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Fracture toughness of a metal–organic framework glass

Theany To, Søren S. Sørensen, Malwina Stepniewska, Ang Qiao, Lars R. Jensen, Mathieu Bauchy, Yuanzheng Yue and Morten M. Smedskjaer ()
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Theany To: Aalborg University
Søren S. Sørensen: Aalborg University
Malwina Stepniewska: Aalborg University
Ang Qiao: Aalborg University
Lars R. Jensen: Aalborg University
Mathieu Bauchy: University of California
Yuanzheng Yue: Aalborg University
Morten M. Smedskjaer: Aalborg University

Nature Communications, 2020, vol. 11, issue 1, 1-9

Abstract: Abstract Metal-organic framework glasses feature unique thermal, structural, and chemical properties compared to traditional metallic, organic, and oxide glasses. So far, there is a lack of knowledge of their mechanical properties, especially toughness and strength, owing to the challenge in preparing large bulk glass samples for mechanical testing. However, a recently developed melting method enables fabrication of large bulk glass samples (>25 mm3) from zeolitic imidazolate frameworks. Here, fracture toughness (KIc) of a representative glass, namely ZIF-62 glass (Zn(C3H3N2)1.75(C7H5N2)0.25), is measured using single-edge precracked beam method and simulated using reactive molecular dynamics. KIc is determined to be ~0.1 MPa m0.5, which is even lower than that of brittle oxide glasses due to the preferential breakage of the weak coordinative bonds (Zn-N). The glass is found to exhibit an anomalous brittle-to-ductile transition behavior, considering its low fracture surface energy despite similar Poisson’s ratio to that of many ductile metallic and organic glasses.

Date: 2020
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DOI: 10.1038/s41467-020-16382-7

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