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Unraveling reaction networks behind the catalytic oxidation of methane with H(2)O(2) over a mixed-metal MIL-53(Al,Fe) MOF catalyst

Reaction paths underlying the catalytic oxidation of methane with H(2)O(2) over an Fe containing MIL-53(Al) metal–organic framework were studied by periodic DFT calculations. Not only the activation of methane, but the full reaction network was considered, which includes the formation of the active...

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Detalles Bibliográficos
Autores principales:	Szécsényi, Ágnes, Li, Guanna, Gascon, Jorge, Pidko, Evgeny A.
Formato:	Online Artículo Texto
Lenguaje:	English
Publicado:	Royal Society of Chemistry 2018
Materias:	Chemistry
Acceso en línea:	https://www.ncbi.nlm.nih.gov/pmc/articles/PMC6113888/ https://www.ncbi.nlm.nih.gov/pubmed/30310609 http://dx.doi.org/10.1039/c8sc02376j

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