Applied Surface Science · 2023 · 32 citations · 43 references
Natural SciencesChemical EngineeringChemistryCatalysisSurface ChemistrySurface ScienceCatalyst CharacterizationCatalytic MaterialsCatalytic Reaction EngineeringCatalytic Reaction KineticsSurface CatalysisSurface ReactionsCatalyst Surface EngineeringCatalyst Surface KineticsCatalyst Surface StructureCatalyst SurfacesCatalytic Surface KineticsCatalytic Surface ReactionsReaction Condition OptimizationSurface Decomposition Reactions
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Generalized Gradient Approximation Made Simple
John P. Perdew, Kieron Burke, Matthias Ernzerhof · Physical Review Letters · 1996 · 211.5K citations · Full text
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Projector augmented-wave method
Peter E. Blöchl · Physical review. B, Condensed matter · 1994 · 90.8K citations
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