Random-close packing limits for monodisperse and polydisperse hard spheres

被引:151
作者
Baranau, Vasili [1 ]
Tallarek, Ulrich [1 ]
机构
[1] Univ Marburg, Dept Chem, D-35032 Marburg, Germany
关键词
STATISTICAL-MECHANICS; HYDRODYNAMIC DISPERSION; ALGORITHM; TRANSITION; DISORDER; GLASSES; LIQUIDS;
D O I
10.1039/c3sm52959b
中图分类号
O64 [物理化学(理论化学)、化学物理学];
学科分类号
070304 ; 081704 ;
摘要
We investigate how the densities of inherent structures, which we refer to as the closest jammed configurations, are distributed for packings of 10(4) frictionless hard spheres. A computational algorithm is introduced to generate closest jammed configurations and determine corresponding densities. Closest jamming densities for monodisperse packings generated with high compression rates using Lubachevsky-Stillinger and force-biased algorithms are distributed in a narrow density range from phi = 0.634-0.636 to phi approximate to 0.64; closest jamming densities for monodisperse packings generated with low compression rates converge to phi approximate to 0.65 and grow rapidly when crystallization starts with very low compression rates. We interpret phi approximate to 0.64 as the random-close packing (RCP) limit and phi approximate to 0.65 as a lower bound of the glass close packing (GCP) limit, whereas phi = 0.634-0.636 is attributed to another characteristic (lowest typical, LT) density phi(LT). The three characteristic densities phi(LT), phi(RCP), and phi(GCP) are determined for polydisperse packings with log-normal sphere radii distributions.
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页码:3826 / 3841
页数:16
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