4.5 Article Proceedings Paper

Finite-size effects in silica: a landscape perspective

Journal

JOURNAL OF PHYSICS-CONDENSED MATTER
Volume 19, Issue 20, Pages -

Publisher

IOP PUBLISHING LTD
DOI: 10.1088/0953-8984/19/20/205143

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Finite-size effects are analysed for the well-known BKS model of silica. Results are presented for thermodynamic as well as dynamic observables which play a key role in the analysis of the potential energy landscape. It turns out that, for the analysed temperature range (T >= 3000 K), a system with only N = 99 particles does not display significant finite-size effects in thermodynamic observables. In agreement with previous work, one observes finite-size effects for the dynamics. However, after rescaling of time the finite-size effects nearly disappear. These results suggest that for BKS-silica a system with only N = 99 particles is sufficiently large to study important properties of structural relaxation in the temperature range considered.

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