Density functional theory of the phase diagram of maximum density droplets in two-dimensional quantum dots in a magnetic field

We present a density-functional theory (DFT) approach to the study of the phase diagram of the maximum density droplet (MDD) in two-dimensional quantum dots in a magnetic field. Within the lowest Landau level (LLL) approximation, analytical expressions are derived for the values of the parameters $N$ (number of electrons) and $B$ (magnetic field) at which the transition from the MDD to a ``reconstructed'' phase takes place. The results are then compared with those of full Kohn-Sham calculations, giving thus information about both correlation and Landau level mixing effects. Our results are also contrasted with those of Hartree-Fock (HF) calculations, showing that DFT predicts a more compact reconstructed edge, which is closer to the result of exact diagonalizations in the LLL.Comment: ReVTeX 3.

Broken Symmetries in the Reconstruction of v=1 Quantum Hall Edges

Spin-polarized reconstruction of the v=1 quantum Hall edge is accompanied by a spatial modulation of the charge density along the edge. We find that this is also the case for finite quantum Hall droplets: current spin density functional calculations show that the so-called Chamon-Wen edge forms a ring of apparently localized electrons around the maximum density droplet (MDD). The boundaries of these different phases qualitatively agree with recent experiments. For very soft confinement, Chern-Simons Ginzburg-Landau theory indicates formation of a non-translational invariant edge with vortices (holes) trapped in the edge region.Comment: Proceedings of the EP2DS, Ottawa (1999) (submitted to Physica E

Current Density Functional approach to large quantum dots in intense magnetic fields

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 attributed in a clear way to the formation of compressible and incompressible states of the system. The orbital and spin angular momenta, the total energy, ionization and electron chemical potentials of the ground state, as well as the frequencies of far-infrared edge modes are calculated as a function of B, and compared with available experimental and theoretical results.Comment: Typeset using Revtex, 17 pages and 13 Postscript figure

Ensemble density functional theory of the fractional quantum Hall effect

We develop an ensemble density functional theory for the fractional quantum Hall effect using a local density approximation. Model calculations for edge reconstructions of a spin-polarized quantum dot give results in good agreement with semiclassical and Hartree-Fock calculations, and with small system numerical diagonalizations. This establishes the usefulness of density functional theory to study the fractional quantum Hall effect, which opens up the possibility of studying inhomegeneous systems with many more electrons than has heretofore been possible.Comment: Improved discussion of ensemble density functional theory. 4 pages plus 3 postscript figures, uses latex with revtex. Contact [email protected]

Current-spin-density functional study of persistent currents in quantum rings

We present a numerical study of persistent currents in quantum rings using current spin density functional theory (CSDFT). This formalism allows for a systematic study of the joint effects of both spin, interactions and impurities for realistic systems. It is illustrated that CSDFT is suitable for describing the physical effects related to Aharonov-Bohm phases by comparing energy spectra of impurity-free rings to existing exact diagonalization and experimental results. Further, we examine the effects of a symmetry-breaking impurity potential on the density and current characteristics of the system and propose that narrowing the confining potential at fixed impurity potential will suppress the persistent current in a characteristic way.Comment: 7 pages REVTeX, including 8 postscript figure

Structure and far-infrared edge modes of quantum antidots at zero magnetic field

We have investigated edge modes of different multipolarity sustained by quantum antidots at zero magnetic field. The ground state of the antidot is described within a local density functional formalism. Two sum rules, which are exact within this formalism, have been derived and used to evaluate the energy of edge collective modes as a function of the surface density and the size of the antidot.Comment: Typeset using Revtex, 8 pages and 6 Postscript figure

Far-infrared edge modes in quantum dots

We have investigated edge modes of different multipolarity sustained by quantum dots submitted to external magnetic fields. We present a microscopic description based on a variational solution of the equation of motion for any axially symmetric confining potential and multipole mode. Numerical results for dots with different number of electrons whose ground-state is described within a local Current Density Functional Theory are discussed. Two sum rules, which are exact within this theory, are derived. In the limit of a large neutral dot at B=0, we have shown that the classical hydrodynamic dispersion law for edge waves \omega(q) \sim \sqrt{q \ln (q_0/q)} holds when quantum and finite size effects are taken into account.Comment: We have changed some figures as well as a part of the tex

Far-infrared edge modes in quantum dots

We have investigated edge modes of different multipolarity sustained by quantum dots submitted to external magnetic fields. We present a microscopic description based on a variational solution of the equation of motion for any axially symmetric confining potential and multipole mode. Numerical results for dots with different number of electrons whose ground-state is described within a local Current Density Functional Theory are discussed. Two sum rules, which are exact within this theory, are derived. In the limit of a large neutral dot at B=0, we have shown that the classical hydrodynamic dispersion law for edge waves \omega(q) \sim \sqrt{q \ln (q_0/q)} holds when quantum and finite size effects are taken into account.Comment: We have changed some figures as well as a part of the tex

Pade approximants for the ground-state energy of closed-shell quantum dots

Analytic approximations to the ground-state energy of closed-shell quantum dots (number of electrons from 2 to 210) are presented in the form of two-point Pade approximants. These Pade approximants are constructed from the small- and large-density limits of the energy. We estimated that the maximum error, reached for intermediate densities, is less than 3%. Within the present approximation the ground-state is found to be unpolarized.Comment: 4 pages, RevTeX, 3 ps figure

The violation of the Hund's rule in semiconductor artificial atoms

The unrestricted Pople-Nesbet approach for real atoms is adapted to quantum dots, the man-made artificial atoms, under applied magnetic field. Gaussian basis sets are used instead of the exact single-particle orbitals in the construction of the appropriated Slater determinants. Both system chemical potential and charging energy are calculated, as also the expected values for total and z-component in spin states. We have verified the validity of the energy shell structure as well as the Hund's rule state population at zero magnetic field. Above given fields, we have observed a violation of the Hund's rule by the suppression of triplets and quartets states at the 1p energy shell, taken as an example. We also compare our present results with those obtained using the LS-coupling scheme for low electronic occupations. We have focused our attention to ground-state properties for GaAs quantum dots populated up to forty electrons.Comment: 5 pages, 2 figures, submitted to Semic. Sci. Techno