Understanding Amorphous Matter Through Modeling and Simulation

Presentations

• Non-metric interaction rules in soft and living matter

  ORAL · Invited

  March 6, 2023, 11:00 AM – March 6, 2023, 11:36 AM

  Presenters

  • Daniel M Sussman

    Emory University

  Authors

  • Daniel M Sussman

    Emory University

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• Mechanical loss in doped amorphous oxides with machine learning potentials

  ORAL

  March 6, 2023, 11:36 AM – March 6, 2023, 11:48 AM

  Presenters

  • Jun Jiang

    University of Florida

  Authors

  • Jun Jiang

    University of Florida

  • Rui Zhang

    University of Florida

  • James N Fry

    University of Florida

  • Riccardo Bassiri

    Stanford University, Stanford Univ

  • Martin M Fejer

    Stanford University

  • Hai-Ping Cheng

    University of Florida, university of Florida

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• Does fluid structure encode predictions of glassy dynamics?

  ORAL

  March 6, 2023, 11:48 AM – March 6, 2023, 12:00 PM

  Presenters

  • Tomilola Obadiya

    Emory University

  Authors

  • Tomilola Obadiya

    Emory University

  • Daniel M Sussman

    Emory University

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• Raman Spectra and Structure Analysis of LIGO Coating Amorphous Oxides

  ORAL

  March 6, 2023, 12:00 PM – March 6, 2023, 12:12 PM

  Publication: Raman Spectra and Structure Analysis of LIGO Coating Amorphous Oxides, Rui Zhang, Jun Jiang, Alec Mishkin, Kiran Prasai, James N. Fry, Riccardo Bassiri, Martin M Fejer and Hai-Ping Cheng, planned paper

  Presenters

  • Rui Zhang

    University of Florida

  Authors

  • Rui Zhang

    University of Florida

  • Jun Jiang

    University of Florida

  • Alec S Mishkin

    University of Florida

  • James N Fry

    University of Florida

  • Riccardo Bassiri

    Stanford University, Stanford Univ

  • Martin M Fejer

    Stanford University

  • Hai-Ping Cheng

    University of Florida, university of Florida

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• Accurate identification of basins of attraction in jammed and glassy systems

  ORAL

  March 6, 2023, 12:12 PM – March 6, 2023, 12:24 PM

  Presenters

  • Praharsh Suryadevara

    New York University

  Authors

  • Praharsh Suryadevara

    New York University

  • Mathias Casiulis

    New York University

  • Stefano Martiniani

    New York University

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• Amorphous Carbon and the Importance of Hybridization on Thermal Properties

  ORAL

  March 6, 2023, 12:24 PM – March 6, 2023, 12:36 PM

  Publication: Planned: Amorphous Carbon and the Importance of Hybridization on Thermal Properties, Paul Desmarchelier, Jean-Yves Raty, Valentina Giordano, Konstantinos Termentzidis

  Presenters

  • Paul Desmarchelier

    Johns Hopkins University

  Authors

  • Paul Desmarchelier

    Johns Hopkins University

  • Jean-Yves Raty

    FNRS, SPIN-CESAM, Université de Liège, 19 Allée du 6 Août, Sart-Tilman 4000, Belgium

  • Valentina M Giordano

    Institut Lumière Matière, UMR 5306 Université Lyon 1-CNRS

  • Konstantinos Termentzidis

    CNRS Bagneux

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• Low energy excitations in Mean Field Spin Glasses at zero temperature

  ORAL

  March 6, 2023, 12:36 PM – March 6, 2023, 12:48 PM

  Publication: "Delocalization transition in low energy excitation modes of vector spin glasses"-SciPost Phys. 12, 016 (2022) - published 12 January 2022; doi: 10.21468/SciPostPhys.12.1.016
  
  "Linear low energy excitations in fully-connected models of glasses"-Silvio Franz et al J. Stat. Mech. (2022) 053302-doi:https://doi.org/10.1088/1742-5468/ac6518
  
  "Low energy excitations of Spin Glass models on Random Graphs at zero temperature"-preprint in preparation

  Presenters

  • Flavio Nicoletti

    University of Rome La Sapienza

  Authors

  • Flavio Nicoletti

    University of Rome La Sapienza

  • Federico Ricci-Tersenghi

    University of Rome La Sapienza

  • Silvio Franz

    Universite Paris-Saclay

  • Giorgio Parisi

    La Sapienza Università di Roma, Sapienza Universita di Roma

  • Cosimo Lupo

    University of Rome 'La Sapienza'

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• Size and quality of quantum mechanical data-set for training Neural Network Force Fields for liquid water

  ORAL

  March 6, 2023, 12:48 PM – March 6, 2023, 1:00 PM

  Publication: arXiv:2209.04059 [cond-mat.stat-mech]

  Presenters

  • Márcio S Gomes-Filho

    Universlty Federal do ABC

  Authors

  • Márcio S Gomes-Filho

    Universlty Federal do ABC

  • Alberto Torres

    Univ Estadual Paulista-UNESP

  • Alexandre R Rocha

    Instituto de Fisica Teorica - UNESP

  • Luana Pedroza

    Univ Federal do ABC, Universlty Federal do ABC

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• Atomic insights into fibril elongation: beyond dock-and-lock mechanisms

  ORAL

  March 6, 2023, 1:00 PM – March 6, 2023, 1:12 PM

  Presenters

  • Sharareh Jalali

    New Jersey Inst of Tech

  Authors

  • Sharareh Jalali

    New Jersey Inst of Tech

  • Cristiano L Dias

    New Jersey Inst of Tech

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• Simulating the insertion dynamics of an anionic model protein into a cationic triblock copolymer membrane

  ORAL

  March 6, 2023, 1:12 PM – March 6, 2023, 1:24 PM

  Presenters

  • Sylvia M Luyben

    Univ of Guelph

  Authors

  • Sylvia M Luyben

    Univ of Guelph

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• PyQMC: an all-Python real-space quantum Monte Carlo module in PySCF

  ORAL

  March 6, 2023, 1:24 PM – March 6, 2023, 1:36 PM

  Publication: S. Pathak and L. K. Wagner, AIP Advances 10, 085213 (2020), https://doi.org/10.1063/5.0004008.
  S. Pathak, B. Busemeyer, J. N. B. Rodrigues, and L. K. Wagner, J. Chem. Phys. 154, 034101 (2021); doi.org/10.1063/5.0030949
  X. Li, Z. Li, and J. Chen, arXiv:2203.15472 (2022).
  S. Yuan, Y. Chang, and L. K. Wagner, arXiv.2208.03189 (2022).

  Presenters

  • William A Wheeler

    University of Illinois at Urbana-Champai

  Authors

  • William A Wheeler

    University of Illinois at Urbana-Champai

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• Active Learning of Diffusion Pathways for Machine-Learned Interatomic Potentials

  ORAL

  March 6, 2023, 1:36 PM – March 6, 2023, 1:48 PM

  Presenters

  • Michael J Waters

    Northwestern University

  Authors

  • Michael J Waters

    Northwestern University

  • James M Rondinelli

    Northwestern University

  View abstract →