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We use the exact strong-interaction limit of the Hohenberg-Kohn energy density functional to approximate the exchange-correlation energy of the restricted Kohn-Sham scheme. Our approximation corresponds to a highly non-local density…

强关联电子 · 物理学 2012-12-12 Francesc Malet , Paola Gori-Giorgi

The description of interacting many-electron systems in external magnetic fields is considered in the framework of the optimized effective potential method extended to current-spin-density functional theory. As a case study, a…

材料科学 · 物理学 2011-01-14 N. Helbig , S. Kurth , S. Pittalis , E. Räsänen , E. K. U. Gross

We measure the energy distribution of electrons passing through a two-dimensional electron gas using a scanning probe microscope. We present direct spatial images of coherent electron wave flow from a quantum point contact formed in a…

介观与纳米尺度物理 · 物理学 2015-06-24 B. J. LeRoy , A. C. Bleszynski , M. A. Topinka , R. M. Westervelt , S. E. J. Shaw , E. J. Heller , K. D. Maranowski , A. C. Gossard

Electron-electron correlation forms the basis of difficulties encountered in many-body problems. Accurate treatment of the correlation problem is likely to unravel some nice physical properties of matter embedded in this correlation. In an…

量子物理 · 物理学 2022-03-24 Eric Ouma Jobunga

Certain classes of strongly correlated systems promise high thermopower efficiency, but a full understanding of correlation effects on the Seebeck coefficient is lacking. This is partly due to limitations of Boltzmann-type approaches. One…

强关联电子 · 物理学 2020-12-15 R. Nourafkan , A. -M. S. Tremblay

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…

其他凝聚态物理 · 物理学 2016-08-16 J. Jung , P. García-González , J. E. Alvarellos , R. W. Godby

A non-empirical exchange functional based on an interpolation between two limits of electron density: slowly varying limit and asymptotic limit, is proposed. In the slowly varying limit, we follow the study by Kleinman in 1984 which…

材料科学 · 物理学 2020-08-04 Teepanis Chachiyo , Hathaithip Chachiyo

The homogeneous electron gas (HEG) is a key ingredient in the construction of most exchange-correlation functionals of density-functional theory. Often, the energy of the HEG is parameterized as a function of its spin density $n$, leading…

化学物理 · 物理学 2021-02-10 Susi Lehtola , Miguel A. L. Marques

We consider dynamic, i.e., frequency-dependent, correlations in non-condensed ultracold atomic Bose gases. In particular, we consider the single-particle correlation function and its power spectrum. We compute this power spectrum for a…

量子气体 · 物理学 2014-03-05 A. Bezett , H. J. van Driel , M. P. Mink , H. T. C. Stoof , R. A. Duine

We use spin-density functional theory to obtain novel expressions for the charge and spin local-field factors of an electron gas in terms of its electron-pair structure factors. These expressions (i) satisfy the compressibility and spin…

强关联电子 · 物理学 2009-11-07 B. Davoudi , M. Polini , M. P. Tosi

We derive an exact representation of the exchange-correlation energy within density functional theory (DFT) which spawns a class of approximations leading to correct long-range asymptotic behavior. In what amounts to be the simplest…

材料科学 · 物理学 2009-11-10 Roi Baer , Daniel Neuhauser

The zero-temperature correlation functions of the one-dimensional attractive Bose gas with delta-function interaction are calculated analytically for any value of the interaction parameter and number of particles, directly from the…

统计力学 · 物理学 2008-11-26 P. Calabrese , J. -S. Caux

The decay properties of the one-particle Green function in real space and imaginary time are systematically studied for solids. I present an analytic solution for the homogeneous electron gas at finite and at zero temperature as well as…

材料科学 · 物理学 2007-05-23 Arno Schindlmayr

We describe a method for calculating the exchange and correlation (XC) contributions to the total energy, effective potential, and stress tensor in the generalized gradient approximation. We avoid using the analytical expressions for the…

材料科学 · 物理学 2009-11-07 L. C. Balbas , Jose Luis Martins , Jose M. Soler

Time-dependent response and correlation functions are studied in random quantum systems composed of infinitely many parts without mutual interaction and defined with statistically independent random matrices. The latter are taken within the…

统计力学 · 物理学 2025-12-17 Sudhir Ranjan Jain , Pierre Gaspard

We propose a practical approximation to the exchange-correlation functional of (time-dependent) density functional theory for many-electron systems coupled to photons. The (time non-local) optimized effective potential (OEP) equation for…

介观与纳米尺度物理 · 物理学 2015-09-02 Camilla Pellegrini , Johannes Flick , Ilya V. Tokatly , Heiko Appel , Angel Rubio

A nonlinear description of the interaction of charged particles penetrating a solid has become of basic importance in the interpretation of a variety of physical phenomena. Here we develop a many-body theoretical approach to the quadratic…

材料科学 · 物理学 2009-10-31 T. del Rio Gaztelurrutia , J. M. Pitarke

The Coulomb exchange and correlation energy density functionals for electron systems are applied to nuclear systems. It is found that the exchange functionals in the generalized gradient approximation provide agreements with the exact-Fock…

核理论 · 物理学 2019-12-09 Tomoya Naito , Ryosuke Akashi , Gianluca Colò , Haozhao Liang , Xavier Roca-Maza

In principle, the Luttinger-Ward Green's function formalism allows one to compute simultaneously the total energy and the quasiparticle band structure of a many-body electronic system from first principles. We present approximate and exact…

材料科学 · 物理学 2015-05-18 Sohrab Ismail-Beigi

We derive an approximate local density functional for the exchange-correlation energy to be used in density-functional calculations of two-dimensional systems. In the derivation we employ the Colle-Salvetti wave function within the scheme…

强关联电子 · 物理学 2010-07-12 S. Sakiroglu , E. Rasanen