592 research outputs found
Lattice thermal conductivity of disordered binary alloys : a formulation
We present here a formulation for the calculation of the configuration
averaged lattice thermal conductivity in random alloys. Our formulation is
based on the augmented-space theorem, introduced by one of us, combined with a
generalized diagrammatic technique. The diagrammatic approach simplifies the
problem of including effects of disorder corrections to a great extent. The
approach allows us to obtain an expression for the effective heat current in
case of disordered alloys, which in turn is used in a Kubo-Greenwood type
formula for the thermal conductivity. We show that disorder scattering
renormalizes the phonon propagators as well as the heat currents. The
corrections to the current terms have been shown to be related to the
self-energy of the propagators. We also study the effect of vertex corrections
in a simplified ladder diagram approximation. A mode dependent diffusivity
and then a total thermal diffusivity averaged over different modes
are defined. Schemes for implementing the said formalism are discussed. A few
initial numerical results on the frequency and temperature dependence of
lattice thermal conductivity are presented for NiPd alloy and are also compared
with experiment. We also display numerical results on the frequency dependence
of thermal diffusivity averaged over modes.Comment: 16 pages, 17 figure
Optical properties of random alloys : Application to Cu_{50}Au_{50} and Ni_{50}Pt_{50}
In an earlier paper [K. K. Saha and A. Mookerjee, Phys. Rev. B 70 (2004) (in
press) or, cond-mat/0403456] we had presented a formulation for the calculation
of the configuration-averaged optical conductivity in random alloys. Our
formulation is based on the augmented-space theorem introduced by one of us [A.
Mookerjee, J. Phys. C: Solid State Phys. 6, 1340 (1973)]. In this communication
we shall combine our formulation with the tight-binding linear muffin-tin
orbitals (TB-LMTO) technique to study the optical conductivities of two alloys
Cu_{50}Au_{50} and Ni_{50}Pt_{50}.Comment: 5 pages, 7 figure
Vibrational properties of phonons in random binary alloys: An augmented space recursive technique in the k-representation
We present here an augmented space recursive technique in the
k-representation which include diagonal, off-diagonal and the environmental
disorder explicitly : an analytic, translationally invariant, multiple
scattering theory for phonons in random binary alloys.We propose the augmented
space recursion (ASR) as a computationally fast and accurate technique which
will incorporate configuration fluctuations over a large local environment. We
apply the formalism to , Ni_{88}Cr_12} and
alloys which is not a random choice. Numerical results on spectral functions,
coherent structure factors, dispersion curves and disordered induced FWHM's are
presented. Finally the results are compared with the recent itinerant coherent
potential approximation (ICPA) and also with experiments.Comment: 20 pages, LaTeX, 23 figure
Development of a Computerized App Based on Fitness Norms of University Students
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Structure, bonding and magnetism in cobalt clusters
The structural, electronic and magnetic properties of Co clusters
(20) have been investigated using density functional theory within the
pseudopotential plane wave method. An unusual hexagonal growth pattern has been
observed in the intermediate size range, 20. The cobalt atoms are
ferromagnetically ordered and the calculated magnetic moments are found to be
higher than that of corresponding hcp bulk value, which are in good agreement
with the recent Stern-Gerlach experiments. The average coordination number is
found to dominate over the average bond length to determine the effective
hybridization and consequently the cluster magnetic moment.Comment: 12 pages and 9 figure
Bilateral Isokinetic Torque Differences in Trained Swimmers
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