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Korringa-Kohn-Rostoker electronic structure method for space-filling cell potentials

Description: The multiple scattering theory (MST) method of Korringa, and of Kohn and Rostoker for determining the electronic structure of solids, originally developed in connection with potentials bounded by non-overlapping spheres (muffin-tin (MT) potentials), is generalized to the case of space-filling potential cells of arbitrary shape through the use of a variational formalism. This generalized version of MST retains the separability of structure and potential characteristic of the application of MST t… more
Date: December 31, 1991
Creator: Gonis, A.; Butler, W. H. & Zhang, X.-G.
Partner: UNT Libraries Government Documents Department
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Neutron scattering studies of magnetism in the high-Tc materials

Description: In this paper, I shall attempt to review what has been learned about magnetism in the high-{Tc} family of compounds using neutron scattering techniques. Whether or not it is true that magnetic effects are involved in an essential way in the mechanism for superconductivity in these materials (a point which has not yet been firmly established), they offer fascinating examples for the study of magnetism for its own sake, being realizations of spin {1/2} 2D quantum antiferromagnets. Further, the ra… more
Date: December 31, 1990
Creator: Sinha, S. K.
Partner: UNT Libraries Government Documents Department
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Vacancy related defects in thin film Pb(ZrTi)O{sub 3} materials

Description: Positron annihilation techniques have been applied to characterize vacancy-related defects in ferroelectric thin film structures. Variable energy positron beam measurements were carried out on doped and undoped Pb(ZrTi)O{sub 3} (PZT) samples subjected to different post-deposition cool down and anneal conditions. The PZT was deposited by sol-gel with either with platinum or RuO{sub 2} electrodes, or by laser ablation with La{sub 0.5}Sr{sub 0.5}CoO{sub 3} electrodes. The RuO{sub 2} and La{sub 0.5… more
Date: December 31, 1994
Creator: Krishnan, A.; Keeble, D. J.; Ramesh, R.; Warren, W. L.; Tuttle, B. A.; Pfeffer, R. L. et al.
Partner: UNT Libraries Government Documents Department
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An investigation of catalytic active phase-support interactions by IR, NMR and x-ray absorption spectroscopies. Progress report, January 15, 1992--September 15, 1992

Description: Active catalytic phases (metal, mixed metals, oxide or mixed oxides) interacting with oxide support on which the active phase is dispersed can affect the percentage exposed, the morphology of supported particles, the degree of reducibility of cations, etc., in a variety of ways. Our objective is to characterize the physical chemistry of the active phase-oxide support interaction by spectroscopic methods and to correlate this structure with catalytic function. Two catalytic systems and their ass… more
Date: September 1, 1992
Creator: Haller, G. L.
Partner: UNT Libraries Government Documents Department
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Photoelectron diffraction and holography: Present status and future prospects

Description: Photoelectron diffraction and photoelectron holography, a newly developed variant of it, can provide a rich range of information concerning surface structure. These methods are sensitive to atomic type, chemical state, and spin state. The theoretical prediction of diffraction patterns is also well developed at both the single scattering and multiple scattering levels, and quantitative fits of experiment to theory can lead to structures with accuracies in the {plus_minus}0.03 {Angstrom} range. D… more
Date: July 1, 1993
Creator: Fadley, C. S.; Thevuthasan, S. & Kaduwela, A. P.
Partner: UNT Libraries Government Documents Department
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4f heavy fermion photoelectron spectra do not exhibit the Kondo scale

Description: It has been the authors contention for some time that the Single Impurity Anderson Model (SIAM), as extended by Gunnarsson and Schonhammer (GS), or the non-crossing approximation (NCA), does not correctly describe the 4f photoelectron spectra of heavy fermions. Recently, they have concentrated on Yb heavy fermions since in these materials the Kondo resonance (KR) is fully occupied and thus accessible via photoemission. In particular, they have repeatedly pointed out that the width, position, sp… more
Date: February 1, 1994
Creator: Arko, A. J.; Joyce, J. J.; Andrews, A. B.; Blyth, R. I. R.; Bartlett, R. J.; Fisk, Z. et al.
Partner: UNT Libraries Government Documents Department
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Predoctoral training grant in the area of physical sciences. Final technical report, October 1989--October 1993

Description: This final technical report represents the results of the research in nonlinear optics (optical phase conjugation) obtained by five (5) predoctoral students in the department of physics at Alabama Agricultural and Mechanical University (AAMU).
Date: November 1993
Creator: Venkateswarlu, Putcha
Partner: UNT Libraries Government Documents Department
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Resonant holographic measurements of laser ablation plume expansion in vacuum and argon gas backgrounds

