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Several semilocal exchange potentials usually employed in the framework of density-functional theory (DFT) are tested and compared with their exact counterpart, the exchange Optimized Effective Potential (OEP), as applied to the…

Strongly Correlated Electrons · Physics 2022-03-14 C. M. Horowitz , C. R. Proetto , J. M. Pitarke

We present a practical and accurate density functional for the exchange-correlation energy of electrons in two dimensions. The exchange part is based on a recent two-dimensional generalized-gradient approximation derived by considering the…

Strongly Correlated Electrons · Physics 2010-06-30 E. Rasanen , S. Pittalis , J. G. Vilhena , M. A. L. Marques

Aiming to remedy the incorrect asymptotic behavior of conventional semilocal exchange-correlation (XC) density functionals for finite systems, we propose an asymptotic correction scheme, wherein an exchange density functional whose…

Chemical Physics · Physics 2013-05-17 Chi-Ruei Pan , Po-Tung Fang , Jeng-Da Chai

We proposed a formally exact, probabilistic method to assess the validity of the Thomas-Fermi potential for three-dimensional condensed matter systems where electron dynamics is constrained to the Fermi surface. Our method, which relies on…

Materials Science · Physics 2024-06-25 Gionni Marchetti

We present a new class of non-adiabatic approximations in time-dependent density functional theory derived from an exact expression for the time-dependent exchange-correlation potential. The approximations reproduce dynamical step and peak…

Chemical Physics · Physics 2018-12-21 Lionel Lacombe , Neepa T. Maitra

The exchange effect and the magneto-plasmon mode dispersion are studied theoretically for an anisotropic two-dimensional electronic system in the presence of an uniform perpendicular magnetic field. Employing an effective low-energy model…

Mesoscale and Nanoscale Physics · Physics 2016-11-23 Xiaoguang Wu

Bounds on the exchange-correlation energy of many-electron systems are derived and tested. By using universal scaling properties of the electron-electron interaction, we obtain the exponent of the bounds in three, two, one, and quasi-one…

Strongly Correlated Electrons · Physics 2009-05-21 E. Rasanen , S. Pittalis , K. Capelle , C. R. Proetto

We improve the Berezin-Li-Yau inequality in dimension two by adding a positive correction term to its right-hand side. It is also shown that the asymptotical behaviour of the correction term is almost optimal. This improves a previous…

Spectral Theory · Mathematics 2010-09-24 Hynek Kovarik , Semjon Vugalter , Timo Weidl

The pieces of the hypernuclear strangeness violating potential due to the pseudoscalar meson exchanges are derived using methods which were successfully applied to hyperon nonleptonic decays. The estimates are tested by comparison with…

High Energy Physics - Phenomenology · Physics 2016-08-15 Cesar Barbero , Franjo Krmpotić , Dubravko Horvat , Zoran Narančić , Dubravko Tadić

We consider a two-dimensional Coulomb gas of positive and negative pointlike unit charges interacting via a logarithmic potential. The density (rather than the charge) correlation functions are studied. In the bulk, the form-factor theory…

Statistical Mechanics · Physics 2007-05-23 L. Šamaj , B. Jancovici

Local density approximation for the exchange energy is made for treatment of excited-states in density-functional theory. It is shown that taking care of the state-dependence of the LDA exchange energy functional leads to accurate…

Other Condensed Matter · Physics 2007-05-23 Manoj K. Harbola , Prasanjit Samal

Higher-order QED effects play an important role in precision measurements of nucleon elastic form factors in electron scattering. Here we introduce a two-photon exchange QED correction to the parity-violating polarization asymmetry of…

High Energy Physics - Phenomenology · Physics 2008-11-26 Andrei V. Afanasev , Carl E. Carlson

It has been known for some time that the exchange-correlation potential in time-dependent density functional theory is an intrinsically nonlocal functional of the density as soon as one goes beyond the adiabatic approximation. In this paper…

Mesoscale and Nanoscale Physics · Physics 2007-05-23 Z. Qian , A. Constantinescu , G. Vignale

We employ the density matrix renormalization group to construct the exact time-dependent exchange correlation potential for an impurity model with an applied transport voltage. Even for short-ranged interaction we find an infinitely…

Mesoscale and Nanoscale Physics · Physics 2017-09-13 Peter Schmitteckert , Michael Dzierzawa , Peter Schwab

An approach to the extraction of the two-photon exchange (TPE) correction from elastic $ep$ scattering data is presented. The cross section, polarization transfer (PT), and charge asymmetry data are considered. It is assumed that the TPE…

High Energy Physics - Phenomenology · Physics 2015-05-28 Krzysztof M. Graczyk

The nonlinear dynamics of a quasi-1D BEC loaded in a double-well potential is studied. The beyond mean-field corrections to the energy in the form of the Lee-Huang-Yang term are taken into account. One-dimensional geometry is considered.…

Quantum Gases · Physics 2024-06-14 Fatkhulla Kh. Abdullaev , Ravil M. Galimzyanov , Akbar M. Shermakhmatov

We develop relativistic short-range exchange energy functionals for four-component relativistic range-separated density-functional theory using a Dirac-Coulomb Hamiltonian in the no-pair approximation. We show how to improve the short-range…

Chemical Physics · Physics 2020-06-24 Julien Paquier , Emmanuel Giner , Julien Toulouse

The capability of density-functional theory to deal with the ground-state of strongly correlated low-dimensional systems, such as semiconductor quantum dots, depends on the accuracy of functionals developed for the exchange and correlation…

Strongly Correlated Electrons · Physics 2009-02-25 S. Pittalis , E. Rasanen , C. Proetto , E. K. U. Gross

A non-empirical exchange functional based on an interpolation between two limits of electron density: slowly varying limit and asymptotic limit, is proposed. In the slowly varying limit, we follow the study by Kleinman in 1984 which…

Materials Science · Physics 2020-08-04 Teepanis Chachiyo , Hathaithip Chachiyo

Certain excitations, especially ones of long-range charge transfer character, are poorly described by time-dependent density functional theory (TDDFT) when typical (semi-)local functionals are used. A proper description of these excitations…

Chemical Physics · Physics 2018-08-01 J. Garhammer , F. Hofmann , R. Armiento , S. Kümmel
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