Understanding Amorphous Matter Through Modeling and Simulation II

Presentations

• A microscopic view of the response of disordered polymer solids to deformation

  ORAL · Invited

  March 14, 2022, 11:30 AM – March 14, 2022, 12:06 PM

  Presenters

  • Robert Riggleman

    • University of Pennsylvania

  Authors

  • Robert Riggleman

    • University of Pennsylvania

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• Recovering dynamics and material properties in chemically specific coarse-grain models of polymer melts using a dissipative potential

  ORAL

  March 14, 2022, 12:06 PM – March 14, 2022, 12:18 PM

  Publication: Lilian C. Johnson and Frederick R. Phelan Jr. , "Dynamically consistent coarse-grain simulation model of chemically specific polymer melts via friction parameterization", J. Chem. Phys. 154, 084114 (2021) https://doi.org/10.1063/5.0034910

  Presenters

  • Lilian C Johnson

    • National Institute of Standards and Technology
    • National Institute of Standards and Tech

  Authors

  • Lilian C Johnson

    • National Institute of Standards and Technology
    • National Institute of Standards and Tech

  • Frederick R Phelan

    • National Institute of Standards and Technology

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• Atomistic Simulations of Polynorbornenes: the Effect of Stereochemistry

  ORAL

  March 14, 2022, 12:18 PM – March 14, 2022, 12:30 PM

  Presenters

  • Nobahar Shahidi

    • University of Tennessee

  Authors

  • Nobahar Shahidi

    • University of Tennessee

  • Jeffrey A Laub

    • University of Tennessee

  • Konstantinos D Vogiatzis

    • University of Tennessee

  • Manolis Doxastakis

    • University of Tennessee
    • Department of Chemical and Biomolecular Engineering, University of Tennessee, Knoxville, Tennessee 37996, USA.
    • University of Tennessee, Knoxville
    • Department of Chemical and Biomolecular Engineering, University of Tennessee, Knoxville, Tennessee, USA
    • UT Knoxville

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• Probing the Equilibrium Adsorption Morphologies of Surfactants at Metal-Water Interfaces Using a Novel Free Energy Sampling Methodology in Molecular Simulations

  ORAL

  March 14, 2022, 12:30 PM – March 14, 2022, 12:42 PM

  Presenters

  • Sumit Sharma

    • Ohio University

  Authors

  • Sumit Sharma

    • Ohio University

  • Himanshu Singh

    • Ohio University

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• Machine learning potentials for amorphous oxides modeling and simulations

  ORAL

  March 14, 2022, 12:42 PM – March 14, 2022, 12:54 PM

  Presenters

  • Jun Jiang

    • University of Florida

  Authors

  • Jun Jiang

    • University of Florida

  • Alec S Mishkin

    • University of Florida

  • Rui Zhang

    • University of Florida

  • Hai-Ping Cheng

    • University of Florida
    • UFL

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• Sub-lattice Melting in Amorphous Tantala

  ORAL

  March 14, 2022, 12:54 PM – March 14, 2022, 1:06 PM

  Presenters

  • Rui Zhang

    • University of Florida

  Authors

  • Rui Zhang

    • University of Florida

  • Jun Jiang

    • University of Florida

  • Alec S Mishkin

    • University of Florida

  • Hai-Ping Cheng

    • University of Florida
    • UFL

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• Atomistic simulations of mechanical loss in amorphous silicon

  ORAL

  March 14, 2022, 1:06 PM – March 14, 2022, 1:18 PM

  Presenters

  • Daniel Wong

    • University of British Columbia

  Authors

  • Daniel Wong

    • University of British Columbia

  • Joerg Rottler

    • University of British Columbia, Vancouver, Canada
    • University of British Columbia

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• Transient Nature of Fast Relaxation in Metallic Glass

  ORAL

  March 14, 2022, 1:18 PM – March 14, 2022, 1:30 PM

  Presenters

  • Leo Zella

    • Department of Materials Science and Engineering, The University of Tennessee

  Authors

  • Leo Zella

    • Department of Materials Science and Engineering, The University of Tennessee

  • Takeshi Egami

    • University of Tennessee
    • Department of Materials Science and Engineering, The University of Tennessee

  • Jaeyun Moon

    • Materials Science and Technology Division, Oak Ridge National Laboratory

  • David Keffer

    • Department of Materials Science and Engineering, The University of Tennessee

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• Space-Time Cluster Analysis of an Aging Athermal System

  ORAL

  March 14, 2022, 1:30 PM – March 14, 2022, 1:42 PM

  Presenters

  • Katharina Vollmayr-Lee

    • Bucknell University

  Authors

  • Katharina Vollmayr-Lee

    • Bucknell University

  • Rituparno Mandal

    • University of Goettingen, Germany

  • Peter K Sollich

    • Georg August Universität Göttingen
    • University of Goettingen

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• Estimation of the equilibrium free energy for glasses using the Jarzynski equality

  ORAL

  March 14, 2022, 1:42 PM – March 14, 2022, 1:54 PM

  Publication: Vinutha, H. A., & Frenkel, D. (2021). Estimation of the equilibrium free energy for glasses using the Jarzynski equality. The Journal of Chemical Physics, 154(23), 231101.

  Presenters

  • H. A Vinutha

    • Georgetown university
    • Georgetown University

  Authors

  • H. A Vinutha

    • Georgetown university
    • Georgetown University

  • Daan Frenkel

    • University of Cambridge
    • Cambridge University

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• Counting and Characterizing the Catchment Regions of Jammed Packings

  ORAL

  March 14, 2022, 1:54 PM – March 14, 2022, 2:06 PM

  Presenters

  • Valerie Beale

    • University of Oregon

  Authors

  • Valerie Beale

    • University of Oregon

  • Eric I Corwin

    • University of Oregon

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• Hyperuniformity of Wigner Glasses

  ORAL

  March 14, 2022, 2:06 PM – March 14, 2022, 2:18 PM

  Presenters

  • Erdal C Oğuz

    • Tel Aviv University; Key Laboratory of Soft Matter Physics, Institute of Physics, Chinese Academy of Sciences, Beijing 100190, China

  Authors

  • Erdal C Oğuz

    • Tel Aviv University; Key Laboratory of Soft Matter Physics, Institute of Physics, Chinese Academy of Sciences, Beijing 100190, China

  • Haim Diamant

    • Tel Aviv University

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• Understanding degeneracy of two-point correlation functions via Debye random media

  ORAL

  March 14, 2022, 2:18 PM – March 14, 2022, 2:30 PM

  Publication: M. Skolnick and S. Torquato, Phys. Rev. E 104, 045306 (2021)

  Presenters

  • Murray Skolnick

    • Princeton University

  Authors

  • Murray Skolnick

    • Princeton University

  • Salvatore Torquato

    • Princeton University

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