A computational and experimental approach linking disorder, high-pressure behaviour and mechanical properties in UiO Frameworks

  • Stephen Moggach (Creator)

Dataset

Description

##Files:##

* Datashare.zip: First principles ab-initio output filed for UiO-abdc and UiO-67.
* cifs.zip: crystallographic data for both UiO-67 and UiO-abdc.
* FINALUIODATA.xlsx: Unit cell dimensions and compression.

Abstract

Data underlying the publication: C. L. Hobday, R. J. Marshall, C. F. Murphie, J. Sotelo, T. Richards, D. R. Allan, T. Düren, F.-X. Coudert, R. S. Forgan, C. A. Morrison, S. A. Moggach, T. D. Bennett, Angew. Chem. Int. Ed. 2016, 55, 2401.

Data Citation

University of Edinburgh, School of Chemisty. (2016). A computational and experimental approach linking disorder, high-pressure behaviour and mechanical properties in UiO Frameworks, [dataset]. http://dx.doi.org/10.7488/ds/369.
Date made available9 Dec 2015
PublisherEdinburgh DataShare

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