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Disorder classification of the vibrational spectra of modern glasses

Zhiwen Pan, Omar Benzine, Shigeki Sawamura, Rene Limbach, Akio Koike, Thomas D. Bennett, Gerhard Wilde, Walter Schirmacher, and Lothar Wondraczek
Phys. Rev. B 104, 134106 – Published 22 October 2021
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Abstract

Using the coherent-potential approximation in heterogeneous-elasticity theory with a log-normal distribution of elastic constants for the description of the Raman spectrum and the temperature dependence of the specific heat, we are able to reconstruct the vibrational density of states and characteristic descriptors of the elastic heterogeneity of a wide range of glassy materials. These descriptors are the nonaffine contribution to the shear modulus, the mean-square fluctuation of the local elasticity, and its correlation length. They enable a physical classification scheme for disorder in modern, industrially relevant glass materials. We apply our procedure to a broad range of real-world glass compositions, including metallic, oxide, chalcogenide, hybrid, and polymer glasses. Universal relationships between the descriptors on the one side, and the height and frequency position of the boson peak, the Poisson ratio and the liquid fragility index on the other side are established.

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  • Received 16 August 2021
  • Revised 27 September 2021
  • Accepted 29 September 2021

DOI:https://doi.org/10.1103/PhysRevB.104.134106

Published by the American Physical Society under the terms of the Creative Commons Attribution 4.0 International license. Further distribution of this work must maintain attribution to the author(s) and the published article's title, journal citation, and DOI.

Published by the American Physical Society

Physics Subject Headings (PhySH)

Condensed Matter, Materials & Applied Physics

Authors & Affiliations

Zhiwen Pan1, Omar Benzine1, Shigeki Sawamura2, Rene Limbach1, Akio Koike2, Thomas D. Bennett3, Gerhard Wilde4, Walter Schirmacher5,6, and Lothar Wondraczek1,7,*

  • 1Otto Schott Institute of Materials Research, University of Jena, 07743 Jena, Germany
  • 2Materials Integration Laboratories, AGC Inc., Yokohama, Kanagawa 230-0045 Japan
  • 3Department of Materials Science and Metallurgy, University of Cambridge, Charles Babbage Road, Cambridge, CB3 0FS, United Kingdom
  • 4Institute of Materials Physics, University of Münster, 48149 Münster, Germany
  • 5Institute of Physics, University of Mainz, 55099 Mainz, Germany
  • 6Center for Life Nano Science @Sapienza, Istituto Italiano di Tecnologia, I-00161 Roma, Italy
  • 7Abbe Center of Photonics, University of Jena, 07745 Jena, Germany

  • *lothar.wondraczek@uni-jena.de

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Issue

Vol. 104, Iss. 13 — 1 October 2021

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