The role of lighter and heavier embedded nanoparticles on the thermal conductivity of SiGe alloys

We have used an atomistic {\it ab initio} approach with no adjustable parameters to compute the lattice thermal conductivity of Si$_{0.5}$Ge$_{0.5}$ with a low concentration of embedded Si or Ge nanoparticles of diameters up to 4.4 nm. Through exact Green's function calculation of the nanoparticle scattering rates, we find that embedding Ge nanoparticles in $\text{Si}_{0.5}\text{Ge}_{0.5}$ provides 20% lower thermal conductivities than embedding Si nanoparticles. This contrasts with the Born approximation which predicts an equal amount of reduction for the two cases, irrespective of the sign of the mass difference. Despite these differences, we find that the Born approximation still performs remarkably well, and it permits investigation of larger nanoparticle sizes, up to 60 nm in diameter, not feasible with the exact approach.Comment: 13 pages, 5 figures, Accepted for publication in Physical Review

Doublet structures in quantum well absorption spectra due to Fano-related interference

In this theoretical investigation we predict an unusual interaction between a discrete state and a continuum of states, which is closely related to the case of Fano-interference. It occurs in a GaAs/AlxGa1-xAs quantum well between the lowest light-hole exciton and the continuum of the second heavy-hole exciton. Unlike the typical case for Fano-resonance, the discrete state here is outside the continuum; we use uniaxial stress to tune its position with respect to the onset of the continuum. State-of-the art calculations of absorption spectra show that as the discrete state approaches the continuum, a doublet structure forms which reveals anticrossing behaviour. The minimum separation energy of the anticrossing depends characteristically on the well width and is unusually large for narrow wells. This offers striking evidence for the strong underlying valence-band mixing. Moreover, it proves that previous explanations of similar doublets in experimental data, employing simple two-state models, are incomplete.Comment: 21 pages, 5 figures and 5 equations. Accepted for publication in Physical Review

Diffusion and Transport Coefficients in Synthetic Opals

Opals are structures composed of the closed packing of spheres in the size range of nano-to-micro meter. They are sintered to create small necks at the points of contact. We have solved the diffusion problem in such structures. The relation between the diffusion coefficient and the termal and electrical conductivity makes possible to estimate the transport coefficients of opal structures. We estimate this changes as function of the neck size and the mean-free path of the carriers. The theory presented is also applicable to the diffusion problem in other periodic structures.Comment: Submitted to PR

Optically-controlled single-qubit rotations in self-assembled InAs quantum dots

We present a theory of the optical control of the spin of an electron in an InAs quantum dot. We show how two Raman-detuned laser pulses can be used to obtain arbitrary single-qubit rotations via the excitation of an intermediate trion state. Our theory takes into account a finite in-plane hole $g$-factor and hole-mixing. We show that such rotations can be performed to high fidelities with pulses lasting a few tens of picoseconds.Comment: 6 pages, 4 figures; minor changes, J-ref adde

Orbital current mode in elliptical quantum dots

An orbital current mode peculiar to deformed quantum dots is theoretically investigated; first by using a simple model that allows to interpret analytically its main characteristics, and second, by numerically solving the microscopic equations of time evolution after an initial perturbation within the time-dependent local-spin-density approximation. Results for different deformations and sizes are shown.Comment: 4 REVTEX pages, 4 PDF figures, accepted in PRB:R

Relativistic three-body bound states and the reduction from four to three dimensions

Beginning with an effective field theory based upon meson exchange, the Bethe-Salpeter equation for the three-particle propagator (six-point function) is obtained. Using the one-boson-exchange form of the kernel, this equation is then analyzed using time-ordered perturbation theory, and a three-dimensional equation for the propagator is developed. The propagator consists of a pre-factor in which the relative energies are fixed by the initial state of the particles, an intermediate part in which only global propagation of the particles occurs, and a post-factor in which relative energies are fixed by the final state of the particles. The pre- and post-factors are necessary in order to account for the transition from states where particles are off their mass shell to states described by the global propagator with all of the particle energies on shell. The pole structure of the intermediate part of the propagator is used to determine the equation for the three-body bound state: a Schr{\"o}dinger-like relativistic equation with a single, global Green's function. The role of the pre- and post-factors in the relativistic dynamics is to incorporate the poles of the breakup channels in the initial and final states. The derivation of this equation by integrating over the relative times rather than via a constraint on relative momenta allows the inclusion of retardation and dynamical boost corrections without introducing unphysical singularities.Comment: REVTeX, 21 pages, 4 figures, epsf.st

Center-of-Mass Properties of the Exciton in Quantum Wells

We present high-quality numerical calculations of the exciton center-of-mass dispersion for GaAs/AlGaAs quantum wells of widths in the range 2-20 nm. The k.p-coupling of the heavy- and light-hole bands is fully taken into account. An optimized center-of-mass transformation enhances numerical convergence. We derive an easy-to-use semi-analytical expression for the exciton groundstate mass from an ansatz for the exciton wavefunction at finite momentum. It is checked against the numerical results and found to give very good results. We also show multiband calculations of the exciton groundstate dispersion using a finite-differences scheme in real space, which can be applied to rather general heterostructures.Comment: 19 pages, 12 figures included, to be published in Phys. Rev.

Collective charge-density excitations of non-circular quantum dots in a magnetic field

Recent photoabsorption measurements have revealed a rich fine structure in the collective charge-density excitation spectrum of few-electron quantum dots in the presence of magnetic fields. We have performed systematic computational studies of the far-infrared density response of quantum dots, using time-dependent density-functional theory in the linear regime and treating the dots as two-dimensional disks. It turns out that the main characteristics observed in the experiment can be understood in terms of the electronic shell structure of the quantum dots. However, new features arise if a breaking of the circular symmetry of the dots is allowed, leading to an improved description of the experimental results.Comment: 18 pages, 5 figures, submitted to Phys. Rev.

Magnetization of noncircular quantum dots

We calculate the magnetization of quantum dots deviating from circular symmetry for noninteracting electrons or electrons interacting according to the Hartree approximation. For few electrons the magnetization is found to depend on their number, and the shape of the dot. The magnetization is an ideal probe into the many-electron state of a quantum dot.Comment: 11 RevTeX pages with 6 included Postscript figure

Magnetoplasmon excitations in arrays of circular and noncircular quantum dots

We have investigated the magnetoplasmon excitations in arrays of circular and noncircular quantum dots within the Thomas-Fermi-Dirac-von Weizs\"acker approximation. Deviations from the ideal collective excitations of isolated parabolically confined electrons arise from local perturbations of the confining potential as well as interdot Coulomb interactions. The latter are unimportant unless the interdot separations are of the order of the size of the dots. Local perturbations such as radial anharmonicity and noncircular symmetry lead to clear signatures of the violation of the generalized Kohn theorem. In particular, the reduction of the local symmetry from SO(2) to $C_4$ results in a resonant coupling of different modes and an observable anticrossing behaviour in the power absorption spectrum. Our results are in good agreement with recent far-infrared (FIR) transmission experiments.Comment: 25 pages, 6 figures, typeset in RevTe