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J. Braun

Publications and source records attributed to J. Braun.

288 records · Page 16Linked to original sources

Calculation of angle-resolved photo emission spectra within the one-step model of photo emission - recent developments

Various technical developments enlarged the potential of angle-resolved photo emission (ARPES) tremendously during the last one or two decades. In particular improved momentum and energy resolution as well as the use of photon energies from few eV up to several keV makes ARPES a rather unique tool to investigate the electronic properties of solids and surfaces. Obviously, this rises the need for a corresponding theoretical formalism that allows to accompany experimental ARPES studies in an adequate way. As will be demonstrated by several examples this goal could be achieved by various recent developments on the basis of the one-step model of photo emission: The spin-orbit induced Rashba-splitting of Shockley-type surface states is discussed using a fully relativistic description. The impact of chemical disorder within surface layers can be handled by means of the Coherent Potential Approximation (CPA) alloy theory. Calculating phonon properties together with the corresponding electron-phonon self-energy allows a direct comparison with features in the ARPES spectra caused by electron-phonon interaction. The same holds for the influence of electronic correlation effects. These are accounted for by means of the dynamical mean field theory (DMFT) that removes the most serious short comings of standard calculations based on the standard LDA. The combination of this approach with the CPA allows the investigation of correlated transition metal alloys. Finally, accounting for the photon momentum and going beyond the single scatter approximation for the final state allows to deal quantitatively with ARPES in the HAXPES regime that reduces the influence of the surface on the spectra and probing primarily the bulk electronic structure this way. Corresponding calculations of ARPES spectra, however, have to deal with thermal vibrations in an adequate way.

cond-mat.mtrl-sci↗

The first search for extremely-high energy cosmogenic neutrinos with the IceCube Neutrino Observatory

We report on the results of the search for extremely-high energy (EHE) neutrinos with energies above $10^7$ GeV obtained with the partially ($\sim$30%) constructed IceCube in 2007. From the absence of signal events in the sample of 242.1 days of effective livetime, we derive a 90% C.L. model independent differential upper limit based on the number of signal events per energy decade at $E^2 ϕ_{ν_e+ν_μ+ν_τ}\simeq 1.4 \times 10^{-6}$ GeV cm$^{-2}$ sec$^{-1}$ sr$^{-1}$ for neutrinos in the energy range from $3\times10^7$ to $3\times10^9$ GeV.

astro-ph.CO↗

Quantitative determination of spin-dependent quasiparticle lifetimes and electronic correlations in hcp cobalt

We report on a quantitative investigation of the spin-dependent quasiparticle lifetimes and electron correlation effects in ferromagnetic hcp Co(0001) by means of spin and angle-resolved photoemission spectroscopy. The experimental spectra are compared in detail to state-of-the-art many-body calculations within the dynamical mean field theory and the three-body scattering approximation, including a full calculation of the one-step photoemission process. From this comparison we conclude that although strong local many-body Coulomb interactions are of major importance for the qualitative description of correlation effects in Co, more sophisticated many-body calculations are needed in order to improve the quantitative agreement between theory and experiment, in particular concerning the linewidths. The quality of the overall agreement obtained for Co indicates that the effect of non-local correlations becomes weaker with increasing atomic number.

cond-mat.mtrl-sci↗

Calibration and Characterization of the IceCube Photomultiplier Tube

Over 5,000 PMTs are being deployed at the South Pole to compose the IceCube neutrino observatory. Many are placed deep in the ice to detect Cherenkov light emitted by the products of high-energy neutrino interactions, and others are frozen into tanks on the surface to detect particles from atmospheric cosmic ray showers. IceCube is using the 10-inch diameter R7081-02 made by Hamamatsu Photonics. This paper describes the laboratory characterization and calibration of these PMTs before deployment. PMTs were illuminated with pulses ranging from single photons to saturation level. Parameterizations are given for the single photoelectron charge spectrum and the saturation behavior. Time resolution, late pulses and afterpulses are characterized. Because the PMTs are relatively large, the cathode sensitivity uniformity was measured. The absolute photon detection efficiency was calibrated using Rayleigh-scattered photons from a nitrogen laser. Measured characteristics are discussed in the context of their relevance to IceCube event reconstruction and simulation efforts.

