5,029 research outputs found
Evaluation of the optical conductivity tensor in terms of contour integrations
For the case of finite life-time broadening the standard Kubo-formula for the
optical conductivity tensor is rederived in terms of Green's functions by using
contour integrations, whereby finite temperatures are accounted for by using
the Fermi-Dirac distribution function. For zero life-time broadening, the
present formalism is related to expressions well-known in the literature.
Numerical aspects of how to calculate the corresponding contour integrals are
also outlined.Comment: 8 pages, Latex + 2 figure (Encapsulated Postscript
Development of dispersion strengthened nickel-chromium alloy (Ni-Cr-ThO2) sheet for space shuttle vehicles, part 2
Two dispersion strengthened nickel base alloy systems were developed for use at temperatures up to 1204 C(2200 F); TD nickel chromium (TDNiCr) and TD nickel chromium aluminum (TDNiCrA1). They are considered candidate materials for use on the thermal protection systems of the space shuttle and for long term use in aircraft gas turbine engine applications. Improved manufacturing processes were developed for the fabrication of TDNiCr sheet and foil to specifications. Sheet rolling process studies and extrusion studies were made on two aluminum containing alloys: Ni-16%Cr-3.5%A1-2%ThO2 and Ni-16%Cr-5.0%A12%ThO2. Over 1600 kg.(3500 lb.) of plate, sheet, foil, bar and extrusion products were supplied to NASA Centers for technology studies
Numerically improved computational scheme for the optical conductivity tensor in layered systems
The contour integration technique applied to calculate the optical
conductivity tensor at finite temperatures in the case of layered systems
within the framework of the spin-polarized relativistic screened
Korringa-Kohn-Rostoker band structure method is improved from the computational
point of view by applying the Gauss-Konrod quadrature for the integrals along
the different parts of the contour and by designing a cumulative special points
scheme for two-dimensional Brillouin zone integrals corresponding to cubic
systems.Comment: 17 pages, LaTeX + 4 figures (Encapsulated PostScript), submitted to
J. Phys.: Condensed Matter (19 Sept. 2000
Electrical transport properties of bulk NiFe alloys and related spin-valve systems
Within the Kubo-Greenwood formalism we use the fully relativistic,
spin-polarized, screened Korringa-Kohn-Rostoker method together with the
coherent-potential approximation for layered systems to calculate the
resistivity for the permalloy series NiFe. We are able to
reproduce the variation of the resistivity across the entire series; notably
the discontinuous behavior in the vicinity of the structural phase transition
from bcc to fcc. The absolute values for the resistivity are within a factor of
two of the experimental data. Also the giant magnetoresistance of a series of
permalloy-based spin-valve structures is estimated; we are able to reproduce
the trends and values observed on prototypical spin-valve structures.Comment: 6 pages, ReVTeX + 4 figures (Encapsulated Postscript), submitted to
PR
Spin-polarized surface states close to adatoms on Cu(111)
We present a theoretical study of surface states close to 3d transition metal
adatoms (Cr, Mn, Fe, Co, Ni and Cu) on a Cu(111) surface in terms of an
embedding technique using the fully relativistic Korringa-Kohn-Rostoker method.
For each of the adatoms we found resonances in the s-like states to be
attributed to a localization of the surface states in the presence of an
impurity. We studied the change of the s-like densities of states in the
vicinity of the surface state band-edge due to scattering effects mediated via
the adatom's d-orbitals. The obtained results show that a magnetic impurity
causes spin-polarization of the surface states. In particular, the long-range
oscillations of the spin-polarized s-like density of states around an Fe adatom
are demonstrated.Comment: 5 pages, 5 figures, submitted to PR
Solvent extraction study of the thorium nitrate, nitric acid, and tributyl phosphate-dodecane system: density and acidity relationships
A solvent extraction study to determine equilibrium conditions of thorium nitrate-nitric acid with 30% tributyl phosphate in normal dodecane has been completed. Experimental conditions studied were 30 to 60{sup 0}C, 0.05 to 1.5 M Th(NO{sub 3}){sub 4}, and 0.0 to 3.0 M HNO{sub 3}. The extractant concentration was constant at 30% tributyl phosphate. The equilibrium experiments have produced data which demonstrate that thorium nitrate concentration, free acid, and density are related in equilibrium behavior between the aqueous and organic phases from 30 to 60{sup 0}C in the 30% tributyl phosphate-dodecane solvent extraction system. The concentration interactions apply to both the two- and three-phase regions. A linear correlation was observed for the density (D) of the aqueous or organic phase and the concentration of thorium and free acid. The general form of the equation is D = a(C/sub Th/ + bC/sub H/) + c, where a is the slope, b is the constant, c is the intercept, and C/sub Th/ and C/sub H/ are the molar concentrations of thorium and free acid respectively. The relationship of temperature, thorium nitrate, and free acid makes possible the definitions of the boundaries between the two- and three-phase regions. This dependence, in turn, permits operational control or simulation studies of the system within the two-phase region. The data demonstrate the interactions of the components of the Thorex system and can be used to improve the mathematical description of equilibrium in the SEPHIS-Thorex computer program
Chiral asymmetry of the spin-wave spectra in ultrathin magnetic films
We raise the possibility that the chiral degeneracy of the magnons in
ultrathin films can be lifted due to the presence of Dzyaloshinskii-Moriya
interactions. By using simple symmetry arguments, we discuss under which
conditions such a chiral asymmetry occurs. We then perform relativistic first
principles calculations for an Fe monolayer on W(110) and explicitly reveal the
asymmetry of the spin-wave spectrum in case of wave-vectors parallel to the
(001) direction. Furthermore, we quantitatively interpret our results in terms
of a simplified spin-model by using calculated Dzyaloshinskii-Moriya vectors.
Our theoretical prediction should inspire experiments to explore the asymmetry
of spin-waves, with a particular emphasis on the possibility to measure the
Dzyaloshinskii-Moriya interactions in ultrathin films.Comment: 4 pages, 5 figure
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