729 research outputs found

    Electronic structure and optical properties of ZnX (X=O, S, Se, Te)

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    Electronic band structure and optical properties of zinc monochalcogenides with zinc-blende- and wurtzite-type structures were studied using the ab initio density functional method within the LDA, GGA, and LDA+U approaches. Calculations of the optical spectra have been performed for the energy range 0-20 eV, with and without including spin-orbit coupling. Reflectivity, absorption and extinction coefficients, and refractive index have been computed from the imaginary part of the dielectric function using the Kramers--Kronig transformations. A rigid shift of the calculated optical spectra is found to provide a good first approximation to reproduce experimental observations for almost all the zinc monochalcogenide phases considered. By inspection of the calculated and experimentally determined band-gap values for the zinc monochalcogenide series, the band gap of ZnO with zinc-blende structure has been estimated.Comment: 17 pages, 10 figure

    From white elephant to Nobel Prize: Dennis Gabor’s wavefront reconstruction

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    Dennis Gabor devised a new concept for optical imaging in 1947 that went by a variety of names over the following decade: holoscopy, wavefront reconstruction, interference microscopy, diffraction microscopy and Gaboroscopy. A well-connected and creative research engineer, Gabor worked actively to publicize and exploit his concept, but the scheme failed to capture the interest of many researchers. Gabor’s theory was repeatedly deemed unintuitive and baffling; the technique was appraised by his contemporaries to be of dubious practicality and, at best, constrained to a narrow branch of science. By the late 1950s, Gabor’s subject had been assessed by its handful of practitioners to be a white elephant. Nevertheless, the concept was later rehabilitated by the research of Emmett Leith and Juris Upatnieks at the University of Michigan, and Yury Denisyuk at the Vavilov Institute in Leningrad. What had been judged a failure was recast as a success: evaluations of Gabor’s work were transformed during the 1960s, when it was represented as the foundation on which to construct the new and distinctly different subject of holography, a re-evaluation that gained the Nobel Prize for Physics for Gabor alone in 1971. This paper focuses on the difficulties experienced in constructing a meaningful subject, a practical application and a viable technical community from Gabor’s ideas during the decade 1947-1957

    Coulomb correlation effects in zinc monochalcogenides

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    Electronic structure and band characteristics for zinc monochalcogenides with zinc-blende- and wurtzite-type structures are studied by first-principles density-functional-theory calculations with different approximations. It is shown that the local-density approximation underestimates the band gap and energy splitting between the states at the top of the valence band, misplaces the energy levels of the Zn-3d states, and overestimates the crystal-field-splitting energy. Regardless of the structure type considered, the spin-orbit-coupling energy is found to be overestimated for ZnO and underestimated for ZnS with wurtzite-type structure, and more or less correct for ZnSe and ZnTe with zinc-blende-type structure. The order of the states at the top of the valence band is found to be anomalous for ZnO in both zinc-blende- and wurtzite-type structure, but is normal for the other zinc monochalcogenides considered. It is shown that the Zn-3d electrons and their interference with the O-2p electrons are responsible for the anomalous order. The typical errors in the calculated band gaps and related parameters for ZnO originate from strong Coulomb correlations, which are found to be highly significant for this compound. The LDA+U approach is by and large found to correct the strong correlation of the Zn-3d electrons, and thus to improve the agreement with the experimentally established location of the Zn-3d levels compared with that derived from pure LDA calculations

    Laser-stimulated Synthesis of Large Nanostructured Fractal Silver Aggregates

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    A Laser-stimulated synthesis of large silver nanoaggregates consisting of hundreds to thousands of nanoparticles is investigated. It is shown that the morphology of the synthesized nanostructures can be controlled with light and monitored via the evolution of the colloid absorption spectra. A solution method is demonstrated that enables production of a bulk amount of metal nanoaggregates, which are of paramount importance for subwavelength concentration and dramatic enhancement of the electromagnetically-induced processes at the nanoscale.Comment: 10 pages, 8 figures, 13 reference

    The RKKY interactions and the Mott Transition

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    A two-site cluster generalization of the Hubbard model in large dimensions is examined in order to study the role of short-range spin correlations near the metal-insulator transition (MIT). The model is mapped to a two-impurity Kondo-Anderson model in a self-consistently determined bath, making it possible to directly address the competition between the Kondo effect and RKKY interactions in a lattice context. Our results indicate that the RKKY interactions lead to qualitative modifications of the MIT scenario even in the absence of long range antiferromagnetic ordering.Comment: 10 pages, 10 figures; to appear in Phys. Rev. B (1999

    Square lattice site percolation at increasing ranges of neighbor interactions

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    We report site percolation thresholds for square lattice with neighbor interactions at various increasing ranges. Using Monte Carlo techniques we found that nearest neighbors (N2^2), next nearest neighbors (N3^3), next next nearest neighbors (N4^4) and fifth nearest neighbors (N6^6) yield the same pc=0.592...p_c=0.592.... At odds, fourth nearest neighbors (N5^5) give pc=0.298...p_c=0.298.... These results are given an explanation in terms of symmetry arguments. We then consider combinations of various ranges of interactions with (N2^2+N3^3), (N2^2+N4^4), (N2^2+N3^3+N4^4) and (N2^2+N5^5). The calculated associated thresholds are respectively pc=0.407...,0.337...,0.288...,0.234...p_c=0.407..., 0.337..., 0.288..., 0.234.... The existing Galam--Mauger universal formula for percolation thresholds does not reproduce the data showing dimension and coordination number are not sufficient to build a universal law which extends to complex lattices.Comment: 4 pages, revtex

    Quantum Nondemolition State Measurement via Atomic Scattering in Bragg Regime

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    We suggest a quantum nondemolition scheme to measure a quantized cavity field state using scattering of atoms in general Bragg regime. Our work extends the QND measurement of a cavity field from Fock state, based on first order Bragg deflection [9], to any quantum state based on Bragg deflection of arbitrary order. In addition a set of experimental parameters is provided to perform the experiment within the frame work of the presently available technology.Comment: 11 pages text, 4 eps figures, to appear in letter section of journal of physical society of Japa

    Theoretical Studies of Spectroscopy and Dynamics of Hydrated Electrons.

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