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Assessing negative thermal expansion in mesoporous metal–organic frameworks by molecular simulation

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Molecular simulations reveal that mesoporous metal–organic frameworks display large volumetric negative thermal expansion, which has a considerable effect on mechanical stability, outlining an alternative application for these ultra-porous materials. Click to show full abstract

Molecular simulations reveal that mesoporous metal–organic frameworks display large volumetric negative thermal expansion, which has a considerable effect on mechanical stability, outlining an alternative application for these ultra-porous materials.

Keywords: thermal expansion; negative thermal; mesoporous metal; metal organic; organic frameworks

Journal Title: Journal of Materials Chemistry A
Year Published: 2019

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