ChemistrySurface ScienceAb Initio MethodsCluster ChemistrySemiconductor InterfacesSemiconductor SurfacesSurface PhysicsSurface ReactionsAdsorption On SemiconductorsChemisorptionSurface States
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Ab initio molecular orbital theory
Warren J. Hehre · Accounts of Chemical Research · 1976 · 7.9K citations