Frontiers in Computational Materials

Presentations

• Multi-Scale Modeling from First-Principles

  COFFEE_KLATCH · Invited

  March 10, 2008, 7:00 AM – March 10, 2008, 7:36 AM

  Authors

  • Matthias Scheffler

    • Fritz-Haber-Institut der Max-Planck-Gesellschaft
    • Fritz-Haber-Institut der MPG
    • Fritz-Haber-Institut der Max-Planck-Gesellschaft, Germany
    • Fritz-Haber-Institut der MPG, Berlin, Germany
    • Fritz-Haber-Institut der Max-Planck-Gesellschaft, Berlin, Germany and UC Santa Barbara, USA

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• Computational Approaches for Strongly Correlated Materials: an Electronic Structure Theory Perspective.

  COFFEE_KLATCH · Invited

  March 10, 2008, 7:36 AM – March 10, 2008, 8:12 AM

  Authors

  • Sergey Savrasov

    • Physics Department, University of California, Davis, CA 95616
    • Department of Physics, University of California, Davis
    • University of California Davis

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• First-principles studies of electrical transport in nanoscale molecular junctions

  COFFEE_KLATCH · Invited

  March 10, 2008, 8:12 AM – March 10, 2008, 8:48 AM

  Authors

  • J. B. Neaton

    • Lawrence Berkeley National Laboratory
    • The Molecular Foundry, Materials Sciences Division, Lawrence Berkeley National Laboratory
    • Molecular Foundry, LBNL
    • Molecular Foundry, Lawrence Berkeley National Laboratory

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• First-Principles Thermodynamics and Kinetics of Advanced Hydrogen Storage Materials

  COFFEE_KLATCH · Invited

  March 10, 2008, 8:48 AM – March 10, 2008, 9:24 AM

  Authors

  • Vidvuds Ozolins

    • University of California at Los Angeles
    • UCLA
    • Department of Materials Science \& Engineering, University of California, Los Angeles

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• Liquid Metal Embrittlement: new understanding for an old problem

  COFFEE_KLATCH · Invited

  March 10, 2008, 9:24 AM – March 10, 2008, 10:00 AM

  Authors

  • David Srolovitz

    • Yeshiva University

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