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Localization, Disorder, and Entropy in a Coarse-Grained Model of the Amorphous Solid

We study the role of disorder in producing the metastable states in which the extent of mass localization is intermediate between that of a liquid and a crystal with long-range order. We estimate the corresponding entropy with the coarse-grained description of a many-particle system used in the clas...

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Detalles Bibliográficos
Autores principales: Leishangthem, Premkumar, Ahmad, Faizyab, Das, Shankar P.
Formato: Online Artículo Texto
Lenguaje:English
Publicado: MDPI 2021
Materias:
Acceso en línea:https://www.ncbi.nlm.nih.gov/pmc/articles/PMC8468715/
https://www.ncbi.nlm.nih.gov/pubmed/34573796
http://dx.doi.org/10.3390/e23091171
Descripción
Sumario:We study the role of disorder in producing the metastable states in which the extent of mass localization is intermediate between that of a liquid and a crystal with long-range order. We estimate the corresponding entropy with the coarse-grained description of a many-particle system used in the classical density functional model. We demonstrate that intermediate localization of the particles results in a change of the entropy from what is obtained from a microscopic approach using for sharply localized vibrational modes following a Debye distribution. An additional contribution is included in the density of vibrational states [Formula: see text] to account for this excess entropy. A corresponding peak in [Formula: see text] / [Formula: see text] vs. frequency [Formula: see text] matches the characteristic boson peak seen in amorphous solids. In the present work, we also compare the shear modulus for the inhomogeneous solid having localized density profiles with the corresponding elastic response for the uniform liquid in the limit of high frequencies.