相关论文: Simple Analytical Particle and Kinetic Energy Dens…

We study ferromagnetism in a repulsively interacting two-component Fermi gas in a harmonic trap. Within a local density approximation, the two components phase-separate beyond a critical interaction strength, with one species having a…

We investigate the properties of a degenerate dilute gas of neutral fermionic particles in a harmonic trap that interact via dipole-dipole forces. We employ the semiclassical Thomas-Fermi method and discuss the Dirac correction to the…

We consider a strongly interacting one-dimensional (1D) Bose-Fermi mixture confined in a harmonic trap. It consists of a Tonks-Girardeau (TG) gas (1D Bose gas with repulsive hard-core interactions) and of a non-interacting Fermi gas (1D…

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…

We present an accurate and efficient real-space formulation of the Hellmann-Feynman stress tensor for $\mathcal{O}(N)$ Kohn-Sham density functional theory (DFT). While applicable at any temperature, the formulation is most efficient at high…

Since the seminal works of Thomas and Fermi, researchers in the Density-Functional Theory (DFT) community are searching for accurate electron density functionals. Arguably, the toughest functional to approximate is the noninteracting…

The dynamics of strongly interacting trapped dilute Fermi gases (dilute in the sense that the range of interatomic potential is small compared with inter-particle spacing) is investigated in a single-equation approach to the time-dependent…

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…

We derive a self-consistent local variant of the Thomas-Fermi approximation for (quasi-)two-dimensional (2D) systems by localizing the Hartree term. The scheme results in an explicit orbital-free representation of the electron density and…

We theoretically investigate equal-mass spin-balanced two-component Fermi gases in which pairs of atoms with opposite spins interact via a short-range isotropic model potential. We probe the distinction between two-dimensional and…

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,…

Closed form analytic expressions are derived for the density profile of a harmonically trapped noninteracting Fermi gas in $d$ dimensions. Shell structure effects are included to leading order in 1/N, where $N$ is the number of particles.…

Mejia-Rodriguez and Trickey recently proposed a procedure for removing the explicit dependence of meta-GGA exchange-correlation energy functionals $E_{\rm xc}$ on the kinetic energy density $\tau$. We present a simple modification to this…

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…

We try to improve the Thomas-Fermi model for the total energy and electron density of atoms and molecules by directly modifying the Euler equation for the electron density, which we argue is less affected by nonlocal corrections. Here we…

We prove that the lowest free energy of a classical interacting system at temperature $T$ with a prescribed density profile $\rho(x)$ can be approximated by the local free energy $\int f_T(\rho(x))dx$, provided that $\rho$ varies slowly…

Properties of a single impurity in a one-dimensional Fermi gas are investigated in homogeneous and trapped geometries. In a homogeneous system we use McGuire's expression [J. B. McGuire, J. Math. Phys. 6, 432 (1965)] to obtain interaction…

We investigate the statics and dynamics of spatial phase segregation process of a mixture of fermion atoms in a harmonic trap using the density functional theory. The kinetic energy of the fermion gas is written in terms of the density and…

Perdew et al. [Phys. Rev. Lett 49, 1691 (1982)] discovered and proved two different properties of exact Kohn-Sham density functional theory (DFT): (i) The exact total energy versus particle number is a series of linear segments between…

We investigate separations of trapped balanced two-component atomic Fermi gases with repulsive contact interaction. Candidates for ground-state densities are obtained from the imaginary-time evolution of a nonlinear pseudo-Schr\"odinger…