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Using the density functional formalism we derive expression for the distortion free energy for systems with continuous broken symmetry and use it to derive expression for the elastic constants of smectic phases in which director is tilted…

软凝聚态物质 · 物理学 2009-11-07 Yashwant Singh , Jokhan Ram

Weakly conducting dielectric liquid drops suspended in another dielectric liquid and subject to an applied uniform electric field exhibit a wide range of dynamical behaviors contingent on field strength and material properties. These…

流体动力学 · 物理学 2017-10-11 Debasish Das , David Saintillan

We re-examine the problem of the dielectric response of highly polar liquids such as water in confinement between two walls using a simple two-variable density functional theory involving number and polarisation densities. In the…

统计力学 · 物理学 2023-02-08 Daniel Borgis , Damien Laage , Luc Belloni , Guillaume Jeanmairet

An accurate non-gradient-expansion based correction to Thomas--Fermi is developed using solvable model. The used model is a system of $N$ non-interacting electrons moving independently in the Coulomb field of the nuclear charge. The…

量子物理 · 物理学 2015-06-04 Alexey Sergeev , Raka Jovanovic , Sabre Kais , Fahhad H Alharbi

We develop a theory for a generic instability of a Fermi liquid in dimension d>1 against the formation of a Luttinger-liquid-like state. The density of states at the Fermi level is the order parameter for the ensuing quantum phase…

强关联电子 · 物理学 2013-10-01 T. R. Kirkpatrick , D. Belitz

The formalism of density functional theory (DFT) can be easily extended to the time dependent case (TDDFT). However, while in the static case the theory is well established and is expected to be, at least in principle, an exact approach for…

凝聚态物理 · 物理学 2007-05-23 Sandro Stringari

We present an accurate local density-functional for electronic-structure calculations within the density functional theory (DFT). The functional is derived by analyzing the structure of the standard perturbative expansion of the correlation…

材料科学 · 物理学 2024-11-28 Mario Benites , Angel Rosado , Efstratios Manousakis

A generalization of the Density Functional Theory is proposed. The theory developed leads to single-particle equations of motion with a quasi-local mean-field operator, which contains a quasi-particle position-dependent effective mass and a…

核理论 · 物理学 2009-11-07 V. B. Soubbotin , V. I. Tselyaev , X. Vinas

In the first two papers in this series, we developed new shifted potential (SP), gradient shifted force (GSF), and Taylor shifted force (TSF) real-space methods for multipole interactions in condensed phase simulations. Here, we discuss the…

化学物理 · 物理学 2016-08-18 Madan Lamichhane , Thomas Parsons , Kathie E. Newman , J. Daniel Gezelter

Presented here are calculations of the distortion of the density of an electron gas due to the electrostatic field of a proton. Several models based upon the local density approximation (LDA) of density functional theory [linear response…

chem-ph · 物理学 2009-10-22 Gary G. Hoffman , Lawrence R. Pratt

In the current density functional theory of linear and nonlinear time-dependent phenomena, the treatment of exchange and correlation beyond the level of the adiabatic local density approximation is shown to lead to the appearance of…

凝聚态物理 · 物理学 2009-10-30 G. Vignale , C. A. Ullrich , S. Conti

We review the progress that has been recently made in the application of time-dependent density functional theory to thermoelectric phenomena. As the field is very young, we emphasize open problems and fundamental issues. We begin by…

介观与纳米尺度物理 · 物理学 2017-04-26 F. G. Eich , M. Di Ventra , G. Vignale

Two-dimensional electron systems offer an appealing platform to explore long-lived excitations arising due to collinear carrier scattering enabled by phase-space constraints at the Fermi surface. Recently it was found that these effects can…

强关联电子 · 物理学 2024-09-27 Serhii Kryhin , Leonid Levitov

Starting from a general classical model of many interacting particles we present a well defined step by step procedure to derive the continuum-mechanics equations of nonlinear elasticity theory with fluctuations which describe the…

统计力学 · 物理学 2022-06-02 Rudolf Haussmann

We have used the variational and diffusion quantum Monte Carlo methods to calculate the energy, pair correlation function, static structure factor, and momentum density of the ground state of the two-dimensional homogeneous electron gas. We…

介观与纳米尺度物理 · 物理学 2010-03-02 N. D. Drummond , R. J. Needs

We derive a closed form expression for the quantum corrections to the kinetic energy density (KED) in the Thomas-Fermi (TF) limit of a linear potential model system in three dimensions (the Airy gas). The universality of the expression is…

量子气体 · 物理学 2015-06-19 A. Lindmaa , A. E. Mattsson , R. Armiento

We derive simple analytical expressions for the particle density $\rho(r)$ and the kinetic energy density $\tau(r)$ for a system of noninteracting fermions in a $d-$dimensional isotropic harmonic oscillator potential. We test the…

介观与纳米尺度物理 · 物理学 2016-08-31 Matthias Brack , Brandon P. van Zyl

We calculate the ground-state energy, pair correlation function, static structure factor, and momentum density of the one-dimensional electron fluid at high density using variational quantum Monte Carlo simulation. For an infinitely thin…

强关联电子 · 物理学 2018-10-03 Vinod Ashokan , N. D. Drummond , K. N. Pathak

A novel dielectric scheme is proposed for strongly coupled electron liquids that handles quantum mechanical effects beyond the random phase approximation level and treats electronic correlations within the integral equation theory of…

统计力学 · 物理学 2023-04-12 Panagiotis Tolias , Federico Lucco Castello , Tobias Dornheim

A density functional theory is developed for fermions in one dimension, interacting via a delta-function. Such systems provide a natural testing ground for questions of principle, as the local density approximation should work well for…

其他凝聚态物理 · 物理学 2007-05-23 R. J. Magyar , K. Burke