1,827 research outputs found

    Ab-initio Prediction of Conduction Band Spin Splitting in Zincblende Semiconductors

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    We use a recently developed self-consistent GWGW approximation to present systematic \emph{ab initio} calculations of the conduction band spin splitting in III-V and II-V zincblende semiconductors. The spin orbit interaction is taken into account as a perturbation to the scalar relativistic hamiltonian. These are the first calculations of conduction band spin splittings based on a quasiparticle approach; and because the self-consistent GWGW scheme accurately reproduces the relevant band parameters, it is expected to be a reliable predictor of spin splittings. The results are compared to the few available experimental data and a previous calculation based on a model one-particle potential. We also briefly address the widely used {\bf k}⋅\cdot{\bf p} parameterization in the context of these results.Comment: 9 pages, 1 figur

    GW method applied to localized 4f electron systems

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    We apply a recently developed quasiparticle self-consistent GWGW method (QSGW) to Gd, Er, EuN, GdN, ErAs, YbN and GdAs. We show that QSGW combines advantages separately found in conventional GWGW and LDA+UU theory, in a simple and fully \emph{ab initio} way. \qsgw reproduces the experimental occupied 4f4f levels well, though unoccupied levels are systematically overestimated. Properties of the Fermi surface responsible for electronic properties are in good agreement with available experimental data. GdN is predicted to be very near a critical point of a first-order metal-insulator transition.Comment: 5 pages,3 figures, 2 table

    Spin wave dispersion based on the quasiparticle self-consistent GWGW method: NiO, MnO and α\alpha-MnAs

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    We present spin wave dispersions in MnO, NiO, and α\alpha-MnAs based on the quasiparticle self-consistent GWGW method (\qsgw), which determines an optimum quasiparticle picture. For MnO and NiO, \qsgw results are in rather good agreement with experiments, in contrast to the LDA and LDA+U description. For α\alpha-MnAs, we find a collinear ferromagnetic ground state in \qsgw, while this phase is unstable in the LDA.Comment: V2: add another figure for SW life time. Formalism is detaile

    Hydrodynamic limit for weakly asymmetric simple exclusion processes in crystal lattices

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    We investigate the hydrodynamic limit for weakly asymmetric simple exclusion processes in crystal lattices. We construct a suitable scaling limit by using a discrete harmonic map. As we shall observe, the quasi-linear parabolic equation in the limit is defined on a flat torus and depends on both the local structure of the crystal lattice and the discrete harmonic map. We formulate the local ergodic theorem on the crystal lattice by introducing the notion of local function bundle, which is a family of local functions on the configuration space. The ideas and methods are taken from the discrete geometric analysis to these problems. Results we obtain are extensions of ones by Kipnis, Olla and Varadhan to crystal lattices.Comment: 41 pages, 7 figure

    Crystal growth and in-plane optical properties of Tl2_2Ba2_2Can−1_{n-1}Cun_nOx_x (n=1,2,3) superconductors

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    Single crystals of thallium-based cuprates with the general formula Tl2_{2}Ba2_{2}Can−1_{n-1}Cun_{n}Ox_{x}(n=1,2,3) have been grown by the flux method. The superconducting transition temperatures determined by the ac magnetic susceptibility are 92 K, 109 K, and 119 K for n=1,2,3 respectively. X-ray diffraction measurements and EDX compositional analysis were described. We measured in-plane optical reflectance from room temperature down to 10 K, placing emphasis on Tl-2223. The reflectance roughly has a linear-frequency dependence above superconducting transition temperature, but displays a pronounced knee structure together with a dip-like feature at higher frequency below Tc_c. Correspondingly, the ratio of the reflectances below and above Tc_{c} displays a maximum and a minimum near those feature frequencies. In particular, those features in Tl2223 appear at higher energy scale than Tl2212, and Tl2201. The optical data are analyzed in terms of spectral function. We discussed the physical consequences of the data in terms of both clean and dirty limit.Comment: 8 pages, 13 figures, to be published in Phys. Rev.

    Electronic structure investigation of CeB6 by means of soft X-ray scattering

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    The electronic structure of the heavy fermion compound CeB6 is probed by resonant inelastic soft X-ray scattering using photon energies across the Ce 3d and 4d absorption edges. The hybridization between the localized 4f orbitals and the delocalized valence-band states is studied by identifying the different spectral contributions from inelastic Raman scattering and normal fluorescence. Pronounced energy-loss structures are observed below the elastic peak at both the 3d and 4d thresholds. The origin and character of the inelastic scattering structures are discussed in terms of charge-transfer excitations in connection to the dipole allowed transitions with 4f character. Calculations within the single impurity Anderson model with full multiplet effects are found to yield consistent spectral functions to the experimental data.Comment: 9 pages, 4 figures, 1 table, http://link.aps.org/doi/10.1103/PhysRevB.63.07510

    Many-body Electronic Structure of Metallic alpha-Uranium

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    We present results for the electronic structure of alpha uranium using a recently developed quasiparticle self-consistent GW method (QSGW). This is the first time that the f-orbital electron-electron interactions in an actinide has been treated by a first-principles method beyond the level of the generalized gradient approximation (GGA) to the local density approximation (LDA). We show that the QSGW approximation predicts an f-level shift upwards of about 0.5 eV with respect to the other metallic s-d states and that there is a significant f-band narrowing when compared to LDA band-structure results. Nonetheless, because of the overall low f-electron occupation number in uranium, ground-state properties and the occupied band structure around the Fermi energy is not significantly affected. The correlations predominate in the unoccupied part of the f states. This provides the first formal justification for the success of LDA and GGA calculations in describing the ground-state properties of this material.Comment: 4 pages, 3 fihgure

    Strain-Induced Conduction Band Spin Splitting in GaAs from First Principles Calculations

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    We use a recently developed self-consistent GW approximation to present first principles calculations of the conduction band spin splitting in GaAs under [110] strain. The spin orbit interaction is taken into account as a perturbation to the scalar relativistic hamiltonian. These are the first calculations of conduction band spin splitting under deformation based on a quasiparticle approach; and because the self-consistent GW scheme accurately reproduces the relevant band parameters, it is expected to be a reliable predictor of spin splittings. We also discuss the spin relaxation time under [110] strain and show that it exhibits an in-plane anisotropy, which can be exploited to obtain the magnitude and sign of the conduction band spin splitting experimentally.Comment: 8 pages, 4 figures, 1 tabl

    A Massive Jet Ejection Event from the Microquasar SS 433 Accompanying Rapid X-Ray Variability

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    Microquasars occasionally exhibit massive jet ejections which are distinct from the continuous or quasi-continuous weak jet ejections. Because those massive jet ejections are rare and short events, they have hardly been observed in X-ray so far. In this paper, the first X-ray observation of a massive jet ejection from the microquasar SS 433 with the Rossi X-ray Timing Explorer (RXTE) is reported. SS 433 undergoing a massive ejection event shows a variety of new phenomena including a QPO-like feature near 0.1 Hz, rapid time variability, and shot-like activities. The shot-like activity may be caused by the formation of a small plasma bullet. A massive jet may be consist of thousands of those plasma bullets ejected from the binary system. The size, mass, internal energy, and kinetic energy of the bullets and the massive jet are estimated.Comment: 21 pages including 5 figures, submitted to Ap
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