Invited Session: Fifty Years of Molecular Dynamics Simulations I: Past, Present and Future

Presentations

• Recent advances in Ab initio Molecular Dynamics

  COFFEE_KLATCH · Invited

  March 2, 2015, 8:00 AM – March 2, 2015, 8:36 AM

  Authors

  • Roberto Car

    • Princeton University

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• Combining Molecular Dynamics and Density Functional Theory

  COFFEE_KLATCH · Invited

  March 2, 2015, 8:36 AM – March 2, 2015, 9:12 AM

  Authors

  • Efthimios Kaxiras

    • Department of Physics and School of Engineering and Applied Sciences, Harvard University
    • Harvard University
    • Harvard University Department of Physics and School of Engineering and Applied Sciences
    • Dept. of Physics, Harvard University
    • Department of Physics, Harvard University
    • Physics Department, Harvard University

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• Material Discovery and Design with Dynamic Charge Reactive Potentials

  COFFEE_KLATCH · Invited

  March 2, 2015, 9:12 AM – March 2, 2015, 9:48 AM

  Authors

  • Susan Sinnott

    • Univ of Florida - Gainesville, FL
    • University of Florida

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• Massively Parallel Reactive and Quantum Molecular Dynamics Simulations

  COFFEE_KLATCH · Invited

  March 2, 2015, 9:48 AM – March 2, 2015, 10:24 AM

  Authors

  • Priya Vashishta

    • Collaboratory for Advanced Computing \& Simulations, University of Southern California

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• Small is Different: Nanoscale Computational Microscopy

  COFFEE_KLATCH · Invited

  March 2, 2015, 10:24 AM – March 2, 2015, 11:00 AM

  Authors

  • Uzi Landman

    • School of Physics, Georgia Institute of technology

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