Related papers: Nonuniform grids for Brillouin zone integration an…
The Bethe-Salpeter formalism represents the most accurate method available nowadays for computing neutral excitation energies and optical spectra of crystalline systems from first principles. Bethe-Salpeter calculations yield very good…
We propose a new curl-free and thermodynamically compatible finite volume scheme on Voronoi grids to solve compressible heat conducting flows written in first-order hyperbolic form. The approach is based on the definition of compatible…
A Cartesian grid method combined with a simplified gas kinetic scheme is presented for subsonic and supersonic viscous flow simulation on complex geometries. Under the Cartesian mesh, the computational grid points are classified into four…
Phonons are quantized vibrations of a crystal lattice that play a crucial role in understanding many properties of solids. Density functional theory (DFT) provides a state-of-the-art computational approach to lattice vibrations from…
We developed an alternative configuration of simplified Brillouin optical correlation-domain reflectometry, which can overcome the drawbacks of the original configuration. This system uses, as reference light, the light that is Fresnel…
We propose a non grid-based interpolation scheme based on the information from the data collected from the vicinity of the query point. As a non-grid-based interpolation, the data points can be distributed randomly in a small region, and…
We develop and compare several analytical approximations for the polaron problem in finite-width, non-parabolic conduction bands. The main focus of the work is an extension of the Feynman variational method to a tight-binding lattice, where…
Non-Abelian states of matter, in which the final state depends on the order of the interchanges of two quasiparticles, can encode information immune from environmental noise with the potential to provide a robust platform for topological…
The phonon dispersion of graphene on Ir(111) has been determined by means of angle-resolved inelastic electron scattering and density functional calculations. Kohn anomalies of the highest optical-phonon branches are observed at the…
Leveraging our structure-adaptive topology optimization framework based on the integration of the photonic density of states over a frequency window for the TM polarization of light [see A. Bahulikar et al., arXiv:2411.09165 (2025)], we…
We present a structure-adaptive topology optimization framework for engineering photonic band gaps with TM-polarized sources based on computation of the photonic density of states with a uniform source substituting for the standard Dirac…
We grow accustomed to the notion that optical susceptibilities can be treated as a local property of a medium. In the context of nonlinear optics, both Kerr and Raman processes are considered local, meaning that optical fields at one…
Resampling by interpolation is the traditional method to process interferograms from non-uniformly sampled Fourier transform spectrometers. The non-uniform fast Fourier transform (NUFFT) is an alternative approach that has been mostly…
Phonon dispersion is widely used to elucidate the vibrational properties of materials. As an emerging technique, momentum-resolved vibrational spectroscopy in scanning transmission electron microscopy (STEM) offers an unparalleled approach…
In this paper a general theory for interpolation methods on a rectangular grid is introduced. By the use of this theory an efficient B-spline based interpolation method for spectral codes is presented. The theory links the order of the…
The purpose of this research is to employ non-uniform arrays in different active and passive sensing applications for both narrowband and wideband operations, while providing a multitude of array processing methodologies that assist in…
We introduce the Voronoi fundamental zone octonion interpolation framework for grain boundary (GB) structure-property models and surrogates. The VFZO framework offers an advantage over other five degree-of-freedom based property…
We consider the existence of plasmons in a non-equilibrium situation where electrons from the valence band of graphene are pumped to states in the Brillouin zone around the $\mathbf{M}$-point by a high intensity UV electromagnetic field.…
We determine the anisotropic dielectric functions of rhombohedral $\alpha$-Ga$_2$O$_3$ by far-infrared and infrared generalized spectroscopic ellipsometry and derive all transverse optical and longitudinal optical phonon mode frequencies…
Based on previous work we extend a primal-dual semi-smooth Newton method for minimizing a general $L^1$-$L^2$-$TV$ functional over the space of functions of bounded variations by adaptivity in a finite element setting. For automatically…