Divergence of Voronoi cell anisotropy vector: A threshold-free characterization of local structure in amorphous materials

Rieser JM, Goodrich CP, Liu AJ, Durian DJ. 2016. Divergence of Voronoi cell anisotropy vector: A threshold-free characterization of local structure in amorphous materials. Physical Review Letters. 116(8), 088001.

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Journal Article | Published | English
Author
Rieser, Jennifer M.; Goodrich, Carl PeterIST Austria ; Liu, Andrea J.; Durian, Douglas J.
Abstract
Characterizing structural inhomogeneity is an essential step in understanding the mechanical response of amorphous materials. We introduce a threshold-free measure based on the field of vectors pointing from the center of each particle to the centroid of the Voronoi cell in which the particle resides. These vectors tend to point in toward regions of high free volume and away from regions of low free volume, reminiscent of sinks and sources in a vector field. We compute the local divergence of these vectors, where positive values correspond to overpacked regions and negative values identify underpacked regions within the material. Distributions of this divergence are nearly Gaussian with zero mean, allowing for structural characterization using only the moments of the distribution. We explore how the standard deviation and skewness vary with the packing fraction for simulations of bidisperse systems and find a kink in these moments that coincides with the jamming transition.
Publishing Year
Date Published
2016-02-23
Journal Title
Physical Review Letters
Volume
116
Issue
8
Article Number
088001
IST-REx-ID

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Rieser JM, Goodrich CP, Liu AJ, Durian DJ. Divergence of Voronoi cell anisotropy vector: A threshold-free characterization of local structure in amorphous materials. Physical Review Letters. 2016;116(8). doi:10.1103/physrevlett.116.088001
Rieser, J. M., Goodrich, C. P., Liu, A. J., & Durian, D. J. (2016). Divergence of Voronoi cell anisotropy vector: A threshold-free characterization of local structure in amorphous materials. Physical Review Letters. American Physical Society. https://doi.org/10.1103/physrevlett.116.088001
Rieser, Jennifer M., Carl Peter Goodrich, Andrea J. Liu, and Douglas J. Durian. “Divergence of Voronoi Cell Anisotropy Vector: A Threshold-Free Characterization of Local Structure in Amorphous Materials.” Physical Review Letters. American Physical Society, 2016. https://doi.org/10.1103/physrevlett.116.088001.
J. M. Rieser, C. P. Goodrich, A. J. Liu, and D. J. Durian, “Divergence of Voronoi cell anisotropy vector: A threshold-free characterization of local structure in amorphous materials,” Physical Review Letters, vol. 116, no. 8. American Physical Society, 2016.
Rieser JM, Goodrich CP, Liu AJ, Durian DJ. 2016. Divergence of Voronoi cell anisotropy vector: A threshold-free characterization of local structure in amorphous materials. Physical Review Letters. 116(8), 088001.
Rieser, Jennifer M., et al. “Divergence of Voronoi Cell Anisotropy Vector: A Threshold-Free Characterization of Local Structure in Amorphous Materials.” Physical Review Letters, vol. 116, no. 8, 088001, American Physical Society, 2016, doi:10.1103/physrevlett.116.088001.

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