Nature Communications (Nov 2018)

Tuning the balance between dispersion and entropy to design temperature-responsive flexible metal-organic frameworks

  • J. Wieme,
  • K. Lejaeghere,
  • G. Kresse,
  • V. Van Speybroeck

DOI
https://doi.org/10.1038/s41467-018-07298-4
Journal volume & issue
Vol. 9, no. 1
pp. 1 – 10

Abstract

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Rational design of metal organic frameworks (MOFs) with shape-memory nanopores is a formidable challenge. Here the authors use an accurate theoretical approach to design thermo-responsive MOFs based on a balance of van der Waals and entropy contributions.