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The interaction with time-dependent external fields, especially the interplay between time-dependent driving and quantum correlations, changes the familiar picture of electron transport through nanoscale systems. Although the exact solution…

Mesoscale and Nanoscale Physics · Physics 2020-02-13 Thomas D. Honeychurch , Daniel S. Kosov

The strong-interaction limit of the Hohenberg-Kohn functional defines a multimarginal optimal transport problem with Coulomb cost. From physical arguments, the solution of this limit is expected to yield strictly-correlated particle…

Strongly Correlated Electrons · Physics 2017-02-17 Michael Seidl , Simone Di Marino , Augusto Gerolin , Luca Nenna , Klaas J. H. Giesbertz , Paola Gori-Giorgi

Exact density functionals for the exchange and correlation energies are approximated in practical calculations for the ground-state electronic structure of a many-electron system. An important exact constraint for the construction of…

Recently, Dial et al. presented measurements of the tunneling density of states into the bulk of a two dimensional electron gas under strong magnetic fields. Several high energy features appear in the measured spectrum showing a distinct…

Strongly Correlated Electrons · Physics 2015-05-20 Gilad Barak , Amir Yacoby , Yigal Meir

We analyze a decomposition of the Coulomb electron-electron interaction into a long-range and a short-range part in the framework of density functional theory, deriving some scaling relations and the corresponding virial theorem. We study…

Chemical Physics · Physics 2015-06-26 Julien Toulouse , Paola Gori-Giorgi , Andreas Savin

We train a neural network as the universal exchange-correlation functional of density-functional theory that simultaneously reproduces both the exact exchange-correlation energy and potential. This functional is extremely non-local, but…

Computational Physics · Physics 2019-10-10 Jonathan Schmidt , Carlos L. Benavides-Riveros , Miguel A. L. Marques

We study the energetic properties of finite but internally homogeneous D-dimensional electron droplets in the strict-correlation limit. The indirect Coulomb interaction is found to increase as a function of the electron number, approaching…

Strongly Correlated Electrons · Physics 2011-05-11 E. Rasanen , M. Seidl , P. Gori-Giorgi

We extend a path-integral approach to bosonization previously developed in the framework of equilibrium Quantum Field Theories, to the case in which time-dependent interactions are taken into account. In particular we consider a non…

High Energy Physics - Theory · Physics 2009-11-10 Carlos M. Naón , Mariano J. Salvay , Marta L. Trobo

For properties of interacting electron systems, Kohn-Sham (KS) theory is often favored over many-body perturbation theory (MBPT) owing to its low computational cost. However, the exact KS potential can be challenging to approximate, for…

Materials Science · Physics 2021-01-15 Jack Wetherell , Matthew Hodgson , Leopold Talirz , Rex Godby

We use Kohn-Sham spin-density-functional theory to study the statistics of ground-state spin and the spacing between conductance peaks in the Coulomb blockade regime for both 2D isolated and realistic quantum dots. We make a systematic…

Mesoscale and Nanoscale Physics · Physics 2007-05-23 Hong Jiang , Denis Ullmo , Weitao Yang , Harold U. Baranger

An instantaneous and zero-range spin-dependent interaction, derived by summing an infinite number of electron-hole ladder diagrams within a local approximation, is analyzed as a function of the electron gas density and the relative spin…

Other Condensed Matter · Physics 2007-05-23 I. A. Nechaev , I. Nagy , P. M. Echenique , E. V. Chulkov

Most approximate exchange-correlation functionals used within density functional theory are constructed as the sum of two distinct contributions for exchange and correlation. Separating the exchange component from the entire functional is…

Condensed Matter · Physics 2009-10-28 Claudia Filippi , C. J. Umrigar , Xavier Gonze

Using an end-to-end differentiable implementation of the Kohn-Sham self-consistent field equations, we obtain an accurate neural network-based exchange and correlation (XC) functional of the electronic density. The functional is optimized…

Chemical Physics · Physics 2021-06-09 Sebastian Dick , Marivi Fernandez-Serra

By extrapolating the energies of non-relativistic atoms and their ions with up to 3000 electrons within Kohn-Sham density functional theory, we find that the ionization potential remains finite and increases across a row, even as…

Materials Science · Physics 2015-05-19 Lucian A. Constantin , John C. Snyder , John P. Perdew , Kieron Burke

Due to the strongly nonlocal nature of $f_{xc}({\bf r},{\bf r}',\omega)$ the {\em scalar} exchange and correlation (xc) kernel of the time-dependent density-functional theory (TDDFT), the formula for Q the friction coefficient of an…

Materials Science · Physics 2009-11-13 V. U. Nazarov , J. M. Pitarke , Y. Takada , G. Vignale , Y. -C. Chang

Many-body interactions in effective field theories for disordered interacting electrons are considered. It is shown that three-body and higher interaction terms are generated in perturbation theory, and some of the physical consequences of…

Statistical Mechanics · Physics 2009-11-10 T. R. Kirkpatrick , D. Belitz

The reconstruction of the exchange-correlation potential from accurate ab initio electron densities can provide insights into the limitations of the currently available approximate functionals and provide guidance for devising improved…

Strongly Correlated Electrons · Physics 2013-02-05 Katharina Boguslawski , Christoph R. Jacob , Markus Reiher

In this paper, we provide a theoretical analysis of strongly interacting quantum systems confined by a time-dependent external potential in one spatial dimension. We show that such systems can be used to simulate spin chains described by…

Quantum Gases · Physics 2016-03-31 A. G. Volosniev , H. -W. Hammer , N. T. Zinner

We consider exact time-dependent analytic solutions to the Schr\"odinger equation for tunneling in one dimension with cut off wave initial conditions at $t=0$. We obtain that as soon as $t \neq 0$ the transmitted probability density at any…

Quantum Physics · Physics 2009-11-06 Gaston Garcia-Calderon , Alberto Rubio , Jorge Villavicencio

We develop a scheme for building the scalar exchange-correlation (xc) kernel of time-dependent density functional theory (TDDFT) from the tensorial kernel of time-dependent {\em current} density functional theory (TDCDFT) and the Kohn-Sham…

Materials Science · Physics 2009-11-13 V. U. Nazarov , J. M. Pitarke , Y. Takada , G. Vignale , Y. -C. Chang
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