期刊
SOFT MATTER
卷 9, 期 14, 页码 3866-3870出版社
ROYAL SOC CHEMISTRY
DOI: 10.1039/c3sm27785b
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资金
- Welch Foundation [F-1696]
- National Science Foundation [CBET-1065357, CHE-1012356]
- Division Of Chemistry
- Direct For Mathematical & Physical Scien [1012356] Funding Source: National Science Foundation
- Div Of Chem, Bioeng, Env, & Transp Sys
- Directorate For Engineering [1065357] Funding Source: National Science Foundation
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.
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