October 8, 2003
Few-electron systems confined in two-dimensional parabolic quantum dots at high magnetic fields are studied by the Hartree-Fock (HF) and exact diagonalization methods. A generalized multicenter Gaussian basis is proposed in the HF method. A comparison of the HF and exact results allows us to discuss the relevance of the symmetry of the charge density distribution for the accuracy of the HF method. It is shown that the energy estimates obtained with the broken-symmetry HF wave functions become exact in the infinite magnetic-field limit. In this limit the charge density of the broken-symmetry solution can be identified with the classical charge distribution.
Similar papers 1
September 14, 2004
Wigner molecules formed at high magnetic fields in circular and elliptic quantum dots are studied by exact diagonalization (ED) and unrestricted Hartree-Fock (UHF) methods with multicenter basis of displaced lowest Landau level wave functions. The broken symmetry states with semi-classical charge density constructed from superpositions of the ED solutions are compared to the UHF results. UHF overlooks the dependence of the few-electron wave function on the actual relative pos...
August 30, 2000
We perform unrestricted Hartree-Fock (HF) calculations for electrons in a parabolic quantum dot at zero magnetic field. The crossover from Fermi liquid to Wigner molecule behavior is studied for up to eight electrons and various spin components $S_z$. We compare the results with numerically exact path-integral Monte Carlo simulations and earlier HF studies. Even in the strongly correlated regime the symmetry breaking HF solutions provide accurate estimates for the energies an...
May 27, 2003
We present detailed results of Unrestricted Hartree-Fock (UHF) calculations for up to eight electrons in a parabolic quantum dot. The UHF energies are shown to provide rather accurate estimates of the ground-state energy in the entire range of parameters from high densities with shell model characteristics to low densities with Wigner molecule features. To elucidate the significance of breaking the rotational symmetry, we compare Restricted Hartree-Fock (RHF) and UHF. While U...
November 12, 2009
We discussed exact solutions of the Schroedinger equation for a two-dimensional parabolic confinement potential in a homogeneous external magnetic field. It turns out that the two-electron system is exactly solvable in the sense, that the problem can be reduced to numerically solving one radial Schroedinger equation. For a denumerably infinite set of values of the effective oscillator frequency $\tilde{\omega}=\sqrt{\omega_0^2+(\omega_c/2)^2}$ (where $\omega_0$ is the frequen...
August 27, 2007
A trial wave function for two-dimensional quantum dot helium in an arbitrary perpendicular magnetic field (a system of two interacting electrons in a two-dimensional parabolic confinement potential) is introduced. A key ingredient of this trial wave function is a Jastrow pair correlation factor that has a displaced Gaussian form. The above choice of the pair correlation factor is instrumental on assuring the overall quality of the wave function at all values of the magnetic f...
July 15, 1996
We perform Hartree-Fock calculations to show that quantum dots (i.e. two dimensional systems of up to twenty interacting electrons in an external parabolic potential) undergo a gradual transition to a spin-polarized Wigner crystal with increasing magnetic field strength. The phase diagram and ground state energies have been determined. We tried to improve the ground state of the Wigner crystal by introducing a Jastrow ansatz for the wavefunction and performing a variational M...
February 23, 2000
Interelectron interactions and correlations in quantum dots can lead to spontaneous symmetry breaking of the self-consistent mean field resulting in formation of Wigner molecules. With the use of spin-and-space unrestricted Hartree-Fock (sS-UHF) calculations, such symmetry breaking is discussed for field-free conditions, as well as under the influence of an external magnetic field. Using as paradigms impurity-doped (as well as the limiting case of clean) two-electron quantum ...
May 5, 2004
Pinning of magnetic-field induced Wigner molecules (WMs) confined in parabolic two-dimensional quantum dots by a charged defect is studied by an exact diagonalization approach. We found a re-entrant pinning of the WMs as function of the magnetic field, a magnetic field induced re-orientation of the WMs and a qualitatively different pinning behaviour in the presence of a positive and negative Coulomb impurity.
April 1, 2004
The Roothaan and Pople-Nesbet approaches for real atoms are adapted to quantum dots in the presence of a magnetic field. Single-particle Gaussian basis sets are constructed, for each dot radius, under the condition of maximum overlap with the exact functions. The chemical potential, the charging energy and the total spin expected values have been calculated, and we have verified the validity of the quantum dot energy shell structure as well as the Hund rule for electronic occ...
June 21, 2001
We present a new method for calculating ground state properties of quantum dots in high magnetic fields. It takes into account the equilibrium positions of electrons in a Wigner cluster to minimize the interaction energy in the high field limit. Assuming perfect spin alignment the many-body trial function is a single Slater determinant of overlapping oscillator functions from the lowest Landau level centered at and near the classical equilibrium positions. We obtain an analyt...