Focus Session: The Role of Water in Energy Production and Utilization II

Presentations

• The structure of water/hydroxyl phases at metal interfaces

  COFFEE_KLATCH · Invited

  March 24, 2011, 8:00 AM – March 24, 2011, 8:36 AM

  Authors

  • Andrew Hodgson

    • The University of Liverpool

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• Quantum nature of the proton in water-hydroxyl overlayers on metal surfaces

  ORAL

  March 24, 2011, 8:36 AM – March 24, 2011, 8:48 AM

  Authors

  • Angelos Michaelides

    • London Centre for Nanotechnology and Department of Chemistry, University College London
    • University College London
    • London Centre for Nanotechnology and Department of Chemistry, University College London, London WC1E 6BT, U.K

  • Xin-Zheng Li

    • London Centre for Nanotechnology and Department of Chemistry, University College London
    • London Centre for Nanotechnology and Department of Chemistry, University College London, London WC1E 6BT, U.K

  • Matthew Probert

    • Department of Physics, University of York

  • Ali Alavi

    • Department of Chemistry, University of Cambridge

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• Water adsorption on oxygen covered Ru(0001) surfaces

  ORAL

  March 24, 2011, 8:48 AM – March 24, 2011, 9:00 AM

  Authors

  • Sabine Maier

    • Lawrence Berkeley National Laboratory

  • Pepa Cabrera-Sanfelix

    • Donostia International Physics Center, San Sebastian, Spain

  • Ingeborg Stass

    • Lawrence Berkeley National Laboratory

  • Daniel Sanchez-Portal

    • Donostia International Physics Center, San Sebastian, Spain

  • Andres Arnau

    • Donostia International Physics Center, San Sebastian, Spain

  • Miquel Salmeron

    • Lawrence Berkeley National Laboratory

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• Water monolayers on metals -- a new framework

  COFFEE_KLATCH · Invited

  March 24, 2011, 9:00 AM – March 24, 2011, 9:36 AM

  Authors

  • Peter J. Feibelman

    • Sandia National Laboratories

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• First-principles simulation of water on graphene using different levels of theory

  ORAL

  March 24, 2011, 9:36 AM – March 24, 2011, 9:48 AM

  Authors

  • P. Ganesh

    • Center for Nanophase Materials Sciences, Oak Ridge National Laboratory, TN

  • P.R.C. Kent

    • Center for Nanophase Materials Sciences, Oak Ridge National Laboratory, TN

  • De-en Jiang

    • Chemical Sciences Division, Oak Ridge National Laboratory, TN

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• How Water Meets Graphene

  ORAL

  March 24, 2011, 9:48 AM – March 24, 2011, 10:00 AM

  Authors

  • Hua Zhou

    • Argonne National Laboratory

  • Paul Fenter

    • Argonne National Laboratory

  • Jake McDonough

    • Department of Materials Science and Engineering, Drexel University

  • Volker Presser

    • Department of Materials Science and Engineering, Drexel University

  • Yuri Gogotsi

    • Department of Materials Science and Engineering, Drexel University

  • Matthew Wander

    • Department of Chemistry, Drexel University

  • Kevin Shuford

    • Department of Chemistry, Drexel University

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• The Dynamics of Supercooled Water

  COFFEE_KLATCH · Invited

  March 24, 2011, 10:00 AM – March 24, 2011, 10:36 AM

  Authors

  • Francesco Mallamace

    • Dept of Physics, University of Messina, Italy

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• Structural, Dynamic, and Spectroscopic Properties of the SCC-DFTB Water Model

  ORAL

  March 24, 2011, 10:36 AM – March 24, 2011, 10:48 AM

  Authors

  • Laura Kinnaman

    • University of Notre Dame

  • Kathie Newman

    • University of Notre Dame

  • Steven Corcelli

    • University of Notre Dame

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• Interfacial water on TiO$_2$ anatase (101) and (001) surfaces: First-principles study with TiO$_2$ slabs dipped in bulk water

  ORAL

  March 24, 2011, 10:48 AM – March 24, 2011, 11:00 AM

  Authors

  • Yoshitaka Tateyama

    • International Centre for Materials Nanoarchitectonics (MANA), National Institute for Materials Science (NIMS)
    • National Institute for Materials Science MANA
    • Materials Nanoarchitectonics Department, National Institute for Material Science

  • Masato Sumita

    • International Centre for Materials Nanoarchitectonics (MANA), National Institute for Materials Science (NIMS)
    • National Institute for Materials Science MANA

  • Chunping Hu

    • Tokyo University of Science

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