765 research outputs found

    Optical conductivity in A3C60 (A=K, Rb)

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    We study the optical conductivity in A3C60 (A =K, Rb). The effects of the electron-phonon interaction is included to lowest order in the coupling strength lambda. It is shown that this leads to a narrowing of the Drude peak by a factor 1+lambda and a transfer of weight to a mid-infrared peak at somewhat larger energies than the phonon energy. Although this goes in the right direction, it is not sufficient to describe experiment.Comment: 5 pages, revtex, 2 figures more information at http://librix.mpi-stuttgart.mpg.de/docs/ANDERSEN/fullerene

    Theory of quasiparticle spectra for Fe, Co, and Ni: bulk and surface

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    The correlated electronic structure of iron, cobalt and nickel is investigated within the dynamical mean-field theory formalism, using the newly developed full-potential LMTO-based LDA+DMFT code. Detailed analysis of the calculated electron self-energy, density of states and the spectral density are presented for these metals. It has been found that all these elements show strong correlation effects for majority spin electrons, such as strong damping of quasiparticles and formation of a density of states satellite at about -7 eV below the Fermi level. The LDA+DMFT data for fcc nickel and cobalt (111) surfaces and bcc iron (001) surface is also presented. The electron self energy is found to depend strongly on the number of nearest neighbors, and it practically reaches the bulk value already in the second layer from the surface. The dependence of correlation effects on the dimensionality of the problem is also discussed.Comment: 15 pages, 24 figure

    Dynamics of magnetization coupled to a thermal bath of elastic modes

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    We study the dynamics of magnetization coupled to a thermal bath of elastic modes using a system plus reservoir approach with realistic magnetoelastic coupling. After integrating out the elastic modes we obtain a self-contained equation for the dynamics of the magnetization. We find explicit expressions for the memory friction kernel and hence, {\em via} the Fluctuation-Dissipation Theorem, for the spectral density of the magnetization thermal fluctuations. For magnetic samples in which the single domain approximation is valid, we derive an equation for the dynamics of the uniform mode. Finally we apply this equation to study the dynamics of the uniform magnetization mode in insulating ferromagnetic thin films. As experimental consequences we find that the fluctuation correlation time is of the order of the ratio between the film thickness, hh, and the speed of sound in the magnet and that the line-width of the ferromagnetic resonance peak should scale as B12hB_1^2h where B1B_1 is the magnetoelastic coupling constant.Comment: Revised version as appeared in print. 12 pages 9 figure

    Adsorption of Cu, Ag, and Au atoms on graphene including van der Waals interactions

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    We performed a systematic density functional study of the adsorption of copper, silver, and gold adatoms on graphene, especially accounting for van der Waals interactions by the vdW-DF and the PBE+D2 methods. In particular, we analyze the preferred adsorption site (among top, bridge, and hollow positions) together with the corresponding distortion of the graphene sheet and identify diffusion paths. Both vdW schemes show that the coinage metal atoms do bind to the graphene sheet and that in some cases the buckling of the graphene can be significant. The results for silver are at variance with those obtained with GGA, which gives no binding in this case. However, we observe some quantitative differences between the vdW-DF and the PBE+D2 methods. For instance the adsorption energies calculated with the PBE+D2 method are systematically higher than the ones obtained with vdW-DF. Moreover, the equilibrium distances computed with PBE+D2 are shorter than those calculated with the vdW-DF method

    Possible polarisation and spin dependent aspects of quantum gravity

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    We argue that quantum gravity theories that carry a Lie algebraic modification of the Poincare' and Heisenberg algebras inevitably provide inhomogeneities that may serve as seeds for cosmological structure formation. Furthermore, in this class of theories one must expect a strong polarisation and spin dependence of various quantum-gravity effects.Comment: Awarded an "honourable mention" in the 2007 Gravity Research Foundation Essay Competitio

    Identification of (E)- and (Z)-11-tetradecenyl acetate as sex pheromone components of the currant pest Euhyponomeutoides albithoracellus

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    The currant bud moth Euhyponomeutoides albithoracellus is a destructive pest in black currant orchards in Northern Sweden and Finland. The larvae feed on the buds, and at high densities, the species can cause severe yield losses. Sex pheromone components of the bud moth were identified via solvent extraction of excised female pheromone glands, analyses by gas chromatography with electroantennographic detection and gas chromatography–mass spectrometry and field trapping experiments. Antennae of males responded strongly and consistently to two compounds in extracts, identified as (E)-11-tetradecenyl acetate and (Z)-11-tetradecenyl acetate. Weaker and less consistent responses were observed to the corresponding alcohols, (E)-11-tetradecenol and (Z)-11-tetradecenol, and tetradecyl acetate. Field tests showed strong attraction of bud moth males to a 1:1 blend of (E)-11-tetradecenyl acetate and (Z)-11-tetradecenyl acetate. Adding the alcohols to the binary acetate blend reduced trap catches drastically, whereas tetradecyl acetate had no statistically significant impact on male attraction when added to that binary blend. Finally, testing different compositions of the binary acetate blend revealed highest catch in traps baited with a 25:75 or 50:50 ratio of the E:Z acetate isomers. The identification of sex pheromone components of the bud moth contributes to developing sustainable control of this pest via monitoring and mating disruption with sex pheromone

    Photoelectron angular distributions in photodetachment from P-

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    The angular distributions of electrons ejected in laser photodetachment of the P- ion have been studied in the photon energy range of 0.95-3.28 eV using a photoelectron spectrometer designed to accommodate a source consisting of collinearly overlapping photon and negative ion beams. We observe the value of the asymmetry parameter β starting at zero near the threshold, falling to almost -1 about 0.5 eV above the threshold and eventually rising to a positive value. The experimental data has been fitted to a simplified model of the Cooper-Zare formula which yields a qualitative understanding of the quantum interference between the outgoing s and d waves representing the free electron. The present results are also compared with previous results for other elements involving p-electron photodetachment

    Carbon release by selective alloying of transition metal carbides

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    We have performed first principles density functional theory calculations on TiC alloyed on the Ti sublattice with 3d transition metals ranging from Sc to Zn. The theory is accompanied with experimental investigations, both as regards materials synthesis as well as characterization. Our results show that by dissolving a metal with a weak ability to form carbides, the stability of the alloy is lowered and a driving force for the release of carbon from the carbide is created. During thin film growth of a metal carbide this effect will favor the formation of a nanocomposite with carbide grains in a carbon matrix. The choice of alloying elements as well as their concentrations will affect the relative amount of carbon in the carbide and in the carbon matrix. This can be used to design the structure of nanocomposites and their physical and chemical properties. One example of applications is as low-friction coatings. Of the materials studied, we suggest the late 3d transition metals as the most promising elements for this phenomenon, at least when alloying with TiC.Comment: 9 pages, 6 figure

    Screening, Coulomb pseudopotential, and superconductivity in alkali-doped Fullerenes

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    We study the static screening in a Hubbard-like model using quantum Monte Carlo. We find that the random phase approximation is surprisingly accurate almost up to the Mott transition. We argue that in alkali-doped Fullerenes the Coulomb pseudopotential μ∗\mu^\ast is not very much reduced by retardation effects. Therefore efficient screening is important in reducing μ∗\mu^{\ast} sufficiently to allow for an electron-phonon driven superconductivity. In this way the Fullerides differ from the conventional picture, where retardation effects play a major role in reducing the electron-electron repulsion.Comment: 4 pages RevTeX with 2 eps figures, additional material available at http://www.mpi-stuttgart.mpg.de/docs/ANDERSEN/fullerene
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