291 research outputs found
Moving system with speeded-up evolution
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
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
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
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
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
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.
Phase formation and relaxor properties of lead-free perovskite ceramics on the base of sodium-bismuth titanate
The work was supported by the Russian Foundation for Basic Research (Projects 16-53-48009, 17-03-00542)
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