Related papers: Localised Wannier functions in metallic systems
In this work we first discuss systematically three general approaches to construct a non-Hermitian flat band, defined by its dispersionless real part. They resort to, respectively, spontaneous restoration of non-Hermitian particle-hole…
While topology can impose obstructions to exponentially localized Wannier functions, certain topological insulators are exempt from such Wannier obstructions. The absence of the Wannier obstructions can further accompany topological…
To understand sparse systems we must account for both strong local atom bonds and weak nonlocal van der Waals forces between atoms separated by empty space. A fully nonlocal functional form [H. Rydberg, B.I. Lundqvist, D.C. Langreth, and M.…
The paper studies properties of continuous time processes with spectrum degeneracy at a single point where their Fourier transforms vanish with a certain rate. It appears that these processes are linearly predictable in some weak sense,…
In this paper we consider Wannier functions of quasi-periodic g-gap ($g\geq 1$) potentials and investigate their main properties. In particular, we discuss the problem of averaging underlying the definition of Wannier functions for both…
In [L. De Carlo and W. D. Wick, Entropy 25, 564 (2023)], we considered the problem of wavefunction ensembles for spin models. To observe magnetization at finite temperature, we had to add macroscopic nonlinear terms that suppress…
We introduce a family of area preserving generalized baker's transformations acting on the unit square and having sharp polynomial rates of mixing for Holder data. The construction is geometric, relying on the graph of a single variable…
We establish global-in-time decay estimates for the multi-phase Muskat problem in the case where the density takes exactly n+1 distinct constant values. We first linearize the system around a flat stable configuration, followed by the study…
Second-order topological insulators can be characterized by their bulk polarization, which is believed to be intrinsically connected to the center of the Wannier function. In this study, we demonstrate the existence of second-order…
The most general way to describe localized atomic-like electronic states in strongly correlated compounds is to utilize Wannier functions. In the present paper we continue the development of widely-spread DFT+U method onto Wannier function…
Transition metal dichalcogenide materials $MX_2 (M=Mo,W;X=S,Se)$ are being thoroughly studied due to their novel two-dimensional structure, that is associated with exceptional optical and transport properties. From a computational point of…
We present a computational scheme to study spin excitations in magnetic materials from first principles. The central quantity is the transverse spin susceptibility, from which the complete excitation spectrum, including single-particle…
We study the global decay properties of solutions to the linear wave equation in 1+3 dimensions on time-dependent, weakly asymptotically flat spacetimes. Assuming non-trapping of null geodesics and a local energy decay estimate, we prove…
Recent studies have theoretically investigated the atomic excitation and ionization induced by the dark matter (DM)-nucleus scattering, and it is found that the suddenly recoiled atom is much more likely to excite or lose its electrons than…
Working in the Wannier representation, we derive an expression for the orbital magnetization of a periodic insulator. The magnetization is shown to be comprised of two contributions, an obvious one associated with the internal circulation…
Optimal sampling of non band-limited functions is an issue of great importance that has attracted considerable attention. We propose to tackle this problem through the use of a frequency warping: First, by a nonlinear shrinking of…
In this paper we present calculations on the electronic band structure of a two-dimensional lateral superlattice subject to a perpendicular magnetic field by employing a projection operator technique based on the ray-group of…
The Discrete Fourier Transform (DFT) is widely utilized for signal analysis but is plagued by spectral leakage, leading to inaccuracies in signal approximation. Window functions play a crucial role in mitigating spectral leakage by…
Locally resonant metamaterials are characterized by bandgaps at wavelengths that are much larger than the lattice size, enabling low-frequency vibration attenuation. Typically, bandgap analyses and predictions rely on the assumption of…
We present x-ray photon correlation spectroscopy measurements of the atomic dynamics in a Zr67Ni33 metallic glass, well below its glass transition temperature. We find that the decay of the density fluctuations can be well described by…