0000000000476295
AUTHOR
J. Kolehmainen
Linear Nuclei: A Density Functional Interpretation
We show that linear shape isomers of small even-even nuclei exist with nearly any internucleon interactions. The shapes of the linear isomers look like chains of alpha-particles, but single-particle spectrum reveals that alpha-particle interpretation is not needed. Indeed, the same shapes are obtained even with noninteracting particles in a rectangular cavity. Linear shape isomers are shown to exist also in metal clusters.
Electronic and magnetic structure of artificial atoms
The concept of shell structure has been found useful in the description of semiconductor quantum dots, which today can be made so small that they contain less than 20 electrons. We review the experimental discovery of magic numbers and spin alignment following Hund’s rules in the addition spectra of vertical quantum dots, and show that these results compare well to model calculations within spin density functional theory. We further discuss the occurrence of spin density waves in quantum dots and quantum wires. For deformable two-dimensional quantum dots (for example, jellium clusters on surfaces), we study the interplay between Hund’s rules and Jahn–Teller deformations and investigate the …
Metal clusters on an inert surface: A simple model
The shapes of metal clusters (with 2 to 14 valence electrons) on an inert surface are studied with a simple model based on the ultimate jellium model. It is shown that within certain approximations the surface-cluster interaction can be described with an external potential in the Kohn-Sham method. No restrictions for the cluster geometry are imposed. The results show that depending on the strength of the interaction and on the size of the cluster, the ground state is either planar or three-dimensional, but in many cases both geometries are stable and there is a marked energy barrier between them. The results agree qualitatively with ab initio calculations of Na clusters on a NaCl(100) surfa…
Magnetic interaction between coupled quantum dots
We study the magnetic coupling in artificial molecules composed of two and four laterally coupled quantum dots. The electronic ground-state configurations of such systems are determined by applying current spin density functional theory which allows to include effects of magnetic fields. While the ground-state of a two-dot molecule with strong enough inter-dot coupling tends to be antiferromagnetic with respect to the spins of the single dot components, we find that a square lattice of four dots has a ferromagnetic ground state.
Quantum dots in magnetic fields: Unrestricted symmetries in the current spin-density functional formalism
We apply the current spin-density functional formalism (CSDFT) of Vignale and Rasolt to two-dimensional quantum dots in magnetic fields. Avoiding any spatial symmetry restrictions of the solutions, we find that a broken rotational symmetry of the electronic charge density can occur in high magnetic fields.