English

Fast Generation of Spectrally-Shaped Disorder

Statistical Mechanics 2024-09-19 v2 Materials Science Computational Physics Optics

Abstract

Media with correlated disorder display unexpected transport properties, but it is still a challenge to design structures with desired spectral features at scale. In this work, we introduce an optimal formulation of this inverse problem by means of the non-uniform fast Fourier transform, thus arriving at an algorithm capable of generating systems with arbitrary spectral properties, with a computational cost that scales O(NlogN)O(N \log N) with system size. The method is extended to accommodate arbitrary real-space interactions, such as short-range repulsion, to simultaneously control short- and long-range correlations. We thus generate the largest-ever stealthy hyperuniform configurations in 2d2d (N=109N = 10^9) and 3d3d (N>107N > 10^7). By an Ewald sphere construction we link the spectral and optical properties at the single-scattering level, and show that these structures in 2d2d and 3d3d generically display transmission gaps, providing a concrete example of fine-tuning of a physical property at will. We also show that large 3d3d power-law hyperuniformity in particle packings leads to single-scattering properties near-identical to those of simple hard spheres. Finally, we show that enforcing large spectral power at a small number of peaks with the right symmetry leads to the non-deterministic generation of quasicrystalline structures in both 2d2d and 3d3d.

Keywords

Cite

@article{arxiv.2305.15693,
  title  = {Fast Generation of Spectrally-Shaped Disorder},
  author = {Aaron Shih and Mathias Casiulis and Stefano Martiniani},
  journal= {arXiv preprint arXiv:2305.15693},
  year   = {2024}
}

Comments

9 pages / 5 figures + 3 pages of appendices / 5 appendix figures + 18 pages and 12 figures in SI