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Heat Transport in Condensed Systems I

FOCUS · A20 · ID: 380708

Presentations

  • Koopmans' spectral functionals: an open-source periodic-boundary implementation

    ORAL

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    Presenters

    • Nicola Colonna

      Paul Scherrer Institut, Paul Scherrer Institut (PSI), Laboratory for Neutron Scattering and Imaging, and National Center for Computational Design and Discovery of Novel Materials (MARVEL), Paul Scherrer Institute (PSI)

    Authors

    • Nicola Colonna

      Paul Scherrer Institut, Paul Scherrer Institut (PSI), Laboratory for Neutron Scattering and Imaging, and National Center for Computational Design and Discovery of Novel Materials (MARVEL), Paul Scherrer Institute (PSI)

    • Riccardo De Gennaro

      École Polytechnique Fédérale de Lausanne, École Polytechnique Fédérale de Lausanne (EPFL), Theory and Simulations of Materials (THEOS), and National Center for Computational Design and Discovery of Novel Materials (MARVEL), Ecole Polytechnique Federale de Lausanne

    • Edward Linscott

      Theory and Simulation of Materials (THEOS), STI IMX, École Polytechnique Fédérale de Lausanne, Theory and Simulations of Materials (THEOS), and National Center for Computational Design and Discovery of Novel Materials (MARVEL), Ecole Polytechnique Federale de Lausanne

    • Nicola Marzari

      Ecole Polytechnique Federale de Lausanne, Theory and Simulation of Materials (THEOS), and National Centre for Computational Design and Discovery of Novel Materials (MARVEL), Ecole Polytechnique Federale de Lausanne, École Polytechnique Fédérale de Lausanne, Theory and Simulation of Materials (THEOS), and National Centre for Computational Design and Discovery of Novel Materials (MARVEL), Ecole Polytechnique Federale de Lausanne,, Theory and Simulation of Materials (THEOS), Faculté des Sciences et Techniques de l’Ingénieur, École Polytechnique Fédérale de Lausanne, THEOS, EPFL, École Polytechnique Fédérale de Lausanne (EPFL), Theory and Simulation of Materials (THEOS) and National Centre for Computational Design and Discovery of Novel Materials (MARVEL), École Polytechnique Fédérale de Lausanne (E, Theory and Simulation of Materials (THEOS), and National Centre for Computational Design and Discovery of Novel Materials (MARVEL), EPFL, CH-1015 Lausanne, Switzerland, Theory and simulation of materials (THEOS), National Centre for Computational Design and Discovery of Novel Materials (MARVEL), EPFL, Materials Engineering, EPFL, Theory and Simulations of Materials (THEOS), and National Center for Computational Design and Discovery of Novel Materials (MARVEL), Ecole Polytechnique Federale de Lausanne

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  • Fermi energy determination for advanced smearing techniques

    ORAL

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    Presenters

    • Flaviano dos Santos

      PGI-1, Forschungszentrum Jülich, Ecole Polytechnique Federale de Lausanne

    Authors

    • Flaviano dos Santos

      PGI-1, Forschungszentrum Jülich, Ecole Polytechnique Federale de Lausanne

    • Nicola Marzari

      Ecole Polytechnique Federale de Lausanne, Theory and Simulation of Materials (THEOS), and National Centre for Computational Design and Discovery of Novel Materials (MARVEL), Ecole Polytechnique Federale de Lausanne, École Polytechnique Fédérale de Lausanne, Theory and Simulation of Materials (THEOS), and National Centre for Computational Design and Discovery of Novel Materials (MARVEL), Ecole Polytechnique Federale de Lausanne,, Theory and Simulation of Materials (THEOS), Faculté des Sciences et Techniques de l’Ingénieur, École Polytechnique Fédérale de Lausanne, THEOS, EPFL, École Polytechnique Fédérale de Lausanne (EPFL), Theory and Simulation of Materials (THEOS) and National Centre for Computational Design and Discovery of Novel Materials (MARVEL), École Polytechnique Fédérale de Lausanne (E, Theory and Simulation of Materials (THEOS), and National Centre for Computational Design and Discovery of Novel Materials (MARVEL), EPFL, CH-1015 Lausanne, Switzerland, Theory and simulation of materials (THEOS), National Centre for Computational Design and Discovery of Novel Materials (MARVEL), EPFL, Materials Engineering, EPFL, Theory and Simulations of Materials (THEOS), and National Center for Computational Design and Discovery of Novel Materials (MARVEL), Ecole Polytechnique Federale de Lausanne

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  • Bridging the difference between Fourier's law and Navier-Stokes equations

