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相关论文: Exchange-correlation orbital functionals in curren…

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We study a model quantum dot system in an external magnetic field by using both the spin-density-functional theory and the current-spin-density-functional theory. The theories are used with local approximations for the spin-density and the…

介观与纳米尺度物理 · 物理学 2007-05-23 H. Saarikoski , E. Räsänen , S. Siljamäki , A. Harju , M. J. Puska , R. M. Nieminen

We use density-functional methods to study the effects of an external magnetic field on two-dimensional quantum dots with a rectangular hard-wall confining potential. The increasing magnetic field leads to spin polarization and formation of…

强关联电子 · 物理学 2009-11-10 E. Räsänen , A. Harju , M. J. Puska , R. M. Nieminen

We consider density functionals for exchange and correlation energies in two-dimensional systems. The functionals are constructed by making use of exact constraints for the angular averages of the corresponding exchange and correlation…

强关联电子 · 物理学 2010-02-25 E. Rasanen , S. Pittalis

A novel approach to electronic correlations in magnetic crystals which takes into account a dynamical many-body effects is present. In order to to find a frequency dependence of the electron self energy, an effective quantum-impurity…

强关联电子 · 物理学 2007-05-23 A. I. Lichtenstein , M. I. Katsnelson

Based on exact limits and quantum Monte Carlo simulations, we obtain, at any density and spin polarization, an accurate estimate for the energy of a modified homogeneous electron gas where electrons repel each other only with a long-range…

材料科学 · 物理学 2009-11-11 Simone Paziani , Saverio Moroni , Paola Gori-Giorgi , Giovanni B. Bachelet

In spin-density-functional theory for noncollinear magnetic materials, the Kohn-Sham system features exchange-correlation (xc) scalar potentials and magnetic fields. The significance of the xc magnetic fields is not very well explored; in…

材料科学 · 物理学 2019-09-25 Edward A. Pluhar , Carsten A. Ullrich

Low-lying energy levels of two interacting electrons confined in a two-dimensional parabolic quantum dot in the presence of an external magnetic field have been revised within the frame of a novel model. The present formalism, which gives…

量子物理 · 物理学 2009-10-11 Bulent Gonul , Ebru Bakir , Koray Koksal

Current-spin density functional theory (CSDFT) provides a framework to describe interacting many-electron systems in a magnetic field which couples to both spin- and orbital-degrees of freedom. Unlike in usual (spin-) density functional…

材料科学 · 物理学 2015-06-25 S. Pittalis , S. Kurth , N. Helbig , E. K. U. Gross

We use a variational Monte Carlo algorithm to solve the electronic structure of two-dimensional semiconductor quantum dots in external magnetic field. We present accurate many-body wave functions for the system in various magnetic field…

介观与纳米尺度物理 · 物理学 2009-11-11 Ari Harju

Most approximate exchange-correlation functionals used within density functional theory are constructed as the sum of two distinct contributions for exchange and correlation. Separating the exchange component from the entire functional is…

凝聚态物理 · 物理学 2009-10-28 Claudia Filippi , C. J. Umrigar , Xavier Gonze

We present a practical and accurate density functional for the exchange-correlation energy of electrons in two dimensions. The exchange part is based on a recent two-dimensional generalized-gradient approximation derived by considering the…

强关联电子 · 物理学 2010-06-30 E. Rasanen , S. Pittalis , J. G. Vilhena , M. A. L. Marques

A spin-current density-functional theory (SCDFT) is introduced, which takes into account currents of the spin-density and thus currents of the magnetization in addition to the electron density, the non-collinear spin-density, and the…

材料科学 · 物理学 2009-11-11 Stefan Rohra , Andreas Goerling

Spin-orbit coupling induces a current density in the ground state, which consequently requires a generalization for meta-generalized gradient approximations. That is, the exchange-correlation energy has to be constructed as an explicit…

化学物理 · 物理学 2024-05-09 Yannick J. Franzke , Christof Holzer

The magnetization of quantum dots is discussed in terms of a relatively simple but exactly solvable model Hamiltonian. The model predicts oscillations in spin polarization as a function of dot radius for a fixed electron density. These…

介观与纳米尺度物理 · 物理学 2007-10-11 A. Bansil , D. Nissenbaum , B. Barbiellini , R. Saniz

A recently developed quasi two-dimensional exact-exchange formalism within the framework of Density Functional Theory has been applied to a strongly inhomogeneous interacting electron gas, and the results were compared with state-of-the-art…

凝聚态物理 · 物理学 2009-11-07 S. Rigamonti , F. A. Reboredo , C. R. Proetto

Due to the spin-orbital coupling in a semiconductor quantum dot, a freely precessing electron spin produces a time-dependent charge density. This creates a sizeable electric field outside the dot, leading to promising applications in…

介观与纳米尺度物理 · 物理学 2008-04-12 L. S. Levitov , E. I. Rashba

We present a study of ground state energies and densities of quantum dots in a magnetic field, which takes into account correlation effects through the Current-density functional theory (CDFT). The method is first tested against exact…

凝聚态物理 · 物理学 2009-10-22 M. Ferconi , G. Vignale

The magnetic dipole (M1) and electric quadupole (E2) responses of two-dimensional quantum dots with an elliptic shape are theoretically investigated as a function of the dot deformation and applied static magnetic field. Neglecting the…

介观与纳米尺度物理 · 物理学 2009-11-07 Enrico Lipparini , Llorenç Serra , Antonio Puente

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,…

介观与纳米尺度物理 · 物理学 2007-05-23 B. P. van Zyl

Within Current Density Functional Theory, we have studied a quantum dot made of 210 electrons confined in a disk geometry. The ground state of this large dot exhibits some features as a function of the magnetic field (B) that can be…

凝聚态物理 · 物理学 2009-10-30 Marti Pi , Manuel Barranco , Agusti Emperador , Enrico Lipparini , Llorens Serra
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