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We calculate the exact Kohn-Sham potential that describes, within time-dependent density-functional theory, the propagation of an electron quasiparticle wavepacket of non-zero crystal momentum added to a ground-state model semiconductor.…

Mesoscale and Nanoscale Physics · Physics 2015-06-05 J. D. Ramsden , R. W. Godby

Within the framework of the kinetic energy driven superconductivity, the electromagnetic response in cuprate superconductors is studied in the linear response approach. The kernel of the response function is evaluated and employed to…

Superconductivity · Physics 2010-04-12 Mateusz Krzyzosiak , Zheyu Huang , Shiping Feng , Ryszard Gonczarek

The thermodynamics of a homogeneous dilute Bose gas with an arbitrary strong repulsion between particles is investigated on the basis of the exact relation connecting the pair correlation function with the in-medium pair wave functions and…

Statistical Mechanics · Physics 2007-05-23 A. Yu. Cherny , A. A. Shanenko

Ground-state properties of a two-dimensional fluid of bosons with repulsive dipole-dipole interactions are studied by means of the Euler-Lagrange hypernetted-chain approximation. We present a self-consistent semi-analytical theory of the…

Quantum Gases · Physics 2012-10-03 Saeed H. Abedinpour , Reza Asgari , Marco Polini

We put forward new approach for the development of a non-local density functional by a direct modeling of the shape of exchange-correlation (xc) hole in inhomogeneous systems. The functional is aimed at giving an accurate xc-energy and an…

Other Condensed Matter · Physics 2013-08-05 Klaas J. H. Giesbertz , Robert van Leeuwen , Ulf von Barth

We investigate the possibility to deduce momentum space properties from time-dependent density functional calculations. Electron and ion momentum distributions after double ionization of a model Helium atom in a strong few-cycle laser pulse…

Atomic Physics · Physics 2009-11-13 F. Wilken , D. Bauer

The exact interaction energy of a many-electron system is determined by the electron pair density, which is not well-approximated in standard Kohn-Sham density functional models. Here we study the (complicated but well-defined) exact…

Chemical Physics · Physics 2015-08-07 Huajie Chen , Gero Friesecke

A quantum electrodynamical time-dependent density functional theory framework is applied to describe strongly coupled light--matter interactions in cavity environments. The formalism utilizes a tensor product approach, coupling real-space…

Chemical Physics · Physics 2025-11-27 Yetmgeta Aklilu , Matthew Shepherd , Cody L. Covington , Kalman Varga

Precise calculations of dynamics in the homogeneous electron gas (jellium model) are of fundamental importance for design and characterization of new materials. We introduce a diagrammatic Monte Carlo technique based on algorithmic…

Strongly Correlated Electrons · Physics 2022-12-21 James P. F. LeBlanc , Kun Chen , Kristjan Haule , Nikolay V. Prokof'ev , Igor S. Tupitsyn

We study the temporal response of the electric current in an electrolyte under a sudden switch on or switch off of an external electric field of arbitrary magnitude. We use Stochastic Density Functional Theory including hydrodynamic…

Statistical Mechanics · Physics 2023-08-02 Haggai Bonneau , Vincent Démery , Élie Raphaël

We theoretically analyze the phase diagram of a quantum gas of bosons that interact via repulsive dipolar interactions. The bosons are tightly confined by an optical lattice in a quasi one-dimensional geometry. In the single-band…

Quantum Gases · Physics 2022-08-01 Rebecca Kraus , Titas Chanda , Jakub Zakrzewski , Giovanna Morigi

Recently, a new connection between density functional theory and kinetic theory has been proposed. In particular, it was shown that the Kohn-Sham (KS) equations can be reformulated as a macroscopic limit of the steady-state solution of a…

Chemical Physics · Physics 2015-10-28 M. Mendoza , H. J. Herrmann , S. Succi

Coupled two-dimensional electron-hole bilayers provide a unique platform to study strongly correlated Bose-Fermi mixtures in condensed matter. Electrons and holes in spatially separated layers can bind to form interlayer excitons, composite…

The linearization around one of its equilibrium of a system that describes the correlations between the superfluid component and the normal fluid part of a condensed Bose gas in the approximation of very low temperature and small condensate…

Analysis of PDEs · Mathematics 2021-12-28 Miguel Escobedo

We present a novel joint time-dependent density-functional theory for the description of solute-solvent systems in time-dependent external potentials. Starting with the exact quantum-mechanical action functional for both electrons and…

Materials Science · Physics 2012-02-16 Johannes Lischner , T. A. Arias

The multi-component density functional theory is faced with the challenge of capturing various types of inter- and intra-particle exchange-correlation effects beyond those introduced by the conventional electronic exchange-correlation…

Atomic and Molecular Clusters · Physics 2023-12-27 Nahid Sadat Riyahi , Mohammad Goli , Shant Shahbazian

The effective potential of electron--electron interaction and the two-particle \textquotedblleft density--density\textquotedblright\ correlation function have been calculated for a simple semiinfinite metal making allowance for the…

Mesoscale and Nanoscale Physics · Physics 2015-03-29 B. M. Markovych , I. M. Zadvorniak

The electric charge transport in a weakly magnetized hot QCD medium has been investigated in the presence of an external inhomogeneous electric field. The current densities (electric and Hall)induced by the inhomogeneous electric field have…

High Energy Physics - Phenomenology · Physics 2021-04-28 Gowthama K K , Manu Kurian , Vinod Chandra

We have calculated the frequency-dependent exact exchange (EXX) kernel of time-dependent (TD) density functional theory employing our recently proposed computational method based on cubic splines. With this kernel we have calculated the…

Mesoscale and Nanoscale Physics · Physics 2009-11-13 Maria Hellgren , Ulf von Barth

We propose exchanging the energy functionals in ground-state DFT with physically equivalent exact force expressions as a new promising route towards approximations to the exchange-correlation potential and energy. In analogy to the usual…