Landau Fermi Liquid Picture of Spin Density Functional Theory: Strutinsky Approach to Quantum Dots

We analyze the ground state energy and spin of quantum dots obtained from spin density functional theory (SDFT) calculations. First, we introduce a Strutinsky-type approximation, in which quantum interference is treated as a correction to a smooth Thomas-Fermi description. For large irregular dots, we find that the second-order Strutinsky expressions have an accuracy of about 5 percent compared to the full SDFT and capture all the qualitative features. Second, we perform a random matrix theory/random plane wave analysis of the Strutinsky SDFT expressions. The results are statistically similar to the SDFT quantum dot statistics. Finally, we note that the second-order Strutinsky approximation provides, in essence, a Landau Fermi liquid picture of spin density functional theory. For instance, the leading term in the spin channel is simply the familiar exchange constant. A direct comparison between SDFT and the perturbation theory derived ``universal Hamiltonian'' is thus made possible.Comment: Submitted to Physical Review

Electron-Electron Interactions in Isolated and Realistic Quantum Dots: A Density Functional Theory Study

We use Kohn-Sham spin-density-functional theory to study the statistics of ground-state spin and the spacing between conductance peaks in the Coulomb blockade regime for both 2D isolated and realistic quantum dots. We make a systematic investigation of the effects of electron-electron interaction strength and electron number on both the peak spacing and spin distributions. A direct comparison between the distributions from isolated and realistic dots shows that, despite the difference in the boundary conditions and confining potential, the statistical properties are qualitatively the same. Strong even/odd pairing in the peak spacing distribution is observed only in the weak e-e interaction regime and vanishes for moderate interactions. The probability of high spin ground states increases for stronger e-e interaction and seems to saturate around $r_s \sim 4$. The saturated value is larger than previous theoretical predictions. Both spin and conductance peak spacing distributions show substantial variation as the electron number increases, not saturating until $N \sim 150$. To interpret our numerical results, we analyze the spin distribution in the even $N$ case using a simple two-level model.Comment: 10 pages, 12 figures, submitted to Phys. Rev.

Mesoscopic Anderson Box: Connecting Weak to Strong Coupling

Both the weakly coupled and strong coupling Anderson impurity problems are characterized by a Fermi-liquid theory with weakly interacting quasiparticles. In an Anderson box, mesoscopic fluctuations of the effective single particle properties will be large. We study how the statistical fluctuations at low temperature in these two problems are connected, using random matrix theory and the slave boson mean field approximation (SBMFA). First, for a resonant level model such as results from the SBMFA, we find the joint distribution of energy levels with and without the resonant level present. Second, if only energy levels within the Kondo resonance are considered, the distributions of perturbed levels collapse to universal forms for both orthogonal and unitary ensembles for all values of the coupling. These universal curves are described well by a simple Wigner-surmise type toy model. Third, we study the fluctuations of the mean field parameters in the SBMFA, finding that they are small. Finally, the change in the intensity of an eigenfunction at an arbitrary point is studied, such as is relevant in conductance measurements: we find that the introduction of the strongly-coupled impurity considerably changes the wave function but that a substantial correlation remains.Comment: 17 pages, 7 figure

One-body energy dissipation in fusion reaction from mean-field theory

Information on dissipation in the entrance channel of heavy-ion collisions is extracted by macroscopic reduction procedure of Time-Dependent Hartree-Fock theory. The method gives access to a fully microscopic description of the friction coefficient associated with transfer of energy from the relative motion towards intrinsic degrees of freedom. The reduced friction coefficient exhibits a universal behavior, i.e. almost independent of systems investigated, whose order of magnitude is comparable with the calculations based on linear response theory. Similarly to nucleus-nucleus potential, especially close to the Coulomb barrier, there are sizable dynamical effects on the magnitude and form factor of friction coefficient.Comment: 7 pages, 10 figure

Persistence of coherent quantum dynamics at strong dissipation

The quantum dynamics of a two state system coupled to a bosonic reservoir with sub-Ohmic spectral density is investigated for strong friction. Numerically exact path integral Monte Carlo methods reveal that in contrast to conventional expectations, coherent dynamics never turns into incoherent decay for a broad class of spectral distributions. Coherences associated with substantial system-reservoir entanglement exist in non-equilibrium even when strong dissipation makes the thermodynamic state of the system to behave essentially classical. This may be of relevance for current experiments with nanoscale devices and bio-molecular aggregates.Comment: 5 pages, 5 figure

