Advancing Polymer Physics by Integrating Simulation and Theory I: Dynamics and Coarse-Graining

Presentations

• A conformationally averaged iterative method for hydrodynamic interactions in Brownian dynamics simulations of polymer solutions

  ORAL

  March 6, 2018, 11:15 AM – March 6, 2018, 11:27 AM

  Presenters

  • Charles Young

    • University of Illinois at Urbana-Champaign
    • Chemical and Biomolecular Engineering, Univ of Illinois - Urbana

  Authors

  • Charles Young

    • University of Illinois at Urbana-Champaign
    • Chemical and Biomolecular Engineering, Univ of Illinois - Urbana

  • Linling Miao

    • Chemical and Biomolecular Engineering, Univ of Illinois - Urbana

  • Charles Sing

    • Chemical and Biomolecular Engineering, University of Illinois - Urbana Champaign
    • University of Illinois at Urbana–Champaign
    • Chemical and Biomolecular Engineering, Univ of Illinois - Urbana

  View abstract →

• Developing and Validating Predictions of a Model for Reversible Scission and Deformation of Wormlike Micelles

  ORAL

  March 6, 2018, 11:27 AM – March 6, 2018, 11:39 AM

  Presenters

  • Abdulrazaq Adams

    • Univ of Michigan - Ann Arbor

  Authors

  • Abdulrazaq Adams

    • Univ of Michigan - Ann Arbor

  • Michael Solomon

    • Chemical Engineering, Univ of Michigan - Ann Arbor
    • Univ of Michigan - Ann Arbor

  • Ronald Larson

    • Chemical Engineering, University of Michigan
    • Univ of Michigan - Ann Arbor

  View abstract →

• Simulation of the Kinetics of Chain Exchange Between Triblock Copolymer Micelles using Dynamical Self-Consistent Mean-Field Theory

  ORAL

  March 6, 2018, 11:39 AM – March 6, 2018, 11:51 AM

  Presenters

  • Shane Holden

    • Physics, University of Guelph

  Authors

  • Shane Holden

    • Physics, University of Guelph

  • Robert Wickham

    • Physics, Univ of Guelph
    • Physics, University of Guelph

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• Achieving Temperature Transferable Coarse-Graining of Glass-Forming Polymers via Energy Renormalization

  ORAL

  March 6, 2018, 11:51 AM – March 6, 2018, 12:03 PM

  Presenters

  • Wenjie Xia

    • National Institute of Standards and Technology

  Authors

  • Wenjie Xia

    • National Institute of Standards and Technology

  • Frederick Phelan Jr.

    • Materials Science and Engineering Division, NIST -Natl Inst of Stds & Tech
    • Materials Science & Engineering, NIST -Natl Inst of Stds & Tech
    • National Institute of Standards and Technology

  • Sinan Keten

    • Northwestern University

  • Jack Douglas

    • National Institute of Standards and Technology
    • Materials Science and Engineering Division, NIST -Natl Inst of Stds & Tech

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• Polymer Conformations & Dynamics in Nano-Confinement as a Function of Chain Length and Confining Radius

  ORAL

  March 6, 2018, 12:03 PM – March 6, 2018, 12:15 PM

  Presenters

  • James Pressly

    • Materials Science and Engineering, Univ of Pennsylvania

  Authors

  • James Pressly

    • Materials Science and Engineering, Univ of Pennsylvania

  • Robert Riggleman

    • Chemical and Biomolecular Engineering, University of Pennsylvania
    • Univ of Pennsylvania
    • University of Pennsylvania
    • Chemical and Biomolecular Engineering, Univ of Pennsylvania

  • Karen Winey

    • University of Pennsylvania
    • Univ of Pennsylvania
    • Materials Science and Engineering, Univ of Pennsylvania
    • Materials Science and Engineering, University of Pennsylvania
    • Materials Science & Engineering, Univ of Pennsylvania

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• Polymer Dynamics under Diamond Network Confinement

  ORAL

  March 6, 2018, 12:15 PM – March 6, 2018, 12:27 PM

  Presenters

  • Tianren Zhang

    • Univ of Pennsylvania

  Authors

  • Tianren Zhang

    • Univ of Pennsylvania

  • Karen Winey

    • University of Pennsylvania
    • Univ of Pennsylvania
    • Materials Science and Engineering, Univ of Pennsylvania
    • Materials Science and Engineering, University of Pennsylvania
    • Materials Science & Engineering, Univ of Pennsylvania

  • Robert Riggleman

    • Chemical and Biomolecular Engineering, University of Pennsylvania
    • Univ of Pennsylvania
    • University of Pennsylvania
    • Chemical and Biomolecular Engineering, Univ of Pennsylvania

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• Identifying Polymer States by Machine Learning

  ORAL

  March 6, 2018, 12:27 PM – March 6, 2018, 12:39 PM

  Presenters

  • Qianshi Wei

    • University of Waterloo

  Authors

  • Qianshi Wei

    • University of Waterloo

  • Roger Melko

    • Perimeter Institute for Theoretical Physics
    • University of Waterloo
    • Univ of Waterloo

