Chemical Engineering Journal · 2023 · 25 citations · 57 references
Natural SciencesChemical EngineeringChemistryCatalysisIndustrial ChemistryReaction EngineeringCatalyst DesignCatalyst PreparationCatalyst SynthesisCatalytic MaterialsCatalytic Reaction EngineeringSupported CatalystsCatalytic Air Pollution ControlEnvironmental CatalysisFormaldehydePlatinum Compounds
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Efficient pseudopotentials for plane-wave calculations
N. Troullier, José Luı́s Martins · Physical review. B, Condensed matter · 1991 · 16.1K citations
Natural Sciences, Chemistry, Physics +14
The SIESTA method for<i>ab initio</i>order-<i>N</i>materials simulation
José M. Soler, Emilio Artacho, Julian D. Gale et al. · Journal of Physics Condensed Matter · 2002 · 11.8K citations · Full text
Natural Sciences, Chemistry, Physics +17
Single-atom catalysis of CO oxidation using Pt1/FeOx
Botao Qiao, Aiqin Wang, Xiaofeng Yang et al. · Nature Chemistry · 2011 · 7.3K citations
The Activated Complex in Chemical Reactions
Henry Eyring · The Journal of Chemical Physics · 1935 · 5.7K citations
Single-Atom Catalysts: A New Frontier in Heterogeneous Catalysis
Xiao-Feng Yang, Aiqin Wang, Botao Qiao et al. · Accounts of Chemical Research · 2013 · 4.7K citations
Natural Sciences, Chemical Engineering, Materials Science +17