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Adiabatic time-dependent density functional theory fails for excitations of a heteroatomic molecule composed of two open-shell fragments at large separation. Strong frequency-dependence of the exchange-correlation kernel is necessary for…

Other Condensed Matter · Physics 2009-11-11 Neepa T. Maitra , David G. Tempel

Density Functional Theory relies on universal functionals characteristic of a given system. Those functionals in general are different for the electron gas and for jellium (electron gas with uniform background). However, jellium is…

Statistical Mechanics · Physics 2017-05-23 James W. Dufty

The uniform electron gas is a key model system in the description of matter, including dense plasmas and solid state systems. However, the simultaneous occurence of quantum, correlation, and thermal effects makes the theoretical description…

Plasma Physics · Physics 2017-05-24 Simon Groth , Tobias Dornheim , Michael Bonitz

In this paper we analyze how radiation effects influence the correlation functions, the excess energy, and in turn the electron correlation energy of the quantized electron gas at temperature $T=0$. To that aim we resort to a statistical…

Statistical Mechanics · Physics 2020-08-26 Johan S. Høye , Enrique Lomba

Resonances with electromagnetic whistler-mode waves are the primary driver for the formation and dynamics of energetic electron fluxes in various space plasma systems, including shock waves and planetary radiation belts. The basic and most…

Space Physics · Physics 2021-11-24 A. V. Artemyev , A. I. Neishtadt , A. A. Vasiliev , D. Mourenas

We make use of continuum elasticity theory to investigate the collective modes that propagate along the edge of a two-dimensional electron liquid or crystal in a magnetic field. An exact solution of the equations of motion is obtained with…

Mesoscale and Nanoscale Physics · Physics 2009-10-31 Irene D'Amico , Giovanni Vignale

Density functional theory is the workhorse of modern electronic structure calculations, with wide-ranging applications in chemistry, physics, materials science, and machine learning. At its heart lies the exchange-correlation functional, a…

Chemical Physics · Physics 2026-02-20 Fabien Tran , Susi Lehtola , Stefano Pittalis , Miguel A. L. Marques

We introduce a new paradigm for finite and infinite strict-one-dimensional uniform electron gases. In this model, $n$ electrons are confined to a ring and interact via a bare Coulomb operator. In the high-density limit (small-$r_s$, where…

Strongly Correlated Electrons · Physics 2012-08-15 Pierre-François Loos , Peter M. W. Gill

Electric conductivity and dielectric permeability of the non-degenerate electronic gas for the collisional plasmas under arbitrary degree of degeneration of electron gas is found. The kinetic equation of Wigner - Vlasov - Boltzmann with…

Mathematical Physics · Physics 2010-03-08 A. V. Latyshev , A. A. Yushkanov

We present a detailed study of the exact-exchange (EXX) kernel of time-dependent density functional theory with an emphasis on its discontinuity at integer particle numbers. It was recently found that this exact property leads to sharp…

Chemical Physics · Physics 2015-06-17 M. Hellgren , E. K. U. Gross

We investigate basic hydrogen quantities like the molecular bond length, the molecular dissociation energy and the van-der-Waals interaction in idealized situations in an effort to discern a suitable exchange-correlation functional for the…

An approximation for the exchange-correlation energy of reduced-density-matrix-functional theory was recently derived from a study of the homogeneous electron gas (N.N. Lathiotakis, N. Helbig, E.K.U. Gross, Phys. Rev. B 75, 195120 (2007)).…

Strongly Correlated Electrons · Physics 2009-11-13 N. N. Lathiotakis , N. Helbig , A. Zacarias , E. K. U. Gross

Most treatments of electron-electron correlations in dense plasmas either ignore them entirely (random phase approximation) or neglect the role of ions (jellium approximation). In this work, we go beyond both these approximations to derive…

Plasma Physics · Physics 2020-02-05 Nathaniel R. Shaffer , Charles E. Starrett

We analyze theoretically the oscillations that the magnetoresistivity of two-dimensional electron systems present when a high intensity direct current is applied. In the model presented here we suggest that a plasma wave is excited in the…

Mesoscale and Nanoscale Physics · Physics 2009-11-13 Jesus Inarrea

The fully three dimensional governing equations in the electron magnetohydrodynamic (EMHD) regime for a plasma with inhomogeneous density is obtained. These equations in the two dimensional (2-D) limit can be cast in terms of the evolution…

Plasma Physics · Physics 2009-11-13 Sharad Kumar Yadav , Amita Das , Predhiman Kaw

We develop a systematic theory of multi-particle excitations in strongly interacting Fermi systems. Our work is the generalization of the time-honored work by Jackson, Feenberg, and Campbell for bosons, that provides, in its most advanced…

Other Condensed Matter · Physics 2017-07-21 H. M. Böhm , R. Holler , E. Krotscheck , M. Panholzer

An exchange correlation energy functional involving fractional power of the one-body reduced density matrix [Phys. Rev. B {\bf 78}, 201103 (2008)] is applied to finite systems and to the homogeneous electron gas. The performance of the…

Strongly Correlated Electrons · Physics 2015-05-13 N. N. Lathiotakis , S. Sharma , J. K. Dewhurst , F. Eich , M. A. L. Marques , E. K. U. Gross

A dilute homogeneous 3D Fermi gas in the ground state is considered for the case of a repulsive pairwise interaction. The low-density (dilution) expansions for the kinetic and interaction energies of the system in question are calculated up…

Statistical Mechanics · Physics 2009-11-10 A. A. Shanenko

The complex nature of electron-electron correlations is made manifest in the very simple but non-trivial problem of two electrons confined within a sphere. The description of highly non-local correlation and self-interaction effects by…

Other Condensed Matter · Physics 2016-08-16 J. Jung , P. García-González , J. E. Alvarellos , R. W. Godby

The accurate calculation of excited state properties of interacting electrons in the condensed phase is an immense challenge in computational physics. Here, we use state-of-the-art equation-of-motion coupled-cluster theory with single and…

Chemical Physics · Physics 2019-07-10 Alan M. Lewis , Timothy C. Berkelbach