English
Related papers

Related papers: A nonlocal kinetic energy functional for an inhomo…

200 papers

We systematically develop a density functional description for the equilibrium properties of a two-dimensional, harmonically trapped, spin-polarized dipolar Fermi gas based on the Thomas-Fermi von Weizs\"acker approximation. We pay…

Quantum Gases · Physics 2014-02-11 Brandon P. van Zyl , E. Zaremba , P. Pisarski

In a recent paper [Phys.~Rev.~A {\bf 89}, 022503 (2014)], the average density approximation (ADA) was implemented to develop a parameter-free, nonlocal kinetic energy functional to be used in the orbital-free density-functional theory of an…

Quantum Gases · Physics 2015-08-25 J. Towers , B. P. van Zyl , W. Kirkby

A new method is proposed for constructing energy density functionals, which include a nonlocal dependence on the density gradients. This method is used to construct functionals for kinetic energy, which is a nonlocal generalization of the…

Materials Science · Physics 2022-09-08 I. I. Mazin

It has been previously proven that the Kohn-Sham kinetic energy functional scales homogeneusly under generalized coordinate scaling, in a way that is obeyed by the von Weiz\"acker functional, but seems to be in contradiction with the…

Quantum Physics · Physics 2014-10-16 Lázaro Calderín

We examine the leading order semiclassical gradient corrections to the non-interacting kinetic energy density functional of a two dimensional Fermi gas by applying the extended Thomas-Fermi theory at finite temperature. We find a non-zero…

Quantum Gases · Physics 2015-05-20 Brandon P. van Zyl , K. Berkane , K Bencheikh , A. Farrell

The magnetic extension of the Thomas-Fermi-Weizs\"acker kinetic energy is used within density-functional-theory to numerically obtain the ground state densities and energies of two-dimensional quantum dots. The results are thoroughly…

Mesoscale and Nanoscale Physics · Physics 2009-10-31 Llorenç Serra , Antonio Puente

We evaluate analytically some ground state properties of two-dimensional harmonically confined Fermi vapors with isotropy and for an arbitrary number of closed shells. We first derive a differential form of the virial theorem and an…

Statistical Mechanics · Physics 2009-11-07 A. Minguzzi , N. H. March , M. P. Tosi

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…

Nuclear Theory · Physics 2009-11-07 V. B. Soubbotin , V. I. Tselyaev , X. Vinas

Building on the discussion in PRA 93, 042510 (2016), we present a systematic derivation of gradient corrections to the kinetic-energy functional and the one-particle density, in particular for two-dimensional systems. We derive the leading…

Quantum Gases · Physics 2017-09-08 Martin-Isbjörn Trappe , Yink Loong Len , Hui Khoon Ng , Berthold-Georg Englert

We derive the density functional for the ground-state energy of a two-dimensional, spin-polarized gas of neutral fermionic atoms with magnetic-dipole interaction, in the Thomas-Fermi-Dirac approximation. For many atoms in a harmonic trap,…

Quantum Gases · Physics 2015-05-19 Bess Fang , Berthold-Georg Englert

A novel nonlocal density functional for the kinetic pressure tensor of a Fermi gas is derived. The functional is designed to reconcile the Quantum Hydrodynamic Model with the microscopic approaches, both for homogeneous equilibrium and…

Plasma Physics · Physics 2018-12-12 D. I. Palade

There is a number of explicit kinetic energy density functionals for non-interacting electron systems that are obtained in terms of the electron density and its derivatives. These semilocal functionals have been widely used in the…

Other Condensed Matter · Physics 2011-12-22 David Garcia-Aldea , J. E. Alvarellos

Density-functional theory is utilized to investigate the zero-temperature transition from a Fermi liquid to an inhomogeneous stripe, or Wigner crystal phase, predicted to occur in a one-component, spin-polarized, two-dimensional dipolar…

Quantum Gases · Physics 2015-08-14 B. P. van Zyl , W. Kirkby , W. Ferguson

The key feature of nonlocal kinetic energy functionals is their ability to reduce to the Thomas-Fermi functional in the regions of high density and to the von Weizs\"acker functional in the region of low density/high density gradient. This…

Materials Science · Physics 2021-03-31 Xuecheng Shao , Wenhui Mi , Michele Pavanello

Properties of confined mesoscopic systems have been extensively studied numerically over recent years. We discuss an analytical approach to the study of finite rotating fermionic systems in two dimension. We first construct the energy…

Mesoscale and Nanoscale Physics · Physics 2019-08-17 Sankalpa Ghosh , M. V. N. Murthy , Subhasis Sinha

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…

Other Condensed Matter · Physics 2007-05-23 R. J. Magyar , K. Burke

Density functional theory (DFT) is notorious for the absence of gradient corrections to the two-dimensional (2D) Thomas-Fermi kinetic-energy functional; it is widely accepted that the 2D analog of the 3D von Weizs\"acker correction…

Two-dimensional Fermi gases with universal short-range interactions are known to exhibit a quantum anomaly, where a classical scale and conformal invariance is broken by quantum effects at strong coupling. We argue that in a quasi…

Quantum Gases · Physics 2022-05-24 Viktor Bekassy , Johannes Hofmann

We present a general approach for the construction of the exact local-energy-density functionals for a uniform N-dimensional electronic system in a magnetic field. For arbitrary dimension, we obtain explicit expressions for the matter,…

Mesoscale and Nanoscale Physics · Physics 2007-05-23 B. P. van Zyl

Orbital-free density functional theory promises to deliver linear-scaling electronic structure calculations. This requires the knowledge of the non-interacting kinetic-energy density functional (KEDF), which should be accurate and must…

Materials Science · Physics 2024-12-12 Michael A. J. Mitchell , Teresa Del Aguila Ferrandis , Stefano Sanvito
‹ Prev 1 2 3 10 Next ›