    Invited

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    Presenters

    • Andrea Cepellotti

      Harvard University

    Authors

    • Michele Simoncelli

      Ecole Polytechnique Federale de Lausanne, Materials Engineering, EPFL

    • Nicola Marzari

      Ecole Polytechnique Federale de Lausanne, Theory and Simulation of Materials (THEOS), and National Centre for Computational Design and Discovery of Novel Materials (MARVEL), Ecole Polytechnique Federale de Lausanne, École Polytechnique Fédérale de Lausanne, Theory and Simulation of Materials (THEOS), and National Centre for Computational Design and Discovery of Novel Materials (MARVEL), Ecole Polytechnique Federale de Lausanne,, Theory and Simulation of Materials (THEOS), Faculté des Sciences et Techniques de l’Ingénieur, École Polytechnique Fédérale de Lausanne, THEOS, EPFL, École Polytechnique Fédérale de Lausanne (EPFL), Theory and Simulation of Materials (THEOS) and National Centre for Computational Design and Discovery of Novel Materials (MARVEL), École Polytechnique Fédérale de Lausanne (E, Theory and Simulation of Materials (THEOS), and National Centre for Computational Design and Discovery of Novel Materials (MARVEL), EPFL, CH-1015 Lausanne, Switzerland, Theory and simulation of materials (THEOS), National Centre for Computational Design and Discovery of Novel Materials (MARVEL), EPFL, Materials Engineering, EPFL, Theory and Simulations of Materials (THEOS), and National Center for Computational Design and Discovery of Novel Materials (MARVEL), Ecole Polytechnique Federale de Lausanne

    • Andrea Cepellotti

      Harvard University

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  • Heat transport in ordered and disordered solids within Wigner’s phase-space formulation

    ORAL

    –

    Presenters

    • Michele Simoncelli

      Ecole Polytechnique Federale de Lausanne, Materials Engineering, EPFL

    Authors

    • Michele Simoncelli

      Ecole Polytechnique Federale de Lausanne, Materials Engineering, EPFL

    • Francesco Mauri

      Dipartimento di Fisica, Università di Roma Sapienza, Rome, Italy, Graphene Laboratories, Fondazione Istituto Italiano di Tecnologia, 1-16163 Genova, Italy; Dipartimento di Fiscia Universita di Roma La Sapienza, I-00185 Roma, Italy, Graphene Laboratories, Fondazione Istituto Italiano di Tecnologia, I-16163 Genova, Italy; Dipartimento di Fisica, Università di Roma La Sapienza, I-00185 Roma, Italy, Università di Roma "La Sapienza"

    • Nicola Marzari

      Ecole Polytechnique Federale de Lausanne, Theory and Simulation of Materials (THEOS), and National Centre for Computational Design and Discovery of Novel Materials (MARVEL), Ecole Polytechnique Federale de Lausanne, École Polytechnique Fédérale de Lausanne, Theory and Simulation of Materials (THEOS), and National Centre for Computational Design and Discovery of Novel Materials (MARVEL), Ecole Polytechnique Federale de Lausanne,, Theory and Simulation of Materials (THEOS), Faculté des Sciences et Techniques de l’Ingénieur, École Polytechnique Fédérale de Lausanne, THEOS, EPFL, École Polytechnique Fédérale de Lausanne (EPFL), Theory and Simulation of Materials (THEOS) and National Centre for Computational Design and Discovery of Novel Materials (MARVEL), École Polytechnique Fédérale de Lausanne (E, Theory and Simulation of Materials (THEOS), and National Centre for Computational Design and Discovery of Novel Materials (MARVEL), EPFL, CH-1015 Lausanne, Switzerland, Theory and simulation of materials (THEOS), National Centre for Computational Design and Discovery of Novel Materials (MARVEL), EPFL, Materials Engineering, EPFL, Theory and Simulations of Materials (THEOS), and National Center for Computational Design and Discovery of Novel Materials (MARVEL), Ecole Polytechnique Federale de Lausanne

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  • Heat transport in water from Deep Neural Network potentials

    ORAL

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    Presenters

    • Davide Tisi

      SISSA - Scuola Internazionale Superiore di Studi Avanzati, Trieste, Italy

    Authors

    • Davide Tisi

      SISSA - Scuola Internazionale Superiore di Studi Avanzati, Trieste, Italy

    • Linfeng Zhang

      Program in Applied and Computational Mathematics, Princeton University, Princeton University, Beijing Institute of Big Data Research, Program in Applied and Computational Mathematics, Princeton University, Princeton, NJ 08544, USA

    • Roberto Car

      Department of Chemistry, Princeton University, Princeton University, Department of Chemistry, Princeton University, Princeton, NJ 08544, USA

    • Stefano Baroni

      SISSA, Scuola Internazionale Superiore di Studi Avanzati, Trieste, SISSA - Scuola Internazionale Superiore di Studi Avanzati, Trieste, Italy

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  • The worm-LBM: enabling accurate ballistic-diffusive phonon transport

    ORAL

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    Presenters

    • René Hammer

      Materials Center Leoben Forschung GmbH (MCL), Simulation, Materials Center Leoben Forschung GmbH

    Authors

    • René Hammer

      Materials Center Leoben Forschung GmbH (MCL), Simulation, Materials Center Leoben Forschung GmbH

    • Verena Fritz

      Simulation, Materials Center Leoben Forschung GmbH

    • Natalia Bedoya-Martínez

      Materials Center Leoben, Simulation, Materials Center Leoben Forschung GmbH

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