549 research outputs found
PREDICTION BY EÖTVÖS´ TORSION BALANCE DATA IN HUNGARY
Possible geodetic applications of Eötvös´
torsion balance gravity gradient data were investigated in
the present study. As a practical example gravity data have
been predicted for two test areas in Hungary with the method of
least squares collocation. By evaluating the results with
gridded data interpolated from gravity measurements the standard
deviation of differences ± 1-1.7 mGal was found which proves the
usability of such gradient data for geodetic applications
Nonlinear hydrodynamic theory of crystallization
We present an isothermal fluctuating nonlinear hydrodynamic theory of
crystallization in molecular liquids. A dynamic coarse-graining technique is
used to derive the velocity field, a phenomenology, which allows a direct
coupling between the free energy functional of the classical Density Functional
Theory and the Navier-Stokes equation. Contrary to the Ginzburg-Landau type
amplitude theories, the dynamic response to elastic deformations is described
by parameter-free kinetic equations. Employing our approach to the free energy
functional of the Phase-Field Crystal model, we recover the classical spectrum
for the phonons and the steady-state growth fronts. The capillary wave spectrum
of the equilibrium crystal-liquid interface is in a good qualitative agreement
with the molecular dynamics simulations
A statistical mechanical approach to fluid dynamics: Thermodynamically consistent equations for simple dissipative fluids
In this paper, a statistical mechanical derivation of thermodynamically
consistent fluid dynamical equations is presented for non-isothermal viscous
molecular fluids. The coarse-graining process is based on the combination of
key concepts from earlier works, including the Dirac-delta formalism of Irving
and Kirkwood, the identity of statistical physical ensemble averages by
Khinchin, and a first-order Taylor expansion around the leading-order solution
of the Chapman-Enskog theory. The non-equilibrium thermodynamic quantities and
constitutive relations directly emerge in the proposed coarse-graining process,
which results in a completion of the phenomenological theory. We show that (i)
the variational form of the thermodynamic part of the reversible stress is
already encoded on the level of the Hamiltonian many-body problem, (ii) the
dynamics monotonically maximizes the entropy at constant energy, and (iii) that
the phenomenological energy balance equation obtained in the adiabatic
approximation lacks the contribution of non-local interactions, which is
crucial in modelling the gas-liquid transition in near-critical fluids
Phase field theory of interfaces and crystal nucleation in a eutectic system of fcc structure: II. Nucleation in the metastable liquid immiscibility region
The official version of this Article can be accessed from the link below - Copyright @ 2007 American Institute of PhysicsIn the second part of our paper, we address crystal nucleation in the metastable liquid miscibility region of eutectic systems that is always present, though experimentally often inaccessible. While this situation resembles the one seen in single component crystal nucleation in the presence of a metastable vapor-liquid critical point addressed in previous works, it is more complex because of the fact that here two crystal phases of significantly different compositions may nucleate. Accordingly, at a fixed temperature below the critical point, six different types of nuclei may form: two liquid-liquid nuclei: two solid-liquid nuclei; and two types of composite nuclei, in which the crystalline core has a liquid "skirt," whose composition falls in between the compositions of the solid and the initial liquid phases, in addition to nuclei with concentric alternating composition shells of prohibitively high free energy. We discuss crystalline phase selection via exploring/identifying the possible pathways for crystal nucleation.This work has been supported by the Hungarian Academy of Sciences under contract No. OTKA-K-62588 and by the ESA PECS Nos. 98021 and 98043
Free energy of the bcc-liquid interface and the Wulff shape as predicted by the Phase-Field Crystal model
The Euler-Lagrange equation of the phase-field crystal (PFC) model has been
solved under appropriate boundary conditions to obtain the equilibrium free
energy of the body centered cubic crystal-liquid interface for 18 orientations
at various reduced temperatures in the range .
While the maximum free energy corresponds to the
orientation for all values, the minimum is realized by the direction for small , and by the orientation for higher . The predicted dependence on
the reduced temperature is consistent with the respective mean field critical
exponent. The results are fitted with an eight-term Kubic harmonic series, and
are used to create stereographic plots displaying the anisotropy of the
interface free energy. We have also derived the corresponding Wulff shapes that
vary with increasing from sphere to a polyhedral form that differs
from the rhombo-dodecahedron obtained previously by growing a bcc seed until
reaching equilibrium with the remaining liquid
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