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Detecting low-energy quasilocalized excitations in computer glasses. | LitMetric

Detecting low-energy quasilocalized excitations in computer glasses.

Phys Rev E

Institute for Theoretical Physics, University of Amsterdam, Science Park 904, 1098 XH Amsterdam, The Netherlands.

Published: October 2023

Soft, quasilocalized excitations (QLEs) are known to generically emerge in a broad class of disordered solids and to govern many facets of the physics of glasses, from wave attenuation to plastic instabilities. In view of this key role of QLEs, shedding light upon several open questions in glass physics depends on the availability of computational tools that allow one to study QLEs' statistical mechanics. The latter is a formidable task since harmonic analyses are typically contaminated by hybridizations of QLEs with phononic excitations at low frequencies, obscuring a clear picture of QLEs' abundance, typical frequencies, and other important micromechanical properties. Here we present an efficient algorithm to detect the field of quasilocalized excitations in structural computer glasses. The algorithm introduced takes a computer-glass sample as input and outputs a library of QLEs embedded in that sample. We demonstrate the power of the algorithm by reporting the spectrum of glassy excitations in two-dimensional computer glasses featuring a huge range of mechanical stability, which is inaccessible using conventional harmonic analyses due to phonon hybridizations. Future applications are discussed.

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Source
http://dx.doi.org/10.1103/PhysRevE.108.044124DOI Listing

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