291 research outputs found

    Moving system with speeded-up evolution

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    In the classical (non-quantum) relativity theory the course of the moving clock is dilated as compared to the course of the clock at rest (the Einstein dilation). Any unstable system may be regarded as a clock. The time evolution (e.g., the decay) of a uniformly moving physical system is considered using the relativistic quantum theory. The example of a moving system is given whose evolution turns out to be speeded-up instead of being dilated. A discussion of this paradoxical result is presented.Comment: 10 pages, LaTe

    Semiempirical Hartree-Fock calculations for KNbO3

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    In applying the semiempirical intermediate neglect of differential overlap (INDO) method based on the Hartree-Fock formalism to a cubic perovskite-based ferroelectric material KNbO3, it was demonstrated that the accuracy of the method is sufficient for adequately describing the small energy differences related to the ferroelectric instability. The choice of INDO parameters has been done for a system containing Nb. Based on the parametrization proposed, the electronic structure, equilibrium ground state structure of the orthorhombic and rhombohedral phases, and Gamma-TO phonon frequencies in cubic and rhombohedral phases of KNbO3 were calculated and found to be in good agreement with the experimental data and with the first-principles calculations available.Comment: 7 pages, 2 Postscript figures, uses psfig.tex. To be published in Phys.Rev.B 54, No.4 (1996

    Properties of pattern formation and selection processes in nonequilibrium systems with external fluctuations

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    We extend the phase field crystal method for nonequilibrium patterning to stochastic systems with external source where transient dynamics is essential. It was shown that at short time scales the system manifests pattern selection processes. These processes are studied by means of the structure function dynamics analysis. Nonequilibrium pattern-forming transitions are analyzed by means of numerical simulations.Comment: 15 poages, 8 figure

    Theory of bound polarons in oxide compounds

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    We present a multilateral theoretical study of bound polarons in oxide compounds MgO and \alpha-Al_2O_3 (corundum). A continuum theory at arbitrary electron-phonon coupling is used for calculation of the energies of thermal dissociation, photoionization (optically induced release of an electron (hole) from the ground self-consistent state), as well as optical absorption to the non-relaxed excited states. Unlike the case of free strong-coupling polarons, where the ratio \kappa of the photoionization energy to the thermal dissociation energy was shown to be always equal to 3, here this ratio depends on the Froehlich coupling constant \alpha and the screened Coulomb interaction strength \beta. Reasonable variation of these two parameters has demonstrated that the magnitude of \kappa remains usually in the narrow interval from 1 to 2.5. This is in agreement with atomistic calculations and experimental data for hole O^- polarons bound to the cation vacancy in MgO. The thermal dissociation energy for the ground self-consistent state and the energy of the optically induced charge transfer process (hops of a hole between O^{2-} ions) have been calculated using the quantum-chemical method INDO. Results obtained within the two approaches for hole O^- polarons bound by the cation vacancies (V^-) in MgO and by the Mg^{2+} impurity (V_{Mg}) in corundum are compared to experimental data and to each other. We discuss a surprising closeness of the results obtained on the basis of independent models and their agreement with experiment.Comment: 13 pages, 2 figures, 2 tables, E-mail addresses: [email protected], [email protected]

    Relative energetics and structural properties of zirconia using a self-consistent tight-binding model

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    We describe an empirical, self-consistent, orthogonal tight-binding model for zirconia, which allows for the polarizability of the anions at dipole and quadrupole levels and for crystal field splitting of the cation d orbitals. This is achieved by mixing the orbitals of different symmetry on a site with coupling coefficients driven by the Coulomb potentials up to octapole level. The additional forces on atoms due to the self-consistency and polarizabilities are exactly obtained by straightforward electrostatics, by analogy with the Hellmann-Feynman theorem as applied in first-principles calculations. The model correctly orders the zero temperature energies of all zirconia polymorphs. The Zr-O matrix elements of the Hamiltonian, which measure covalency, make a greater contribution than the polarizability to the energy differences between phases. Results for elastic constants of the cubic and tetragonal phases and phonon frequencies of the cubic phase are also presented and compared with some experimental data and first-principles calculations. We suggest that the model will be useful for studying finite temperature effects by means of molecular dynamics.Comment: to be published in Physical Review B (1 march 2000

    Precision tests with a new class of dedicated ether-drift experiments

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    In principle, by accepting the idea of a non-zero vacuum energy, the physical vacuum of present particle physics might represent a preferred reference frame. By treating this quantum vacuum as a relativistic medium, the non-zero energy-momentum flow expected in a moving frame should effectively behave as a small thermal gradient and could, in principle, induce a measurable anisotropy of the speed of light in a loosely bound system as a gas. We explore the phenomenological implications of this scenario by considering a new class of dedicated ether-drift experiments where arbitrary gaseous media fill the resonating optical cavities. Our predictions cover most experimental set up and should motivate precise experimental tests of these fundamental issues.Comment: Accepted for publication in Eur. Phys. Journ.
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