Generating Ultradense Jammed Ellipse Packings Using Biased SWAP

Using a Lubachevsky-Stillinger-like growth algorithm combined with biased SWAP Monte Carlo and transient degrees of freedom, we generate ultradense disordered jammed ellipse packings. For all aspect ratios α, these packings exhibit significantly smaller intermediate-wavelength density fluctuations and greater local nematic order than their less-dense counterparts. The densest packings are disordered despite having packing fractions ϕ<sub>J</sub>(α) that are within less than 0.5% of that of the monodisperse-ellipse crystal [ϕ<sub>xtal</sub> = π/(2√3) ≃ 0.9069] over the range 1.2 ≲ α ≲ 1.45 and coordination numbers <i>Z</i><sub>J</sub>(α) that are within less than 0.5% of isostaticity [<i>Z</i><sub>iso</sub> = 6] over the range 1.2 ≲ α ≲ 2.6. Lower-α packings are strongly fractionated and consist of polycrystals of intermediate-size particles, with the largest and smallest particles isolated at the grain boundaries. Higher-α packings are also fractionated, but in a qualitatively different fashion; they are composed─of increasingly large locally nematic domains─reminiscent of liquid glasses.

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Publication Details

Journal
The Journal of Physical Chemistry B
Published
2024-12-31
DOI
https://doi.org/10.1021/acs.jpcb.4c06533
Citations
1
Primary Topic
Material Properties and Processing
Type
article
Field-Weighted Citation Impact
0.27

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article

Generating Ultradense Jammed Ellipse Packings Using Biased SWAP

Robert S. Hoy
1 citations
The Journal of Physical Chemistry B
Material Properties and Processing
0.27
article

Generating Ultradense Jammed Ellipse Packings Using Biased SWAP

Robert S. Hoy
article en
1 citations

Abstract

Using a Lubachevsky-Stillinger-like growth algorithm combined with biased SWAP Monte Carlo and transient degrees of freedom, we generate ultradense disordered jammed ellipse packings. For all aspect ratios α, these packings exhibit significantly smaller intermediate-wavelength density fluctuations and greater local nematic order than their less-dense counterparts. The densest packings are disordered despite having packing fractions ϕ<sub>J</sub>(α) that are within less than 0.5% of that of the monodisperse-ellipse crystal [ϕ<sub>xtal</sub> = π/(2√3) ≃ 0.9069] over the range 1.2 ≲ α ≲ 1.45 and coordination numbers <i>Z</i><sub>J</sub>(α) that are within less than 0.5% of isostaticity [<i>Z</i><sub>iso</sub> = 6] over the range 1.2 ≲ α ≲ 2.6. Lower-α packings are strongly fractionated and consist of polycrystals of intermediate-size particles, with the largest and smallest particles isolated at the grain boundaries. Higher-α packings are also fractionated, but in a qualitatively different fashion; they are composed─of increasingly large locally nematic domains─reminiscent of liquid glasses.

The Journal of Physical Chemistry BVol. 129(2)
University of South Florida (US)
National Science Foundation
Affordable and clean energy
Openalex Percentile: Top 46%
Material Properties and Processing
0.27
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Generating Ultradense Jammed Ellipse Packings Using Biased SWAP — Robert S. Hoy · The Journal of Physical Chemistry B (2024) | TGRS Research Map | TGRS