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Selective oxidation of methane by dinitrogen monoxide on FeZSM-5 zeolites. Ab initio quantum chemical analysis

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Abstract

On the basis of ab initio quantum chemical calculations, we propose the structure and energetics of the species taking part in the selective oxidation of methane by dinitrogen monoxide on FeZSM-5 zeolites. The immediate oxidizing site is reasonably represented by a binuclear iron-hydroxide cluster with a peroxo-like fragment located between iron atoms.

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Authors and Affiliations

  1. Federal Scientific Center, Boreskov Institute of Catalysis, Prospekt Lavrentieva, 5, 630090, Novosibirsk, Russia

    A. V. Arbuznikov & G. M. Zhidomirov

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  1. A. V. Arbuznikov
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  2. G. M. Zhidomirov
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Arbuznikov, A.V., Zhidomirov, G.M. Selective oxidation of methane by dinitrogen monoxide on FeZSM-5 zeolites. Ab initio quantum chemical analysis. Catal Lett 40, 17–23 (1996). https://doi.org/10.1007/BF00807450

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  • DOI: https://doi.org/10.1007/BF00807450

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