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Computational NMR investigation of mixed-metal (Al,Sc)-MIL-53 and its phase transitions

Compositionally complex metal–organic frameworks (MOFs) have properties that depend on local structure that is often difficult to characterise. In this paper a density functional theory (DFT) computational study of mixed-metal (Al,Sc)-MIL-53, a flexible MOF with several different forms, was used to...

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Detalles Bibliográficos
Autores principales:	Davis, Zachary H., Borthwick, Emma A. L., Morris, Russell E., Ashbrook, Sharon E.
Formato:	Online Artículo Texto
Lenguaje:	English
Publicado:	The Royal Society of Chemistry 2023
Materias:	Chemistry
Acceso en línea:	https://www.ncbi.nlm.nih.gov/pmc/articles/PMC10566452/ https://www.ncbi.nlm.nih.gov/pubmed/37767813 http://dx.doi.org/10.1039/d3cp04147f

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