Chem · 2022 · 358 citations · 61 references
Natural SciencesChemistryMaterials ScienceMagnetic MaterialsNanomaterialsNanotechnologyCatalytic MaterialsCluster ChemistryMagnetic NanomaterialsSpintronic MaterialsSpintronicsSurface Functionalization Of NanomaterialsIron-catalyzed OxidationNanocluster ChemistryNoble Metal NanoclustersOxygen Reduction CatalystsOxygen Reduction ReactionSpin State EvolutionSpin State TransitionsSpin-state Energetics
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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
Natural Sciences, Chemistry, Physics +16
<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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