Description: This thesis discusses the following on resonant holographic measurements of laser ablation plume expansion: Introduction to laser ablation; applications of laser ablation; The study of plume expansion; holographic interferometry; resonant holographic interferometry; accounting for finite laser bandwidth; The solution for doppler broadening and finite bandwidth; the main optical table; the lumonics laser spot shape; developing and reconstructing the holograms; plume expansion in RF/Plasma Enviro… more
Date: October 1, 1993
Creator: Lindley, R. A.
Partner: UNT Libraries Government Documents Department
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Fifth Annual Meeting of the Advanced Light Source User`s Association

Description: This report discusses the following topics: ALS Project Status; Accelerator Commissioning; Experimental Systems: Supersmooth Optics and Ultra-Precise Undulators; Planning for Users and User Services; ALS Scientific Program; High Resolution Core-Level Photoemission; Photoelectron Diffraction and Holography; Soft X-Ray Emission Spectroscopy of Solids at the NSLS and the ALS; Gas-Phase Spectrometry; Spectromicroscopy; X-Ray Dichroism Experiments Using Circular Polarization; Magnetic Circular X-Ray… more
Date: October 1, 1993
Partner: UNT Libraries Government Documents Department
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Applications of circularly polarized photons at the ALS with a bend magnet source

Description: The purpose of this workshop is to focus attention on, and to stimulate the scientific exploitation of, the natural polarization properties of bend-magnet synchrotron radiation at the ALS -- for research in biology, materials science, physics, and chemistry. The topics include: The Advanced Light Source; Magnetic Circular Dichroism and Differential Scattering on Biomolecules; Tests of Fundamental Symmetries; High {Tc} Superconductivity; Photoemission from Magnetic and Non-magnetic Solids; Studi… more
Date: February 1, 1992
Partner: UNT Libraries Government Documents Department
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X-ray and {gamma}-ray spectroscopy of solids under pressure. Annual technical progress report, October 1991--October 1992

Description: The effort is divided into the following: high pressure transitions (Fe, RbCl), XAFS studies of perovskites under pressure (ReO{sub 3}, high-{Tc} superconductors), studies of XANES of alkali halides, and Moessbauer studies (iron silicate spinel).
Date: April 30, 1992
Creator: Ingalls, Robert L.
Partner: UNT Libraries Government Documents Department
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Positron annihilation study of P implanted Si

Description: High-energy ion implantation (above 200 keV) is now commonly used in a variety of VLSI processes. The high energy required for these implants is often achieved by implanting multiply charged ions, which inevitably brings in the problem of low-energy ion contamination. The low-energy contamination is difficult to diagnose and detect. Positron annihilation spectroscopy is used to examine the defect distributions in these high energy implants with varying degrees of contamination.
Date: December 1, 1992
Creator: Asoka-Kumar, P.; Au, H. L.; Lynn, K. G. & Sferlazzo, P.
Partner: UNT Libraries Government Documents Department
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Structure and shear response of lipid monolayers. Progress report, July 1, 1989--June 31, 1990

Description: Organic monolayers and multilayers are both scientifically fascinating and technologically promising; they are, however, both complex systems and relatively inaccessible to experimental probes. In this Progress Report, we describe our X-ray diffraction studies, which have given us substantial new information about the structures and phase transitions in monolayers on the surface of water; our use of these monolayers as a unique probe of the dynamics of wetting and spreading; and our studies of … more
Date: February 1, 1990
Creator: Dutta, P. & Ketterson, J. B.
Partner: UNT Libraries Government Documents Department
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Inelastic scattering in condensed matter with high intensity Moessbauer radiation. Final technical report, December 1, 1989--November 30, 1992

Description: The QUEGS facility at MURR has produced a number of new results and demonstrated the range of potential applications of high resolution, high intensity Moessbauer scattering. This work has been carried out by both MU and Purdue researchers and includes published results on Na, W, pentadecane, polydimethylsiloxane and other systems, manuscripts submitted on alkali halides (Phys. Rev. B) and accurate Moessbauer lineshape measurements (Phys. Rev. C), and manuscripts in preparation on glycerol, NiA… more
Date: February 1, 1993
Creator: Yelon, W. B. & Schupp, G.
Partner: UNT Libraries Government Documents Department
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Rietveld refinement of magnetic structures from pulsed-neutron-source powder-diffraction data

