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The single-particle Green's function (GF) of mesoscopic structures plays a central role in mesoscopic quantum transport. The recursive GF technique is a standard tool to compute this quantity numerically, but it lacks physical transparency…

Mesoscale and Nanoscale Physics · Physics 2017-02-22 Shu-Hui Zhang , Wen Yang , Kai Chang

Following on recent experimental characterization of the transport properties of stealth hyperuniform media for electromagnetic and acoustic waves, we report here measurements at ultrasonic frequencies of the multiple scattering of waves by…

Fluid Dynamics · Physics 2023-06-29 Ludovic Alhaïtz , Jean-Marc Conoir , Tony Valier-Brasier

The family of Green's function methods based on the $GW$ approximation has gained popularity in the electronic structure theory thanks to its accuracy in weakly correlated systems combined with its cost-effectiveness. Despite this,…

Chemical Physics · Physics 2023-08-31 Antoine Marie , Pierre-François Loos

This paper introduces a new Windowed Green Function (WGF) method for the numerical integral-equation solution of problems of electromagnetic scattering by obstacles in presence of dielectric or conducting half-planes. The WGF method, which…

Computational Physics · Physics 2015-08-05 Oscar Bruno , Mark Lyon , Carlos Perez-Arancibia , Catalin Turc

Quantum Heisenberg ferromagnets with long-range interactions decayin as $1/r^p$ in one and two dimensions are investigated by means of the Green's function method. It is shown that there exists a finite-temperature phase transition in the…

Condensed Matter · Physics 2009-10-28 Hiroki Nakano , Minoru Takahashi

A remarkable consequence of the Hohenberg-Kohn theorem of density functional theory is the existence of an injective map between the electronic density and any observable of the many electron problem in an external potential. In this work,…

Disordered Systems and Neural Networks · Physics 2021-08-16 Javier Robledo Moreno , Johannes Flick , Antoine Georges

The good performance of the GW approximation for band-structure calculations in solids was long taken as a sign that the sum of self-energy diagrams is converged and that all omitted terms are small. However, with modern computational…

Materials Science · Physics 2007-05-23 Arno Schindlmayr

The Kohn-Sham orbital kinetic energy density $\tau_\sigma(\vec{r}) = \sum_{i} w_{i\sigma} \big|\nabla \psi_{i\sigma}(\vec{r}) \big|^2$ is one fundamental quantity for constructing meta-generalized gradient approximations (meta-GGA) for use…

Materials Science · Physics 2015-06-23 Lin-Hui Ye

We investigate the dynamical self-energy corrections of the electron-hole plasma due to electron-electron and electron-phonon interactions at the band edges of a quasi-one dimensional (1D) photoexcited electron-hole plasma. The…

Mesoscale and Nanoscale Physics · Physics 2009-10-31 E. H. Hwang , S. Das Sarma

Quantization of electrodynamics in curved space-time in the Lorenz gauge and with arbitrary gauge parameter makes it necessary to study Green functions of non-minimal operators with variable coefficients. Starting from the integral…

Mathematical Physics · Physics 2007-05-23 Giuseppe Bimonte , Enrico Calloni , Luciano Di Fiore , Giampiero Esposito , Leopoldo Milano , Luigi Rosa

We study the spectral function of the homogeneous electron gas using many-body perturbation theory and the cumulant expansion. We compute the angle-resolved spectral function based on the GW approximation and the `GW plus cumulant'…

Materials Science · Physics 2016-11-23 Fabio Caruso , Feliciano Giustino

There has been considerable interest in properties of condensed matter at finite temperature, including non-equilibrium behavior and extreme conditions up to the warm dense matter regime. Such behavior is encountered, e.g., in experimental…

Materials Science · Physics 2021-07-28 Tun S. Tan , J. J. Kas , J. J. Rehr

The Gaussian wavefunctional approach is developed in thermofield dynamics. We manufacture thermal vacuum wavefunctional, its creation as well as annihilation operators,and accordingly thermo-particle excited states. For a (D+1)-dimensional…

High Energy Physics - Theory · Physics 2008-11-26 Wen-Fa Lu

We model a Kohn-Sham potential with a discontinuity at integer particle numbers derived from the GLLB approximation of Gritsenko et al. We evaluate the Kohn-Sham gap and the discontinuity to obtain the quasiparticle gap. This allows us to…

Materials Science · Physics 2013-05-29 M. Kuisma , J. Ojanen , J. Enkovaara , T. T. Rantala

We present an extension of the quasiparticle self-consistent $GW$ approximation (QS$GW$) [Phys. Rev. B, 76 165106 (2007)] to include vertex corrections in the screened Coulomb interaction $W$. This is achieved by solving the Bethe-Salpeter…

Materials Science · Physics 2023-10-11 Brian Cunningham , Myrta Grüning , Dimitar Pashov , Mark van Schilfgaarde

This paper proposes and analyzes a class of new weak Galerkin (WG) finite element methods for 2- and 3-dimensional linear elasticity problems. The methods use discontinuous piecewise-polynomial approximations of degrees $k(\geq 0)$ for the…

Numerical Analysis · Mathematics 2017-10-24 Gang Chen , Xiaoping Xie

We present a nontrivial model system of interacting electrons that can be solved analytically in the GW approximation. We obtain the particle number from the GW Green's function strictly analytically, and prove that there is a genuine…

Materials Science · Physics 2008-02-03 Arno Schindlmayr

A highly sensitive and selective CO2 gas sensor is presented based on a subwavelength grating (SWG) slot waveguide. Polyhexamethylene biguanide (PHMB) as a functional material fills the slot gap as well as the space between the silicon…

Optics · Physics 2026-05-11 S. Hadi Badri

For fast and accurate calculations of band gaps of solids, we present an {\it ab initio} method that extends the density functional theory plus on-site Hubbard interaction (DFT+$U$) to include inter-site Hubbard interaction ($V$). This…

Materials Science · Physics 2021-01-14 Sang-Hoon Lee , Young-Woo Son

The $GW$ approximation has recently gained increasing attention as a viable method for the computation of deep core-level binding energies as measured by X-ray photoelectron spectroscopy (XPS). We present a comprehensive benchmark study of…

Chemical Physics · Physics 2022-06-14 Jiachen Li , Ye Jin , Patrick Rinke , Weitao Yang , Dorothea Golze