Incipient Wigner Localization in Circular Quantum Dots

We study the development of electron-electron correlations in circular quantum dots as the density is decreased. We consider a wide range of both electron number, N<=20, and electron gas parameter, r_s<18, using the diffusion quantum Monte Carlo technique. Features associated with correlation appear to develop very differently in quantum dots than in bulk. The main reason is that translational symmetry is necessarily broken in a dot, leading to density modulation and inhomogeneity. Electron-electron interactions act to enhance this modulation ultimately leading to localization. This process appears to be completely smooth and occurs over a wide range of density. Thus there is a broad regime of ``incipient'' Wigner crystallization in these quantum dots. Our specific conclusions are: (i) The density develops sharp rings while the pair density shows both radial and angular inhomogeneity. (ii) The spin of the ground state is consistent with Hund's (first) rule throughout our entire range of r_s for all 4<N<20. (iii) The addition energy curve first becomes smoother as interactions strengthen -- the mesoscopic fluctuations are damped by correlation -- and then starts to show features characteristic of the classical addition energy. (iv) Localization effects are stronger for a smaller number of electrons. (v) Finally, the gap to certain spin excitations becomes small at the strong interaction (large r_s) side of our regime.Comment: 14 pages, 12 figure

Functional integral for non-Lagrangian systems

A novel functional integral formulation of quantum mechanics for non-Lagrangian systems is presented. The new approach, which we call "stringy quantization," is based solely on classical equations of motion and is free of any ambiguity arising from Lagrangian and/or Hamiltonian formulation of the theory. The functionality of the proposed method is demonstrated on several examples. Special attention is paid to the stringy quantization of systems with a general A-power friction force $-\kappa[\dot{q}]^A$. Results for $A = 1$ are compared with those obtained in the approaches by Caldirola-Kanai, Bateman and Kostin. Relations to the Caldeira-Leggett model and to the Feynman-Vernon approach are discussed as well.Comment: 14 pages, 7 figures, corrected typo

Fermi-Edge Singularities in the Mesoscopic X-Ray Edge Problem

We study the x-ray edge problem for a chaotic quantum dot or nanoparticle displaying mesoscopic fluctuations. In the bulk, x-ray physics is known to produce deviations from the naively expected photoabsorption cross section in the form of a peaked or rounded edge. For a coherent system with chaotic dynamics, we find substantial changes and in particular that a photoabsorption cross section showing a rounded edge in the bulk will change to a slightly peaked edge on average as the system size is reduced to a mesoscopic (coherent) scale.Comment: 4 pages, 3 figures, final version as published in PR

Semiclassical Density Functional Theory: Strutinsky Energy Corrections in Quantum Dots

We develop a semiclassical density functional theory in the context of quantum dots. Coulomb blockade conductance oscillations have been measured in several experiments using nanostructured quantum dots. The statistical properties of these oscillations remain puzzling, however, particularly the statistics of spacings between conductance peaks. To explore the role that residual interactions may play in the spacing statistics, we consider many-body systems which include electron-electron interactions through an explicit density functional. First, we develop an approximate series expansion for obtaining the ground state using the idea of the Strutinsky shell correction method. Next, we relate the second-order semiclassical corrections to the screened Coulomb potential. Finally, we investigate the validity of the approximation method by numerical calculation of a one-dimensional model system, and show the relative magnitudes of the successive terms as a function of particle number

Interactions and Broken Time-Reversal Symmetry in Chaotic Quantum Dots

When treating interactions in quantum dots within a RPA-like approach, time-reversal symmetry plays an important role as higher-order terms -- the Cooper series -- need to be included when this symmetry is present. Here we consider model quantum dots in a magnetic field weak enough to leave the dynamics of the dot chaotic, but strong enough to break time-reversal symmetry. The ground state spin and addition energy for dots containing 120 to 200 electrons are found using local spin density functional theory, and we compare the corresponding distributions with those derived from an RPA-like treatment of the interactions. The agreement between the two approaches is very good, significantly better than for analogous calculations in the presence of time-reversal symmetry. This demonstrates that the discrepancies between the two approaches in the time-reversal symmetric case indeed originate from the Cooper channel, indicating that these higher-order terms might not be properly taken into account in the spin density functional calculations.Comment: 4 pages, 3 figure