Chemical Physics of Hydrogen Bonding II

Presentations

• Water at silica/liquid water interfaces investigated by DFT-MD simulations

  COFFEE_KLATCH · Invited

  March 13, 2017, 11:15 AM – March 13, 2017, 11:51 AM

  Authors

  • Marie-Pierre Gaigeot

    • LAMBE UMR8587 Universite d'Evry val d'Essonne

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• Modulators of heterogeneous protein surface water dynamics

  COFFEE_KLATCH · Invited

  March 13, 2017, 11:51 AM – March 13, 2017, 12:27 PM

  Authors

  • Songi Han

    • Dept of Chemistry and Biochemistry and Dept of Chemical Engineering, University of California Santa Barbara

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• Enhanced Tetrahedral Order in Hydrophobic Hydration-Shells

  ORAL · Invited

  March 13, 2017, 12:27 PM – March 13, 2017, 1:03 PM

  Authors

  • Dor Ben-Amotz

    • Purdue Univ

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• Phosphate vibrations as reporters of DNA hydration

  ORAL

  March 13, 2017, 1:03 PM – March 13, 2017, 1:15 PM

  Authors

  • Steven Corcelli

    • Univ of Notre Dame

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• First-Principles Molecular Dynamics Simulations of NaCl in Water: Performance of Advanced Exchange-Correlation Approximations in Density Functional Theory

  ORAL

  March 13, 2017, 1:15 PM – March 13, 2017, 1:27 PM

  Authors

  • Yi Yao

    • University of North Carolina at Chapel Hill
    • UNC-Chapel Hill

  • Yosuke Kanai

    • Univ of NC - Chapel Hill
    • UNC-Chapel Hill

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• Computational Investigation of Surface Freezing in a Molecular Model of Water

  ORAL

  March 13, 2017, 1:27 PM – March 13, 2017, 1:39 PM

  Authors

  • Amir Haji-Akbari

    • Department of Chemical and Environmental Engineering, Yale University

  • Pablo Debenedetti

    • Department of Chemical and Biological Engineering, Princeton University

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• Real space imaging of buckled tetramer and flat hexamer water cluster on Au(111) surface: determine structures of water clusters on solid surface

  ORAL

  March 13, 2017, 1:39 PM – March 13, 2017, 1:51 PM

  Authors

  • Anning Dong

    • Institute of Physics, Chinese Academy of Sciences

  • Lei Yan

    • Institute of Physics, Chinese Academy of Sciences

  • Lihuan Sun

    • Institute of Physics, Chinese Academy of Sciences

  • Xinyan Shan

    • Institute of Physics, Chinese Academy of Sciences

  • Yang Guo

    • Institute of Physics, Chinese Academy of Sciences

  • Sheng Meng

    • Beijing National Laboratory for Condensed Matter Physics and Institute of Physics, Chinese Academy of Sciences
    • Institute of Physics, Chinese Academy of Sciences
    • Chinese Academy of Sciences (CAS)
    • Beijing National Lab for Condensed Matter Physics, Institute of Physics, Chinese Academy of Sciences

  • Xinghua Lu

    • Institute of Physics, Chinese Academy of Sciences

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• Molecular structure and polarization of water interfaces: physical picture from the hydrogen bonding of constrained geometry

  ORAL

  March 13, 2017, 1:51 PM – March 13, 2017, 2:03 PM

  Authors

  • Sucheol Shin

    • Massachusetts Institute of Technology

  • Adam Willard

    • Massachusetts Institute of Technology

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