General Theory, Computational Physics

ORAL · K02

Presentations

  • Finding Stationary States in Density Functional Theory Using Imaginary Time Propagation

    ORAL

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    Presenters

    • Cedric Flamant

      Department of Physics, Harvard University

    Authors

    • Cedric Flamant

      Department of Physics, Harvard University

    • Grigory Kolesov

      School of Engineering and Applied Sciences, Harvard University, Physics, Harvard University, Department of Physics, Harvard University, School of Engineering and Applied Science, Harvard University

    • Efstratios Manousakis

      Florida State Univ, Department of Physics and National High Magnetic Field Laboratory, Florida State Unversity, National High Magnetic Field Laboratory, Physics, Florida State Univ, Department of Physics and National High Magnetic Field Laboratory, Florida State University, University of Athens, Panepistimioupolis, Zografos, Athens, Greece; Florida State University, Tallahassee, FL, United States; National High Magnetic Field Laboratory

    • Efthimios Kaxiras

      Department of Physics, Harvard University, Harvard Univ, Harvard University, Physics, Harvard University, School of Engineering and Applied Science, Harvard University

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  • Construction of Interatomic Potentials and Mechanical Loss in Nb<sub>2</sub>O<sub>5</sub>

    ORAL

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    Presenters

    • Maher Yazback

      Department of Physics and Quantum Theory Project, Univ of Florida - Gainesville

    Authors

    • Maher Yazback

      Department of Physics and Quantum Theory Project, Univ of Florida - Gainesville

    • Chris Billman

      Department of Physics, University of Florida, Department of Physics and Quantum Theory Project, Univ of Florida - Gainesville

    • Alec Mishkin

      Department of Physics and Quantum Theory Project, Univ of Florida - Gainesville

    • Hai-Ping Cheng

      University of Florida, Department of Physics, University of Florida, Department of Physics and Quantum Theory Project, Univ of Florida - Gainesville, Department of Physics and QTP, University of Florida

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  • Spin–lattice simulations of cobalt and iron–cobalt alloys with LAMMPS

    ORAL

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    Presenters

    • Julien Tranchida

      Sandia Natl Labs

    Authors

    • Julien Tranchida

      Sandia Natl Labs

    • Aidan Thompson

      Sandia Natl Labs, Center for Computing Research, Sandia Natl Labs

    • Pascal Thibaudeau

      CEA Le Ripault

    • Attila Cangi

      Sandia National Laboratories, Center for Computing Research, Sandia National Laboratories, Sandia Natl Labs

    • Todd Monson

      Sandia National Laboratories, Sandia Natl Labs

    • Eric Langlois

      Sandia Natl Labs

    • Jamin Pillars

      Sandia Natl Labs

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  • The MULTIBINIT software project

    ORAL

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    Presenters

    • Alexandre Martin

      Theoretical Materials Physics, Q-MAT, CESAM, Université de Liège

    Authors

    • Alexandre Martin

      Theoretical Materials Physics, Q-MAT, CESAM, Université de Liège

    • Jordan Bieder

      CEA DAM-DIF

    • Serguei Prokhorenko

      Theoretical Materials Physics, Q-MAT, CESAM, Université de Liège

    • Philippe Ghosez

      Université de Liège, Theoretical Materials Physics, Q-MAT, CESAM, Université de Liège

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  • Information based structure determination of amorphous carbon

    ORAL

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    Presenters

    • Bishal Bhattarai

      Department of Physics and Astronomy, Ohio University

    Authors

    • Bishal Bhattarai

      Department of Physics and Astronomy, Ohio University

    • Anup Pandey

      The Chemical and Engineering Materials Division (CEMD), Oak Ridge National Laboratory

    • Parthapratim Biswas

      Department of Physics and Astronomy, The University of Southern Mississippi

    • David Drabold

      Department of Physics and Astronomy, Ohio University

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  • Design of Metamaterials for Mass Diffusion

    ORAL

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    Presenters

    • Juan Restrepo-Fl&oacute;rez

      School of Chemical and biomolecular engineering / School of Physics , Georgia Inst of Tech

    Authors

    • Juan Restrepo-Fl&oacute;rez

      School of Chemical and biomolecular engineering / School of Physics , Georgia Inst of Tech

    • Martin Maldovan

      School of Chemical and biomolecular engineering / School of Physics , Georgia Inst of Tech, Georgia Inst of Tech

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  • Elucidating the cluster versus crystal growth of the Solid Electrolyte Interphase components

    ORAL

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    Presenters

    • Asma Marzouk

      Qatar Environment and Energy Research Institute, Hamad Bin Khalifa University

    Authors

    • Asma Marzouk

      Qatar Environment and Energy Research Institute, Hamad Bin Khalifa University

    • Fernando Soto

      Department of Chemical Engineering, Texas A&M University, College Station

    • Kie Hankins

      Department of Chemical Engineering, Texas A&M University, College Station

    • Perla Balbuena

      Department of Chemical Engineering, Texas A&M University, College Station

    • Fadwa El-Mellouhi

      Qatar Environment and Energy Research Institute, Hamad Bin Khalifa University

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  • Enhancing the predictive capability of modified Paschen curve models for direct current field emission assisted (FEA) microdischarges

    ORAL

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    Presenters

    • Jiba Dahal

      Department of Physics , Univ of California - Merced, Physics , Univ of California - Merced

    Authors

    • Jiba Dahal

      Department of Physics , Univ of California - Merced, Physics , Univ of California - Merced

    • Venkattraman Ayyaswamy

      Department of Physics , Univ of California - Merced, Physics , Univ of California - Merced

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