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Wiley, Angewandte Chemie International Edition, 24(46), p. 4496-4499, 2007

DOI: 10.1002/anie.200700218

Wiley, Angewandte Chemie, 24(119), p. 4580-4583, 2007

DOI: 10.1002/ange.200700218

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Exceptional Negative Thermal Expansion in Isoreticular Metal–Organic Frameworks

Journal article published in 2007 by David Dubbeldam, Krista S. Walton, Donald E. Ellis, Randall Q. Snurr ORCID
This paper was not found in any repository, but could be made available legally by the author.
This paper was not found in any repository, but could be made available legally by the author.

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Abstract

Shrink when heated: A new model for flexible frameworks is used to simulate the structures and adsorption properties of isoreticular metal-organic frameworks (IRMOFs), such as IRMOF-1 (see picture; Zn silver, C cyan, H white, O red). The structural simulations suggest that the IRMOFs have negative thermal-expansion coefficients over their full temperature ranges of stability.