Emerging Trends in Molecular Dynamics Simulations and Data Analytics II

FOCUS · L21

Presentations

  • Overcoming the Time Limitation in Molecular Dynamics Simulation of Crystal Nucleation: A Persistent-Embryo Approach

    Invited

    –

    Presenters

    • Yang Sun

      Ames Laboratory

    Authors

    • Yang Sun

      Ames Laboratory

    • Feng Zhang

      Ames Laboratory

    • Huajing Song

      Ames Laboratory

    • Mikhail Mendelev

      Ames Laboratory

    • Alex Travesset

      Iowa State University, Department of Physics and Astronomy, Iowa State University

    • Cai-Zhuang Wang

      Ames Laboratory, Physics, Iowa State University

    • Kai-Ming Ho

      Ames Laboratory, Iowa State University, Physics, Iowa State University

    View abstract →

  • TBD

    Invited

    –

    Presenters

    • Klaus-Robert Müller

      Machine Learning Group, Technische Universität Berlin, Technical University of Berlin, Machine Learning/Intelligent Data Analysis, Technische Universität Berlin

    Authors

    • Klaus-Robert Müller

      Machine Learning Group, Technische Universität Berlin, Technical University of Berlin, Machine Learning/Intelligent Data Analysis, Technische Universität Berlin

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  • Cavitation in Water Induced by a SnO<sub>2</sub> Nanoparticle and a Strong Electric Field

    ORAL

    –

    Presenters

    • Shane Jackson

      Physics, University of Southern California

    Authors

    • Shane Jackson

      Physics, University of Southern California

    • Aiichiro Nakano

      University of Southern California, Physics, University of Southern California, Physics & Astronomy, University of Southern California

    • Priya Vashishta

      University of Southern California, Physics, University of Southern California, Collaboratory for Advanced Computing and Simulations, University of Southern California, Physics & Astronomy, University of Southern California

    • Rajiv Kalia

      University of Southern California, Physics, University of Southern California, Physics & Astronomy, University of Southern California

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  • Atomic Structure of Supported Metal Nano Clusters on MoS<sub>2</sub> Monolayer Using Deep Potentials

    ORAL

    –

    Presenters

    • Wissam Saidi

      Mechanical Engineering and Materials Science, University of Pittsburgh, University of Pittsburgh, Mechanical Engineering & Materials Science, University of Pittsburgh

    Authors

    • Wissam Saidi

      Mechanical Engineering and Materials Science, University of Pittsburgh, University of Pittsburgh, Mechanical Engineering & Materials Science, University of Pittsburgh

    • Yongliang Shi

      University of Science and Technology of China

    • Linfeng Zhang

      Princeton University

    • Han Wang

      Institute and Applied Physics and Computational Mathematics

    • Weinan E

      Princeton University

    • Jin Zhao

      University of Science and Technology of China

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  • Development of a universal Electron Force Field

    ORAL

    –

    Presenters

    • Isidro Losada López

      Condensed Matter Physics, Autonomous University of Madrid

    Authors

    • Isidro Losada López

      Condensed Matter Physics, Autonomous University of Madrid

    • Michelle Fritz

      Slalom, Philadelphia

    • Paula Mori-Sanchez

      Chemistry, Autonomous University of Madrid

    • Marivi Fernandez Serra

      Stony Brook University, Department of Physics and Astronomy, Institute for Advance Computational Science, Stony Brook University, Department of Physics and Astronomy, and Institute for Advanced Computational Science, Stony Brook University, Department of Physics and Astronomy, Stony Brook Univerysity, U.S.A.

    • Jose M Soler

      Departamento de Física de la Materia Condensada, Univ. Autónoma de Madrid, Condensed Matter Physics, Autonomous University of Madrid

    View abstract →