astro-ph.IM↗

About the strength of correlation effects in the electronic structure of iron

The strength of electronic correlation effects in the spin-dependent electronic structure of ferromagnetic bcc Fe(110) has been investigated by means of spin and angle-resolved photoemission spectroscopy. The experimental results are compared to theoretical calculations within the three-body scattering approximation and within the dynamical mean-field theory, together with one-step model calculations of the photoemission process. This comparison indicates that the present state of the art many-body calculations, although improving the description of correlation effects in Fe, give too small mass renormalizations and scattering rates thus demanding more refined many-body theories including non-local fluctuations.

cond-mat.str-el↗

gamma-Mn at the border between weak and strong correlations

We investigate the role of magnetic fluctuations in the spectral properties of paramagnetic gamma-Mn. Two methods are employed. The Local Density Approximation plus Dynamical Mean-Field Theory together with the numerically exact quantum Monte-Carlo solver is used as a reference for the spectral properties. Then the same scheme is used with the computationally less demanding perturbative spin-polarized fluctuation-exchange solver in combination with the Disordered Local Moment approach, and photoemission spectra are calculated within the one-step model. It is shown that the formation of local magnetic moments in gamma-Mn is very sensitive to the value of Hund's exchange parameter. Comparison with the experimental photoemission spectra demonstrates that gamma-Mn is a strongly correlated system, with the Hubbard band formation, which cannot be described by the perturbative approach. However, minor change of parameters would transform it into a weakly correlated system.

cond-mat.str-el↗

Electron correlations in Co$_2$Mn$_{1-x}$Fe$_x$Si Heusler compounds

This study presents the effect of local electronic correlations on the Heusler compounds Co$_2$Mn$_{1-x}$Fe$_x$Si as a function of the concentration $x$. The analysis has been performed by means of first-principles band-structure calculations based on the local approximation to spin-density functional theory (LSDA). Correlation effects are treated in terms of the Dynamical Mean-Field Theory (DMFT) and the LSDA+U approach. The formalism is implemented within the Korringa-Kohn-Rostoker (KKR) Green's function method. In good agreement with the available experimental data the magnetic and spectroscopic properties of the compound are explained in terms of strong electronic correlations. In addition the correlation effects have been analysed separately with respect to their static or dynamical origin. To achieve a quantitative description of the electronic structure of Co$_2$Mn$_{1-x}$Fe$_x$Si both static and dynamic correlations must be treated on equal footing.

cond-mat.str-el↗

RG flow of the Polyakov-loop potential: First status report

We study SU(2) Yang-Mills theory at finite temperature in the framework of the functional renormalization group. We concentrate on the effective potential for the Polyakov loop which serves as an order parameter for confinement. In this first status report, we focus on the behaviour of the effective Polyakov-loop potential at high temperatures. In addition to the standard perturbative result, our findings provide information about the ``RG improved'' backreactions of Polyakov-loop fluctuations on the potential. We demonstrate that these fluctuations establish the convexity of the effective potential.

hep-ph↗

Influence of quark boundary conditions on the pion mass in finite volume

We calculate the mass shift for the pion in a finite volume with renormalization group (RG) methods in the framework of the quark-mesons model. In particular, we investigate the importance of the quark effects on the pion mass. As in lattice gauge theory, the choice of quark boundary conditions has a noticeable effect on the pion mass shift in small volumes, in addition to the shift due to pion interactions. We compare our results to chiral perturbation theory calculations and find differences due to the fact that chiral perturbation theory only considers pion effects in the finite volume.

hep-ph↗

Volume and Quark Mass Dependence of the Chiral Phase Transition

We investigate chiral symmetry restoration in finite spatial volume and at finite temperature by calculating the dependence of the chiral phase transition temperature on the size of the spatial volume and the current-quark mass for the quark-meson model, using the proper-time Renormalization Group approach. We find that the critical temperature is weakly dependent on the size of the spatial volume for large current-quark masses, but depends strongly on it for small current-quark masses. In addition, for small volumes we observe a dependence on the choice of quark boundary conditions.

hep-ph↗

Volume Dependence of the Pion Mass in the Quark-Meson-Model

We consider the quark-meson-model in a finite three-dimensional volume using the Schwinger proper-time renormalization group. We derive and solve the flow equations for finite volume in local potential approximation. In order to break chiral symmetry in the finite volume, we introduce a small current quark mass. The corresponding effective meson potential breaks chiral O(4) symmetry explicitly, depending on sigma and pion fields separately. We calculate the volume dependence of the pion mass and of the pion decay constant with the renormalization group flow equations and compare with recent results from chiral perturbation theory in a finite volume.

