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Research PaperResearchia:200401.08003

Does the interaction potential determine both the fragility of a liquid and the vibrational properties of its glassy state?

P. Bordat

Abstract

By performing molecular dynamics simulations of binary Lennard-Jones systems with three different potentials, we show that increase of anharmonicity and capacity for intermolecular coupling of the potential is the cause of (i) the increase of kinetic fragility and nonexponentiality in the liquid state, (ii) the Tg-scaled temperature dependence of the nonergodicity parameter determined by the vibrations at low temperatures in the glassy state. Naturally these parameters correlate with each other,...

Submitted: January 8, 2004Subjects: Physics; Condensed Matter

Description / Details

By performing molecular dynamics simulations of binary Lennard-Jones systems with three different potentials, we show that increase of anharmonicity and capacity for intermolecular coupling of the potential is the cause of (i) the increase of kinetic fragility and nonexponentiality in the liquid state, (ii) the Tg-scaled temperature dependence of the nonergodicity parameter determined by the vibrations at low temperatures in the glassy state. Naturally these parameters correlate with each other, as observed experimentally by T. Scopigno et al., Science 302, 849 (2003).


Source: arXiv:0401117v1 - http://arxiv.org/abs/cond-mat/0401117v1 PDF: https://arxiv.org/pdf/cond-mat/0401117v1 Original Link: http://arxiv.org/abs/cond-mat/0401117v1

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Submission Info
Date:
Jan 8, 2004
Topic:
Condensed Matter
Area:
Physics
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Does the interaction potential determine both the fragility of a liquid and the vibrational properties of its glassy state? | Researchia