Literature DB >> 20866814

Aging effects manifested in the potential-energy landscape of a model glass former.

Christian Rehwald1, Nicoletta Gnan, Andreas Heuer, Thomas Schrøder, Jeppe C Dyre, Gregor Diezemann.   

Abstract

We present molecular dynamics simulations of the binary Kob-Andersen Lennard-Jones model, a model glass former, and consider the distributions of inherent energies and metabasins during aging. In addition to the typical protocol of performing a temperature jump from a high temperature to a low destination temperature, we consider the temporal evolution of the energy distributions after an "up-jump," i.e., from a low to a high temperature. In this case, for times on the order of the relaxation time the distribution of metabasin energies exhibits a transient two-peak structure for a small system (65 particles). For a large system (1000 particles) no such two-peak structure appears because it is averaged out. The simulations show, however, that a clear signal of an intermediate two-peak structure survives in the thermodynamic limit, namely that the inherent energy distribution width goes through a maximum at intermediate times for temperature up jumps; no such maximum is found for temperature down jumps. These findings are qualitatively rationalized in terms of a simple trap model with a Gaussian distribution of energies, assuming that the liquid may be divided into non-interacting regions each of which is described by a trap model.

Year:  2010        PMID: 20866814     DOI: 10.1103/PhysRevE.82.021503

Source DB:  PubMed          Journal:  Phys Rev E Stat Nonlin Soft Matter Phys        ISSN: 1539-3755


  3 in total

1.  Structural relaxation and crystallization in supercooled water from 170 to 260 K.

Authors:  Loni Kringle; Wyatt A Thornley; Bruce D Kay; Greg A Kimmel
Journal:  Proc Natl Acad Sci U S A       Date:  2021-04-06       Impact factor: 11.205

2.  Energy landscape-driven non-equilibrium evolution of inherent structure in disordered material.

Authors:  Yue Fan; Takuya Iwashita; Takeshi Egami
Journal:  Nat Commun       Date:  2017-05-19       Impact factor: 14.919

3.  Rejuvenation in Deep Thermal Cycling of a Generic Model Glass: A Study of Per-Particle Energy Distribution.

Authors:  Marian Bruns; Fathollah Varnik
Journal:  Materials (Basel)       Date:  2022-01-22       Impact factor: 3.623

  3 in total

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