Computational Methods for Statistical Mechanics: Advances and Applications - II

Presentations

• Efficient Simulation of Self-Avoiding Walks

  Invited

  March 18, 2021, 3:00 PM – March 18, 2021, 3:36 PM

  Presenters

  • Nathan Clisby

    • Swinburne Univ of Tech

  Authors

  • Nathan Clisby

    • Swinburne Univ of Tech

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• Deriving LBM Collision Operator using the Coarse-Graining MDLG Approach

  ORAL

  March 18, 2021, 3:36 PM – March 18, 2021, 3:48 PM

  Presenters

  • Aleksandra Pachalieva

    • Los Alamos National Laboratory

  Authors

  • Aleksandra Pachalieva

    • Los Alamos National Laboratory

  • Alexander Wagner

    • Physics, North Dakota State University
    • North Dakota State University
    • Department of Physics, North Dakota State University

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• Multithermal-multibaric ensembles from collective-variables-based enhanced sampling methods

  ORAL

  March 18, 2021, 3:48 PM – March 18, 2021, 4:00 PM

  Presenters

  • Pablo Piaggi

    • Princeton University
    • Department of Chemistry, Princeton University

  Authors

  • Pablo Piaggi

    • Princeton University
    • Department of Chemistry, Princeton University

  • Michele Invernizzi

    • ETH Zurich

  • Thomas Edward Gartner

    • Princeton University
    • Department of Chemistry, Princeton University

  • Haiyang Niu

    • Northwestern Polytechnical University - China

  • Michele Parrinello

    • ETH Zurich

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• Non-Reversible Monte Carlo Simulations of Long-Range Interacting Molecular Systems

  ORAL

  March 18, 2021, 4:00 PM – March 18, 2021, 4:12 PM

  Presenters

  • Philipp Hoellmer

    • University of Bonn

  Authors

  • Philipp Hoellmer

    • University of Bonn

  • Liang Qin

    • École normale supérieure

  • Michael F. Faulkner

    • University of Bristol

  • A. C. Maggs

    • ESPCI Paris

  • Werner Krauth

    • École normale supérieure

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• Measuring configurational entropy of glasses using population annealing

  ORAL

  March 18, 2021, 4:12 PM – March 18, 2021, 4:24 PM

  Presenters

  • Chris Amey

    • Physics, Univ of Mass - Amherst

  Authors

  • Chris Amey

    • Physics, Univ of Mass - Amherst

  • Jonathan Lee Machta

    • Physics, Univ of Mass - Amherst, Santa Fe Institute

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• Parallel multicanonical simulations applied to equilibrium cluster formation

  ORAL

  March 18, 2021, 4:24 PM – March 18, 2021, 4:36 PM

  Presenters

  • Johannes Zierenberg

    • Max Planck Institute for Dynamics and Self-Organization

  Authors

  • Johannes Zierenberg

    • Max Planck Institute for Dynamics and Self-Organization

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• Error bars for Markov chain Monte Carlo data streams

  ORAL

  March 18, 2021, 4:36 PM – March 18, 2021, 4:48 PM

  Presenters

  • Jonathan Moussa

    • Virginia Tech
    • Molecular Sciences Software Institute, USA

  Authors

  • Jonathan Moussa

    • Virginia Tech
    • Molecular Sciences Software Institute, USA

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• Algorithm for the replica redistribution for population annealing method

  ORAL

  March 18, 2021, 4:48 PM – March 18, 2021, 5:00 PM

  Presenters

  • Lev Shchur

    • Landau ITP - Chernogolovka
    • Landau Institute for Theoretical Physics

  Authors

  • Alexander Russkov

    • Keldysh IAM

  • Roman Chulkevich

    • HSE University

  • Lev Shchur

    • Landau ITP - Chernogolovka
    • Landau Institute for Theoretical Physics

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• Simulating Frustrated Spin Systems with Memory Dynamics

  ORAL

  March 18, 2021, 5:00 PM – March 18, 2021, 5:12 PM

  Presenters

  • Yan Ru Pei

    • University of California, San Diego

  Authors

  • Yan Ru Pei

    • University of California, San Diego

  • Massimiliano Di Ventra

    • University of California, San Diego
    • Department of Physics, University of California San Diego

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• A coarse-grained approach to modeling Brownian motion in multi-dimensional rough potentials

  ORAL

  March 18, 2021, 5:12 PM – March 18, 2021, 5:24 PM

  Presenters

  • Thomas Gray

    • University of Cambridge
    • Univ of Cambridge

  Authors

  • Thomas Gray

    • University of Cambridge
    • Univ of Cambridge

  • Ee Hou Yong

    • Nanyang Technological University

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• Probing predictions due to the nonlocal interface Hamiltonian: Monte Carlo simulations of interfacial fluctuations in Ising films

  ORAL

  March 18, 2021, 5:24 PM – March 18, 2021, 5:36 PM

  Presenters

  • Lijun Pang

    • Georgia Gwinnett College

  Authors

  • Lijun Pang

    • Georgia Gwinnett College

  • David P Landau

    • The University of Georgia
    • University of Georgia

  • Kurt Binder

    • Johannes Gutenberg University

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• Calculating Transport Coefficients from Biased Molecular Dynamics

  ORAL

  March 18, 2021, 5:36 PM – March 18, 2021, 5:48 PM

  Presenters

  • Ernesto Carlos Cortes Morales

    • Chemical and Biomolecular Engineering, University of Notre Dame
    • University of Notre Dame

  Authors

  • Ernesto Carlos Cortes Morales

    • Chemical and Biomolecular Engineering, University of Notre Dame
    • University of Notre Dame

  • Jonathan Whitmer

    • University of Notre Dame
    • Chemical and Biomolecular Engineering, University of Notre Dame

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• Smart random walks for accelerated Monte Carlo simulations

  ORAL

  March 18, 2021, 5:48 PM – March 18, 2021, 6:00 PM

  Presenters

  • Ying Wai Li

    • Los Alamos National Laboratory

  Authors

  • Ying Wai Li

    • Los Alamos National Laboratory

  • Alfred C. K. Farris

    • Oxford College of Emory University
    • Emory University

  • Markus Eisenbach

    • National Center for Computational Sciences, Oak Ridge National Laboratory
    • Oak Ridge National Lab
    • Oak Ridge National Laboratory
    • Oak Ridge Nat. Lab

  View abstract →