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Issue 14, 2013
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Inverse design of simple pairwise interactions with low-coordinated 3D lattice ground states

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Abstract

We demonstrate that inverse statistical mechanical optimization can be used to discover simple (e.g., short-range, isotropic, and convex-repulsive) pairwise interparticle potentials with three-dimensional diamond or simple cubic lattice ground states over a wide range of densities.

Graphical abstract: Inverse design of simple pairwise interactions with low-coordinated 3D lattice ground states

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Article information


Submitted
04 Dec 2012
Accepted
13 Feb 2013
First published
26 Feb 2013

Soft Matter, 2013,9, 3866-3870
Article type
Paper

Inverse design of simple pairwise interactions with low-coordinated 3D lattice ground states

A. Jain, J. R. Errington and T. M. Truskett, Soft Matter, 2013, 9, 3866
DOI: 10.1039/C3SM27785B

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