A thermodynamic description of the adsorption-induced structural transitions in flexible MIL-53 metal-organic framework

Abstract : We briefly review the concept of temperature-loading phase diagram that we derived from an osmotic statistical ensemble analysis of the adsorption-induced structural transitions observed in the MIL-53 family of metal-organic framework nanoporous materials. We highlight the generic nature of this diagram and comment on the occurrence of breathing transitions depending on the guest fluid, the framework functionalisation and the nature of the metal centre.
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François-Xavier Coudert, Anne Boutin, Alain H. Fuchs. A thermodynamic description of the adsorption-induced structural transitions in flexible MIL-53 metal-organic framework. Molecular Physics, Taylor & Francis, 2014, 112 (9-10), pp.1257-1261. ⟨10.1080/00268976.2014.889325⟩. ⟨hal-02116918⟩

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