Metals Theory Oxides Interfaces

Presentations

• Transferable tight-binding description of the Fe-C interaction

  ORAL

  Feb. 27, 2012, 2:30 PM – Feb. 27, 2012, 2:42 PM

  Authors

  • Nicholas Hatcher

    • ICAMS, Ruhr-Universit\"{a}t Bochum

  • Georg K.H. Madsen

    • ICAMS, Ruhr-Universit\"{a}t Bochum

  • Ralf Drautz

    • ICAMS, Ruhr-Universit\"{a}t Bochum

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• Empirical potentials from a combined density functional theory / genetic algorithm approach: Illustration for Xe in UO2

  ORAL

  Feb. 27, 2012, 2:42 PM – Feb. 27, 2012, 2:54 PM

  Authors

  • Alexander Thompson

    • Northwestern University

  • Bryce Meredig

    • Northwestern University

  • Chris Wolverton

    • Northwestern University

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• ABSTRACT WITHDRAWN

  Feb. 27, 2012, 2:54 PM – Feb. 27, 2012, 3:06 PM

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• The dielectric response of single-crystal UO$_{2}$ probed by terahertz time-domain spectroscopy

  ORAL

  Feb. 27, 2012, 3:06 PM – Feb. 27, 2012, 3:18 PM

  Authors

  • Yong An

    • MST-8, Los Alamos National Laboratory, Los Alamos, NM 87545, USA

  • Trevor Tyson

    • Department of Physics, New Jersey Institute of Technology, Newark, NJ 07102, USA

  • Steven Conradson

    • MST-8, Los Alamos National Laboratory, Los Alamos, NM 87545, USA

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• Magnetocaloric Effect of NiFeCoCrPdx High Entropy Alloys

  ORAL

  Feb. 27, 2012, 3:18 PM – Feb. 27, 2012, 3:30 PM

  Authors

  • Dustin Belyea

    • University of South Florida
    • Department of Physics, University of South Florida

  • C. Bauer

    • USF

  • M. Lucas

    • Air Force Research Laboratory

  • J. Horwath

    • AFRL; Wright State University

  • E. Michel

    • AFRL; UTC inc.

  • Casey W. Miller

    • USF

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• Magnetic and crystallographic properties of Cr1-xFexGe

  ORAL

  Feb. 27, 2012, 3:30 PM – Feb. 27, 2012, 3:42 PM

  Authors

  • Yuen Yiu

    • University of Tennessee

  • Nirmal Ghimire

    • University of Tennessee

  • David Mandrus

    • University of Tennessee and Oak Ridge National Laboratory
    • University of Tennessee, Knoxville, TN, 37996
    • University of Tennessee

  • Stephen Nagler

    • Oak Ridge National Laboratory

  • Michael McGuire

    • Oak Ridge National Laboratory
    • Oak Ridge National Laboratory, Oak Ridge, TN 37831, USA

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• An {\it ab-initio} multiscale method to investigate chemical embrittlement of metals

  ORAL

  Feb. 27, 2012, 3:42 PM – Feb. 27, 2012, 3:54 PM

  Authors

  • Georg Schusteritsch

    • Harvard University

  • Thomas K\"uhne

    • Johannes Gutenberg University of Mainz

  • Efthimios Kaxiras

    • Harvard University

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• Molecular dynamics study of the thermopower of Ag, Au, and Pt nanocontacts

  ORAL

  Feb. 27, 2012, 3:54 PM – Feb. 27, 2012, 4:06 PM

  Authors

  • F. Pauly

    • Molecular Foundry, Lawrence Berkeley National Laboratory, USA

  • J.K. Viljas

    • Department of Physics, University of Oulu, Finland

  • M. B\"urkle

    • Institute for Theoretical Solid State Physics, Karlsruhe Institute of Technology, Germany

  • M. Dreher

    • Department of Physics, University of Konstanz, Germany

  • P. Nielaba

    • Department of Physics, University of Konstanz, Germany

  • J.C. Cuevas

    • Departamento de Fisica Teorica de la Materia Condensada, Universidad Autonoma de Madrid, Spain

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• First-Principles Study of Hydrogen Permeation in Palladium-Gold Alloys

  ORAL

  Feb. 27, 2012, 4:06 PM – Feb. 27, 2012, 4:18 PM

  Authors

  • Angelo Bongiorno

    • School of Chemistry and Biochemistry, Georgia Instutute of Technology, Atlanta, GA 30332

  • Shucheng Xu

    • School of Chemistry and Biochemistry, Georgia Instutute of Technology, Atlanta, GA 30332

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• Hydrogen Embrittlement in Zirconium: a Quasi-Continuum Density Functional Theory Study

  ORAL

  Feb. 27, 2012, 4:18 PM – Feb. 27, 2012, 4:30 PM

  Authors

  • Q. Peng

    • Rensselaer Polytechnic Institute

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• Effects of disorder on the T-dependent bandstructure of purple bronze Li$_2$Mo$_{12}$O$_{34}$

  ORAL

  Feb. 27, 2012, 4:30 PM – Feb. 27, 2012, 4:42 PM

  Authors

  • Thomas Jarlborg

    • DPMC, University of Geneva, 24 Quai Ernest-Ansermet, CH-1211 Geneva 4, Switzerland

  • Piotr Chudzinski

    • DPMC, University of Geneva, 24 Quai Ernest-Ansermet, CH-1211 Geneva 4, Switzerland

  • Thierry Giamarchi

    • DPMC, University of Geneva, 24 Quai Ernest-Ansermet, CH-1211 Geneva 4, Switzerland

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• Metamagnetic transition self-propelled by the spin injection

  ORAL

  Feb. 27, 2012, 4:42 PM – Feb. 27, 2012, 4:54 PM

  Authors

  • Alexander Zyuzin

    • University of Waterloo

  • A.Yu. Zyuzin

    • A.F. Ioffe Physico-Technical Institute

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• Generalized Statistical Thermodyanmics Applied to Small Material Systems

  ORAL

  Feb. 27, 2012, 4:54 PM – Feb. 27, 2012, 5:06 PM

  Authors

  • Robert Cammarata

    • Johns Hopkins University

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• $d + i d$ superconductivity on the honeycomb bilayer

  ORAL

  Feb. 27, 2012, 5:06 PM – Feb. 27, 2012, 5:18 PM

  Authors

  • Milica Milovanovic

    • Institute of Physics Belgrade

  • Jaksa Vucicevic

    • Institute of Physics Belgrade

  • Darko Tanaskovic

    • Institute of Physics Belgrade

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