Mixed hierarchical local structure in a disordered metal–organic framework

The structures of amorphous MOFs are challenging to characterise. Here the authors use electron microscopy and pair distribution function methods, coupled with a polymerisation-based algorithm to determine the atomic structure of Fe-BTC, demonstrating the power of this computational approach.

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Autores principales:	Adam F. Sapnik, Irene Bechis, Sean M. Collins, Duncan N. Johnstone, Giorgio Divitini, Andrew J. Smith, Philip A. Chater, Matthew A. Addicoat, Timothy Johnson, David A. Keen, Kim E. Jelfs, Thomas D. Bennett
Formato:	article
Lenguaje:	EN
Publicado:	Nature Portfolio 2021
Materias:	Science Q
Acceso en línea:	https://doaj.org/article/54151337285c432a92704f51dfb2d1df
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spelling	oai:doaj.org-article:54151337285c432a92704f51dfb2d1df2021-12-02T14:37:28ZMixed hierarchical local structure in a disordered metal–organic framework10.1038/s41467-021-22218-92041-1723https://doaj.org/article/54151337285c432a92704f51dfb2d1df2021-04-01T00:00:00Zhttps://doi.org/10.1038/s41467-021-22218-9https://doaj.org/toc/2041-1723The structures of amorphous MOFs are challenging to characterise. Here the authors use electron microscopy and pair distribution function methods, coupled with a polymerisation-based algorithm to determine the atomic structure of Fe-BTC, demonstrating the power of this computational approach.Adam F. SapnikIrene BechisSean M. CollinsDuncan N. JohnstoneGiorgio DivitiniAndrew J. SmithPhilip A. ChaterMatthew A. AddicoatTimothy JohnsonDavid A. KeenKim E. JelfsThomas D. BennettNature PortfolioarticleScienceQENNature Communications, Vol 12, Iss 1, Pp 1-12 (2021)
institution	DOAJ
collection	DOAJ
language	EN
topic	Science Q
spellingShingle	Science Q Adam F. Sapnik Irene Bechis Sean M. Collins Duncan N. Johnstone Giorgio Divitini Andrew J. Smith Philip A. Chater Matthew A. Addicoat Timothy Johnson David A. Keen Kim E. Jelfs Thomas D. Bennett Mixed hierarchical local structure in a disordered metal–organic framework
description	The structures of amorphous MOFs are challenging to characterise. Here the authors use electron microscopy and pair distribution function methods, coupled with a polymerisation-based algorithm to determine the atomic structure of Fe-BTC, demonstrating the power of this computational approach.
format	article
author	Adam F. Sapnik Irene Bechis Sean M. Collins Duncan N. Johnstone Giorgio Divitini Andrew J. Smith Philip A. Chater Matthew A. Addicoat Timothy Johnson David A. Keen Kim E. Jelfs Thomas D. Bennett
author_facet	Adam F. Sapnik Irene Bechis Sean M. Collins Duncan N. Johnstone Giorgio Divitini Andrew J. Smith Philip A. Chater Matthew A. Addicoat Timothy Johnson David A. Keen Kim E. Jelfs Thomas D. Bennett
author_sort	Adam F. Sapnik
title	Mixed hierarchical local structure in a disordered metal–organic framework
title_short	Mixed hierarchical local structure in a disordered metal–organic framework
title_full	Mixed hierarchical local structure in a disordered metal–organic framework
title_fullStr	Mixed hierarchical local structure in a disordered metal–organic framework
title_full_unstemmed	Mixed hierarchical local structure in a disordered metal–organic framework
title_sort	mixed hierarchical local structure in a disordered metal–organic framework
publisher	Nature Portfolio
publishDate	2021
url	https://doaj.org/article/54151337285c432a92704f51dfb2d1df
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Mixed hierarchical local structure in a disordered metal–organic framework

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