English

Designing Pairwise Interactions that Stabilize Open Crystals: Truncated Square and Truncated Hexagonal Lattices

Soft Condensed Matter 2018-01-10 v1

Abstract

Using a recently introduced formulation of the ground-state inverse design problem for a targeted lattice [Pi\~neros et al., J. Chem. Phys. 144} 084502 (2016)], we discover purely repulsive and isotropic pair interactions that stabilize low-density truncated square and truncated hexagonal crystals, as well as promote their assembly in Monte Carlo simulations upon isochoric cooling from a high-temperature fluid phase. The results illustrate that the primary challenge to stabilizing very open two-dimensional lattices is to design interactions that can favor the target structure over competing stripe microphases.

Keywords

Cite

@article{arxiv.1703.08615,
  title  = {Designing Pairwise Interactions that Stabilize Open Crystals: Truncated Square and Truncated Hexagonal Lattices},
  author = {William D. Piñeros and Thomas M. Truskett},
  journal= {arXiv preprint arXiv:1703.08615},
  year   = {2018}
}

Comments

8 pages, 8 figures and supplementary material

R2 v1 2026-06-22T18:56:33.617Z