Description: The General Structure Analysis System, GSAS, has recently been modified to include magnetic neutron-scattering cross-sections. Low-temperature diffraction data have been taken on the hexagonal noncollinear antiferromagnet UPdSn on both the HIPD and the NPD powder diffractometers at LANSCE. The low-resolution data reveal that the magnetic structure has orthorhombic symmetry (magnetic space group P{sub c}112{sub 1}) between 25K and 40K, and monoclinic symmetry (magnetic space group P{sub c}l12{su… more
Date: May 1, 1993
Creator: Robinson, R. A.; Lawson, A. C.; Larson, A. C.; Von Dreele, R. B. & Goldstone, J. A.
Partner: UNT Libraries Government Documents Department
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NQR-NMR studies of higher alcohol synthesis Cu-Co catalysts. Quarterly technical progress report, December 15, 1991--March 15, 1992

Description: During this period, we focused our attention in analyzing the magnetic nature of the extensively used trimetallic catalyst system Cu-Co-Cr for the production of higher alcohols. We believe that there could be some correspondence between the catalytic and magnetic behaviors of the transition metal catalyst systems. Both the morphology and metallic charge distribution of the particles are known to govern the catalytic as well as the magnetic properties of the system.
Date: May 4, 1992
Creator: Murty, A. N.
Partner: UNT Libraries Government Documents Department
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X-ray and {Gamma}-ray spectroscopy of solids under pressure. Annual technical progress report, November 1993--October 1994

Description: During this period, synchrotron beam time (approx. 2 weeks/year) was obtained from the Stanford Synchrotron Radiation Laboratory. The following areas of study are reported: XAFS studies of polyhedral solids (ReO{sub 3}, perovskites, rubidium tungsten bronze), Moessbauer study of sodium nitroprusside, XAFS studies of phase transition mechanisms (effects of high pressure on metallic Fe), and multiple scattering analysis of XANES.
Date: April 30, 1994
Creator: Ingalls, R. L.
Partner: UNT Libraries Government Documents Department
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[Gamma scattering in condensed matter with high intensity Moessbauer radiation]

Description: This report discusses: quasielastic scattering studies on glycerol; gamma-ray scattering from alkali halides; lattice dynamics in metals; Moessbauer neutron scattering, x-ray diffraction, and macroscopic studies of high {Tc} superconductors containing tungsten; NiAl scattering studies; and atomic interference factors and nuclear Casimir effect.
Date: June 1, 1992
Partner: UNT Libraries Government Documents Department
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NMR imaging of components and materials for DOE application

Description: The suitability for using NMR imaging to characterize liquid, polymeric, and solid materials was reviewed. The most attractive applications for NMR imaging appear to be liquid-filled porous samples, partially cured polymers, adhesives, and potting compounds, and composite polymers/high explosives containing components with widely varying thermal properties. Solid-state NMR line-narrowing and signal-enhancing markedly improve the imaging possibilities of true solid and materials. These technique… more
Date: December 1, 1993
Creator: Richardson, B. R.
Partner: UNT Libraries Government Documents Department
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Applications of photon-in, photon-out spectroscopy with third-generation, synchrotron-radiation sources

Description: This report discusses the following topics: Mother nature`s finest test probe; soft x-ray emission spectroscopy with high-brightness synchrotron radiation sources; anisotropy and polarization of x-ray emission from atoms and molecules; valence-hole fluorescence from molecular photoions as a probe of shape-resonance ionization: progress and prospects; structural biophysics on third-generation synchrotron sources; ultra-soft x-ray fluorescence-yield XAFS: an in situ photon-in, photon-out spectros… more
Date: December 31, 1991
Creator: Lindle, D. W. & Perera, R. C. C.
Partner: UNT Libraries Government Documents Department
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Nuclear Bragg scattering studies in {sup 57}Fe with synchrotron radiation

Description: Studies of nuclear Bragg x-ray scattering of synchrotron radiation, using crystals of {alpha}-{sup 57}Fe{sub 2}O{sub 3}, have been carried out at the NSLS at Brookhaven National Laboratory and at the Cornell University CHESS facility. These studies have demonstrated that nuclear resonance states can be used to produce filtered x-ray beams which have extremely narrow bandwidth, small angular divergence and unique polarization and temporal properties. this combination of characteristics, unobtain… more
Date: March 1, 1993
Creator: Haustein, Peter E.
Partner: UNT Libraries Government Documents Department
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Optical pumping and xenon NMR

Description: Nuclear Magnetic Resonance (NMR) spectroscopy of xenon has become an important tool for investigating a wide variety of materials, especially those with high surface area. The sensitivity of its chemical shift to environment, and its chemical inertness and adsorption properties make xenon a particularly useful NMR probe. This work discusses the application of optical pumping to enhance the sensitivity of xenon NMR experiments, thereby allowing them to be used in the study of systems with lower … more
Date: November 1, 1991
Creator: Raftery, M. D.
Partner: UNT Libraries Government Documents Department
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