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An expression is derived within the framework of the Debye-H\"uckel approximation for the screening length of a field in a p-type semiconductor taking into account the energy spread of immobile acceptor levels and the density of states tail…

Materials Science · Physics 2014-07-21 N. A. Poklonski

Within the Dirac-Brueckner-Hartree-Fock approach, using the Bonn potentials, we investigate the properties of dense, asymmetric nuclear matter and apply it to neutron stars. In the actual calculations of the nucleon self-energies and the…

Nuclear Theory · Physics 2013-10-02 Tetsuya Katayama , Koichi Saito

We introduce a combined density functional theory (DFT) and non-equilibrium Green's function (NEGF) framework to compute the capacitance of nanocapacitors and directly extract the dielectric response of a sub-nanometer dielectric under…

We calculate the Hartree-Fock energy of a density-wave in a spin polarized two-dimensional electron gas using a short-range repulsive interaction. We find that the stable ground state for a short-range potential is always either the…

Strongly Correlated Electrons · Physics 2009-11-10 Juana Moreno , D. C. Marinescu

On this article there are presented the main results of the theory of electron phenomena in an unordered condensed matter that can be described as an inhomogeneously deformed crystalline lattice with dislocations. The one-electron effective…

Condensed Matter · Physics 2007-05-23 Ilya M. Dubrovskii

We have designed and implemented a straightforward method to deterministically measure the temperature of the selected segment of a cold atom ensemble, and we have also developed an upgrade in the form of nondestructive thermometry. The…

Atomic Physics · Physics 2020-08-19 Xin Wang , Yuan Sun , Hua-Dong Cheng , Jin-Yin Wan , Yan-Ling Meng , Ling Xiao , Liang Liu

We present a robust, ab initio method for addressing atom-light interactions and apply it to photoionization of argon. We use a close-coupling ansatz constructed on a multi-configurational Hartree-Fock description of localized states and…

Atomic Physics · Physics 2015-06-12 T. Carette , J. M. Dahlström , L. Argenti , E. Lindroth

In this work we include electron-electron interaction beyond Hartree-Fock level in our non-equilibrium Green's function approach by a crude form of GW through the Single Plasmon Pole Approximation. This is achieved by treating all…

Mesoscale and Nanoscale Physics · Physics 2016-05-02 David O. Winge , Martin Franckié , Claudio Verdozzi , Andreas Wacker , Mauro F. Pereira

We prove the decay in the energy space for the solution to the defocusing biharmonic Hartree-Fock equations with mass-supercritical and energy-subcritical Choquard-type nonlinearity in space dimension $d\geq3$. We treat both the free and…

Analysis of PDEs · Mathematics 2021-08-31 Mirko Tarulli , George Venkov

We study Density Functional Theory models for systems which are translationally invariant in some directions, such as a homogeneous 2-d slab in the 3-d space. We show how the different terms of the energy are modified and we derive reduced…

Mathematical Physics · Physics 2021-12-24 David Gontier , Salma Lahbabi , Abdallah Maichine

We investigate the thermal properties of circular semiconductor quantum dots in high magnetic fields using finite temperature Hartree-Fock techniques. We demonstrate that for a given magnetic field strength quantum dots undergo various…

Strongly Correlated Electrons · Physics 2009-11-07 D. J. Dean , J. C. Wells , M. R. Strayer

The aim of this article is to propose a mathematical model describing the electronic structure of crystals with local defects in the framework of the Thomas-Fermi-von Weizs\"acker (TFW) theory. The approach follows the same lines as that…

Mathematical Physics · Physics 2010-07-16 Eric Cancès , Virginie Ehrlacher

We consider the damped time-harmonic Galbrun's equation, which is used to model stellar oscillations. We introduce a discontinuous Galerkin finite element method (DGFEM) with $H(\operatorname{div})$-elements, which is nonconform with…

Numerical Analysis · Mathematics 2023-06-07 Martin Halla

We establish necessary and sufficient conditions for the N-representability of the universal one-electron reduced density matrix functional. Functionals satisfying these conditions are guaranteed to yield variational upper bounds on the…

Quantum Physics · Physics 2026-04-08 Jannis Erhard , Paul W. Ayers

In this paper, we study the relationship between the Dirac--Fock model and the electron-positron Hartree--Fock model. We justify the Dirac--Fock model as a variational approximation of QED when the vacuum polarization is neglected and when…

Analysis of PDEs · Mathematics 2023-01-10 Long Meng

The crucial step in density-corrected Hartree-Fock density functional theory (DC(HF)-DFT) is to decide whether the density produced by the density functional for a specific calculation is erroneous and hence should be replaced by, in this…

Chemical Physics · Physics 2023-09-20 Daniel Graf , Alex J. W. Thom

Embedded defects proposed long ago (Z-vortices and Nambu monopoles) have been successfully searched for in 3D equilibrium lattice studies within the standard model near the electroweak phase transition and the crossover (which follows it…

High Energy Physics - Phenomenology · Physics 2007-05-23 M. N. Chernodub , F. V. Gubarev , E. -M. Ilgenfritz , A. Schiller

We analyze the convergence of the electron density and relative energy with respect to a perfect crystal of a class of volume defects that are compactly contained along one direction while being of infinite extent along the other two using…

Mathematical Physics · Physics 2025-11-19 Dharamveer Kumar , Amuthan A. Ramabathiran

We compare the behavior of the finite-temperature Hartree-Fock model with that of thermal density functional theory using both ground-state and temperature-dependent approximate exchange functionals. The test system is bcc Li in the…

Materials Science · Physics 2013-11-26 Valentin V. Karasiev , Travis Sjostrom , S. B. Trickey

We provide a theory to establish the existence of nonzero solutions of perturbed Hammerstein integral equations with deviated arguments, being our main ingredient the theory of fixed point index. Our approach is fairly general and covers a…

Classical Analysis and ODEs · Mathematics 2016-03-22 Alberto Cabada , Gennaro Infante , F. Adrian F. Tojo