  • Jeff Chen

    • Department of Physics and Astronomy, University of Waterloo
    • University of Waterloo

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• Systematic Coarse-Graining of Polymer Field Theories by Phase Field Mapping

  ORAL

  March 6, 2018, 12:39 PM – March 6, 2018, 12:51 PM

  Presenters

  • Jimmy Liu

    • Chemical Engineering, Univ of California - Santa Barbara

  Authors

  • Jimmy Liu

    • Chemical Engineering, Univ of California - Santa Barbara

  • Kris Delaney

    • Univ of California - Santa Barbara
    • UC Santa Barbara
    • Materials Research Laboratory, Univ of California - Santa Barbara
    • Materials Research Laboratory, University of California
    • University of California - Santa Barbara
    • Materials Research Laboratory and Department of Chemical Engineering and Materials, University of California, Santa Barbara

  • Glenn Fredrickson

    • Univ of California - Santa Barbara
    • UC Santa Barbara
    • Materials Research Laboratory, UC Santa Barbara
    • Chemical Engineering, Univ of California - Santa Barbara
    • Chemical Engineering, Materials, and Materials Research Laboratory, University of California
    • University of California - Santa Barbara
    • Materials Research Laboratory and Department of Chemical Engineering and Materials, University of California, Santa Barbara

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• Developing Chemically Specific Coarse-Grained Conjugated Polymer Models Using the TAFFI Framework

  ORAL

  March 6, 2018, 12:51 PM – March 6, 2018, 1:03 PM

  Presenters

  • Brett Savoie

    • School of Chemical Engineering, Purdue University
    • Chemical Engineering, Purdue University

  Authors

  • Brett Savoie

    • School of Chemical Engineering, Purdue University
    • Chemical Engineering, Purdue University

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• Exploring Nanoparticle Structure and Thermodynamics Using Field-Theoretic Simulations

  Invited

  March 6, 2018, 1:03 PM – March 6, 2018, 1:39 PM

  Presenters

  • Robert Riggleman

    • Chemical and Biomolecular Engineering, University of Pennsylvania
    • Univ of Pennsylvania
    • University of Pennsylvania
    • Chemical and Biomolecular Engineering, Univ of Pennsylvania

  Authors

  • Robert Riggleman

    • Chemical and Biomolecular Engineering, University of Pennsylvania
    • Univ of Pennsylvania
    • University of Pennsylvania
    • Chemical and Biomolecular Engineering, Univ of Pennsylvania

  • Jason Koski

    • Chemical and Biomolecular Engineering, University of Pennsylvania

  • Huikuan Chao

    • University of Pennsylvania
    • Chemical and Biomolecular Engineering, University of Pennsylvania

  • Benjamin Lindsay

    • Chemical and Biomolecular Engineering, University of Pennsylvania

  • Jing Cao

    • Chemical and Biomolecular Engineering, University of Pennsylvania

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• Bonded Potentials of Coarse-Grained Polymer Models

  ORAL

  March 6, 2018, 1:39 PM – March 6, 2018, 1:51 PM

  Presenters

  • Qiang Wang

    • Department of Chemical and Biological Engineering, Colorado State University

  Authors

  • Qiang Wang

    • Department of Chemical and Biological Engineering, Colorado State University

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• Theory-Informed Coarse-Grained Simulations of Polymer Liquids

  ORAL

  March 6, 2018, 1:51 PM – March 6, 2018, 2:03 PM

  Presenters

  • Marina Guenza

    • Chemistry & Biochemistry and Institute of Theoretical Science, Univ of Oregon
    • Chemistry and Biochemistry, University of Oregon

  Authors

  • Marina Guenza

    • Chemistry & Biochemistry and Institute of Theoretical Science, Univ of Oregon
    • Chemistry and Biochemistry, University of Oregon

  • Mohammadhasan Dinpajooh

    • Chemistry & Biochemistry and Institute of Theoretical Science, Univ of Oregon
    • Chemistry and Biochemistry, University of Oregon

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• Towards a Computational Workflow for Polymer Melts Based on the Integral Equation Coarse-Graining Method

  ORAL

  March 6, 2018, 2:03 PM – March 6, 2018, 2:15 PM

  Presenters

  • Mohammadhasan Dinpajooh

    • Chemistry & Biochemistry and Institute of Theoretical Science, Univ of Oregon
    • Chemistry and Biochemistry, University of Oregon

  Authors

  • Mohammadhasan Dinpajooh

    • Chemistry & Biochemistry and Institute of Theoretical Science, Univ of Oregon
    • Chemistry and Biochemistry, University of Oregon

  • Marina Guenza

    • Chemistry & Biochemistry and Institute of Theoretical Science, Univ of Oregon
    • Chemistry and Biochemistry, University of Oregon

  View abstract →