Chinese Chemical Letters · 2021 · 45 citations · 59 references
Natural SciencesChemistryMaterials ScienceComputational ChemistryElectrochemistryMaterials ChemistryCatalytic MaterialsElectrochemical CellsElectrode MaterialsNanocatalysisOxidation-reduction ReactionsSurface PhysicsChemical Reduction MechanismsComputational Prediction ModelsElectrocatalyst DesignElectrocatalystsElectrocatalytic NanomaterialsElectrocatalytic Surface ReactionsNitrogen Reduction Reaction
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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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