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In Situ Neutron Diffraction of Zn-MOF-74 Reveals Nanoconfinement-Induced Effects on Adsorbed Propene

[Image: see text] Even though confinement was identified as a common element of selective catalysis and simulations predicted enhanced properties of adsorbates within microporous materials, experimental results on the characterization of the adsorbed phase are still rare. In this study, we provide e...

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Detalles Bibliográficos
Autores principales: Gäumann, Patrick, Ferri, Davide, Sheptyakov, Denis, van Bokhoven, Jeroen A., Rzepka, Przemyslaw, Ranocchiari, Marco
Formato: Online Artículo Texto
Lenguaje:English
Publicado: American Chemical Society 2023
Acceso en línea:https://www.ncbi.nlm.nih.gov/pmc/articles/PMC10461295/
https://www.ncbi.nlm.nih.gov/pubmed/37646009
http://dx.doi.org/10.1021/acs.jpcc.3c03225
Descripción
Sumario:[Image: see text] Even though confinement was identified as a common element of selective catalysis and simulations predicted enhanced properties of adsorbates within microporous materials, experimental results on the characterization of the adsorbed phase are still rare. In this study, we provide experimental evidence of the increase of propene density in the channels of Zn-MOF-74 by 16(2)% compared to the liquid phase. The ordered propene molecules adsorbed within the pores of the MOF have been localized by in situ neutron powder diffraction, and the results are supported by adsorption studies. The formation of a second adsorbate layer, paired with nanoconfinement-induced short intermolecular distances, causes the efficient packing of the propene molecules and results in an increase of olefin density.