Fast generation of spectrally shaped disorder
- 1. Courant Institute of Mathematical Sciences, New York University, New York 10003, USA
- 2. Center for Soft Matter Research, Department of Physics, New York University, New York 10003, USA
- 3. Simons Center for Computational Physical Chemistry, Department of Chemistry, New York University, New York 10003, USA
Description
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 nonuniform fast Fourier transform, thus arriving at an algorithm capable of generating systems with arbitrary spectral properties, with a computational cost that scales 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 () and () and demonstrate the flexibility of the approach by generating structures with designed spectral features at scale. By an Ewald sphere construction we link the spectral and optical properties at the single-scattering level and show that stealthy hyperuniform structures generically display transmission gaps, providing a concrete example of fine-tuning of a physical property. We also show that large power-law hyperuniformity in particle packings leads to single-scattering properties nearly identical to those of simple hard spheres. Finally, we demonstrate generalizations of the approach to impose features in either continuous or discrete real space, using constraints in either continuous or discrete reciprocal space. In particular, enforcing large spectral power at peaks with the right symmetry leads to the nondeterministic generation of quasicrystalline structures in and . This technique should become an essential tool to embed, and understand the role of, long-range correlations in disordered metamaterials.
Additional details
Identifiers
- DOI
- 10.1103/PhysRevE.110.034122;
- arXiv
- arXiv:2305.15693;
Publishing Information
- Journal Title
- Physical Review E
- Journal Volume
- 110
- Journal Issue
- 3
- Journal Page Range
- 19 pgs.
- ISSN
- 1089-3787
INIS
- Country of Publication
- United States
- Country of Input or Organization
- International Atomic Energy Agency (IAEA)
- Subject category
- S97: MATHEMATICAL METHODS AND COMPUTING; S71: CLASSICAL AND QUANTUM MECHANICS, GENERAL PHYSICS;
- Descriptors DEI
- ALGORITHMS; CONFIGURATION; CORRELATIONS; FLEXIBILITY; FOURIER TRANSFORMATION; INTERACTIONS; LIMITING VALUES; METAMATERIALS; OPTICAL PROPERTIES; PEAKS; SCATTERING; SPACE; SPHERES; SYMMETRY; TRANSPORT THEORY; TUNING
- Descriptors DEC
- INTEGRAL TRANSFORMATIONS; MATERIALS; MATHEMATICAL LOGIC; MECHANICAL PROPERTIES; PHYSICAL PROPERTIES; TENSILE PROPERTIES; TRANSFORMATIONS
Optional Information
- Copyright
- ©2024 American Physical Society
- Notes
- These authors contributed equally to this work; Contact Email: Contact author: sm7683@nyu.edu; Record automatically processed
- Funding organization
- Simons Center for Computational Physical Chemistry