hep-ph↗

Volume Dependence of the Pion Mass from Renormalization Group Flows

We investigate finite volume effects on the pion mass and the pion decay constant with renormalization group (RG) methods in the framework of a phenomenological model for QCD. An understanding of such effects is important in order to interpret results from lattice QCD and extrapolate reliably from finite lattice volumes to infinite volume. We consider the quark-meson-model in a finite Euclidean 3+1 dimensional volume. In order to break chiral symmetry in the finite volume, we introduce a small current quark mass. In the corresponding effective potential for the meson fields, the chiral O(4)-symmetry is broken explicitly, and the sigma and pion fields are treated individually. Using the proper-time renormalization group, we derive renormalization group flow equations in the finite volume and solve these equations in the approximation of a constant expectation value. We calculate the volume dependence of pion mass and pion decay constant and compare our results with recent results from chiral perturbation theory in finite volume.

hep-ph↗

Electron-correlation effects in appearance-potential spectra of Ni

Spin-resolved and temperature-dependent appearance-potential spectra of ferromagnetic Nickel are measured and analyzed theoretically. The Lander self-convolution model which relates the line shape to the unoccupied part of the local density of states turns out to be insufficient. Electron correlations and orbitally resolved transition-matrix elements are shown to be essential for a quantitative agreement between experiment and theory.

cond-mat.str-el↗

Combined He-atom scattering and theoretical study of the low energy vibrations of physisorbed monolayers of Xe on Cu(111) and Cu(001)

The surface phonon dispersion curves of commensurate Xe monolayers on Cu(111) and incommensurate Xe monolayers on Cu(001) surfaces have been measured using He atom scattering (HAS) time of flight (TOF) spectroscopy. The TOF spectra are interpreted by combining quantum scattering calculations with the dynamical matrix description of the surface vibrations. Both a vertically polarized Einstein-like mode and another, acoustic-like mode of dominantly longitudinal character, are identified. The latter mode is characterized by the presence and absence of the zone center frequency gap in the commensurate and incommensurate adlayers, respectively. The microscopic description of the TOF spectral intensities is based on the extensive theoretical studies of the interplay of the phonon dynamics, projectile-surface potentials, multi-quantum interference and projectile recoil, and their effect on the HAS spectra. Both single and multi-quantum spectral features observed over a wide range of He atom incident energies and substrate temperatures are successfully explained by the theory.

cond-mat.mtrl-sci↗

Relativistic photoemission theory for general nonlocal potentials

An improved formulation of the one-step model of photoemission from crystal surfaces is proposed which overcomes different limitations of the original theory. Considering the results of an electronic-structure calculation, the electronic (one-particle) potential and the (many-body) self-energy, as given quantities, we derive explicit expressions for the dipole transition-matrix elements. The theory is formulated within a spin-polarized, relativistic framework for general nonspherical and space-filling one-particle potentials and general nonlocal, complex and energy-dependent self-energies. It applies to semi-infinite lattices with perfect lateral translational invariance and arbitrary number of atoms per unit cell.

cond-mat.str-el↗

One-step model of photoemission for non-local potentials

The one-step model of valence-band photoemission and inverse photoemission from single-crystal surfaces is reformulated for generalized (non-local, complex and energy-dependent) potentials. Thereby, it becomes possible to account for self-energy corrections taken from many-body electronic-structure calculations. The original formulation due to Pendry and co-workers employs the KKR multiple-scattering theory for the calculation of the initial state. This prevents a straightforward generalization of the one-step model to non-local potentials. We therefore consider the Dyson equation which is set up within a muffin-tin-orbitals representation as an alternative to obtain the initial-state Green function. This approach requires a revision of the transition-matrix elements which is carried out in detail. The final state is considered as a time-reversed LEED state as usual. The proposed generalization of the one-step model allows to distinguish between the bare photocurrent reflecting the (quasi-particle) band structure and the secondary effects due to the (dipole) selection rules and due to the wave-vector and energy dependence of the transition-matrix elements.

cond-mat.str-el↗