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Identification of the active sites and mechanism for partial methane oxidation to methanol over copper-exchanged CHA zeolites

Yu Mao, P. Hu

2020Science China Chemistry33 citationsDOI

Topics & Concepts

ChemistryMethaneAb initioMethanolCatalysisvan der Waals forceDensity functional theoryZeoliteAnaerobic oxidation of methanePartial oxidationComputational chemistryActive siteCopperReaction mechanismMolecular dynamicsPhysical chemistryMoleculeOrganic chemistryCatalytic Processes in Materials ScienceCatalysis and Oxidation ReactionsMetal-Organic Frameworks: Synthesis and Applications
Identification of the active sites and mechanism for partial methane oxidation to methanol over copper-exchanged CHA zeolites | Litcius