Dynamical Heterogeneities in a Supercooled Lennard-Jones Liquid

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Dynamical Heterogeneities in a Supercooled Lennard-Jones Liquid

Walter Kob,1 Claudio Donati,2 Steven J. Plimpton,3 Peter H. Poole,4 and Sharon C. Glotzer2 1Institut für Physik, Johannes Gutenberg-Universität, Staudinger Weg 7, D-55099 Mainz, Germany 2Center for Theoretical and Computational Materials Science, and Polymers Division, National Institute of Standards and Technology, Gaithersburg, Maryland 20899 3Parallel Computational Sciences Department, Sandi...

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Hopping in a supercooled Lennard-Jones liquid: metabasins, waiting time distribution, and diffusion.

We investigate the jump motion among potential energy minima of a Lennard-Jones model glass former by extensive computer simulation. From the time series of minima energies, it becomes clear that the energy landscape is organized in superstructures called metabasins. We show that diffusion can be pictured as a random walk among metabasins, and that the whole temperature dependence resides in th...

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The manner in which the intermolecular potential u(r) governs structural relaxation in liquids is a long standing problem in condensed matter physics. Herein, we show, in agreement with recent experimental results, that diffusion coefficients for simulated Lennard-Jones m-6 liquids (8 < or = m < or = 36) in normal and moderately supercooled states are a unique function of the variable rhogamma/...

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How reproducible are dynamic heterogeneities in a supercooled liquid?

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ژورنال

عنوان ژورنال: Physical Review Letters

سال: 1997

ISSN: 0031-9007,1079-7114

DOI: 10.1103/physrevlett.79.2827