Počet záznamů: 1  

Oxidative Dehydrogenation of Cyclohexane by Cu vs Pd Clusters: Selectivity Control by Specific Cluster Dynamics

  1. 1.
    SYSNO ASEP0523057
    Druh ASEPJ - Článek v odborném periodiku
    Zařazení RIVJ - Článek v odborném periodiku
    Poddruh JČlánek ve WOS
    NázevOxidative Dehydrogenation of Cyclohexane by Cu vs Pd Clusters: Selectivity Control by Specific Cluster Dynamics
    Tvůrce(i) Halder, A. (US)
    Ha, M.-A. (US)
    Zhai, H. (US)
    Yang, B. (US)
    Pellin, M. J. (US)
    Seifert, S. (US)
    Alexandrova, A. N. (US)
    Vajda, Štefan (UFCH-W) RID, ORCID
    Zdroj.dok.ChemCatChem. - : Wiley - ISSN 1867-3880
    Roč. 12, JAN 2020 (2020), s. 1307-1315
    Poč.str.9 s.
    Jazyk dok.eng - angličtina
    Země vyd.DE - Německo
    Klíč. slovasize ; catalysts ; reactivity ; ensemble ; ethylene ; route ; tio2 ; cluster dynamics ; cyclohexane oxidative dehydrogenation ; deposited clusters ; selectivity control ; size-selected subnanometer clusters
    Vědní obor RIVCF - Fyzikální chemie a teoretická chemie
    Obor OECDPhysical chemistry
    Způsob publikováníOpen access
    Institucionální podporaUFCH-W - RVO:61388955
    UT WOS000505076200001
    EID SCOPUS85078066446
    DOI10.1002/cctc.201901795
    AnotaceSupported subnanometer clusters can exhibit catalytic properties not observed in their bulk analogues. Partially-oxidized Pd and Cu clusters are reported to catalyze the oxidative dehydrogenation of cyclohexane with high activity, and with distinctly different selectivity, producing primarily benzene or cyclohexene, respectively. Under the appliedreaction conditions, the structure and oxidation state of the two catalysts evolve differently, which leads to either the desorption of the cyclohexene intermediate or to its deeper dehydrogenation. Under the applied reaction conditions, the initially oxidized Pd and Cu clusters undergo partial reduction, which we show to be required for the selectivity to emerge. Both systems also have thermal access to multiple distinct structural forms yielding statistical ensembles. The structures within these ensembles evolve with the changing nature of the bound reaction intermediates differently for the two metals. The evolution is found pronounced in the Cu clusters, but only modest in Pd. Ultimately, the different selectivity observed experimentally for the Cu versus Pd clusters is controlled by differences in the collective structural and redox dynamics of their ensembles.
    PracovištěÚstav fyzikální chemie J.Heyrovského
    KontaktMichaela Knapová, michaela.knapova@jh-inst.cas.cz, Tel.: 266 053 196
    Rok sběru2021
    Elektronická adresahttp://hdl.handle.net/11104/0307465
Počet záznamů: 1  

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