Electrons, Phonons, Electron-Phonon Scattering, and Phononics: IV

Presentations

• Computing electron and phonon transport including drag: current state-of-the-art and what comes next

  ORAL · Invited

  March 18, 2025, 6:00 PM – March 18, 2025, 6:36 PM

  Presenters

  • Nakib H Protik

    Humboldt University of Berlin

  Authors

  • Nakib H Protik

    Humboldt University of Berlin

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• Phase diagram and thermal conductivity of TaN from first principles

  ORAL

  March 18, 2025, 6:36 PM – March 18, 2025, 6:48 PM

  Presenters

  • Sungyeb Jung

    The University of Texas at Austin

  Authors

  • Sungyeb Jung

    The University of Texas at Austin

  • Hongze Li

    University of Texas at Austin, The University of Texas at Austin

  • Li Shi

    University of Texas at Austin

  • Jianshi Zhou

    University of Texas at Austin, The University of Texas at Austin

  • Feliciano Giustino

    University of Texas at Austin

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• Ultra-Low Heat Conductivity by Configurational Entropy for Thermoelectric Conversion

  ORAL

  March 18, 2025, 6:48 PM – March 18, 2025, 7:00 PM

  Presenters

  • Tara Karimzadeh Sabet

    Pennsylvania State University, The Pennsylvania State University, Carnegie Mellon University

  Authors

  • Tara Karimzadeh Sabet

    Pennsylvania State University, The Pennsylvania State University, Carnegie Mellon University

  • Robert A Robinson

    Pennsylvania State University, The Pennsylvania State University, Penn State

  • Francisco Marques dos Vieira

    Pennsylvania State University

  • Saeed S Almishal

    Pennsylvania State University, The Pennsylvania State University

  • Sai Venkata Gayathri Ayyagari

    The Pennsylvania State University, Pennsylvania State University

  • Rowan R Katzbaer

    The Pennsylvania State University, Pennsylvania State University

  • Gabriele Di Gianluca

    University of Florida

  • Saugata Sarker

    The Pennsylvania State University, Pennsylvania State University

  • Pedro R Trinidad-Perez

    The Pennsylvania State University, Pennsylvania State University

  • John Barber

    Virginia Tech

  • Seng Huat Lee

    Pennsylvania State University

  • James Hodges

    The Pennsylvania State University, Pennsylvania State University

  • Raymond E Schaak

    The Pennsylvania State University, Pennsylvania State University

  • Vincent H Crespi

    Pennsylvania State University, The Pennsylvania State University

  • Nasim Alem

    The Pennsylvania State University, Pennsylvania State University

  • Christina M Rost

    Virginia Tech

  • Jon-Paul Maria

    Pennsylvania State University, Penn State University

  • Zhiqiang Mao

    Pennsylvania State University

  • Ismaila Dabo

    Carnegie Mellon University

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• Data-driven compression of first-principles phonon-phonon interactions

  ORAL

  March 18, 2025, 7:00 PM – March 18, 2025, 7:12 PM

  Presenters

  • Yao Luo

    Caltech

  Authors

  • Yao Luo

    Caltech

  • Dhruv Mangtani

    Stanford University

  • Jia Yao

    Caltech

  • Sergei Kliavinek

    Caltech

  • Marco Bernardi

    Caltech

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• Physics and Data-driven Acceleration of Phonon Dynamics Calculations in Ultrahigh Thermal Conductivity Materials

  ORAL

  March 18, 2025, 7:12 PM – March 18, 2025, 7:24 PM

  Presenters

  • Nikhil Malviya

    Indian Institute of Science Bangalore

  Authors

  • Nikhil Malviya

    Indian Institute of Science Bangalore

  • Navaneetha Ravichandran

    Indian Institute of Science Bangalore

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• Abstract Withdrawn

  ORAL Withdrawn

  March 18, 2025, 7:24 PM – March 18, 2025, 7:36 PM

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• Phonon Boltzmann transport equation beyond the semiclassical regime

  ORAL

  March 18, 2025, 7:36 PM – March 18, 2025, 7:48 PM

  Publication: Submitted for review

  Presenters

  • Enrico Di Lucente

    EPFL

  Authors

  • Enrico Di Lucente

    EPFL

  • Michele Simoncelli

    Theory of Condensed Matter Group, Cavendish Laboratory, University of Cambridge, Univ of Cambridge, TCM group, Cavendish Laboratory, University of Cambridge

  • Nicola Marzari

    Ecole Polytechnique Federale de Lausanne, École Polytechnique Fédérale de Lausanne (EPFL), Ecole Polytechnique Federale de Lausanne (EPFL), Paul Scherrer Institut (PSI)

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• Bond-network entropy controls thermal conductivity of coordination-disordered solids

  ORAL

  March 18, 2025, 7:48 PM – March 18, 2025, 8:00 PM

  Publication: Bond-network entropy controls thermal conductivity of coordination-disordered solids (planned paper)

  Presenters

  • Kamil Iwanowski

    TCM group, Cavendish Laboratory, University of Cambridge

  Authors

  • Kamil Iwanowski

    TCM group, Cavendish Laboratory, University of Cambridge

  • Gabor Csanyi

    Engineering Laboratory, University of Cambridge, Applied Mechanics Group, Mechanics, Materials and Design, Department of Engineering, University of Cambridge

  • Michele Simoncelli

    Theory of Condensed Matter Group, Cavendish Laboratory, University of Cambridge, Univ of Cambridge, TCM group, Cavendish Laboratory, University of Cambridge

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• Phonon polarization conversion at boundaries suppresses the thin film thermal conductivity of semiconductors with large group velocity ratio

  ORAL

  March 18, 2025, 8:00 PM – March 18, 2025, 8:12 PM

  Presenters

  • Navaneetha Ravichandran

    Indian Institute of Science Bangalore

  Authors

  • Navaneetha Ravichandran

    Indian Institute of Science Bangalore

  • Vasumathy Ravishankar

    Indian Institute of Science Bangalore

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• Ab initio Prediction of Novel Induced Stacking Phase Transition in Intercalated Bi₂Se₃ Heterostructures: Implications on Thermoelectric Transport

  ORAL

  March 18, 2025, 8:12 PM – March 18, 2025, 8:24 PM

  Presenters

  • Drake Niedzielski

    Cornell University

  Authors

  • Drake Niedzielski

    Cornell University

  • Betul Pamuk

    Williams College

  • Mark Polking

    MIT Lincoln Labs

  • Tomás A Arias

    Cornell University

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• Interacting Phonon Green's Function in Strontium Titanate via Self-Consistent Perturbation Theory and Irreducible Derivatives

  ORAL

  March 18, 2025, 8:24 PM – March 18, 2025, 8:36 PM

  Presenters

  • Shenwei Wu

    Columbia University

  Authors

  • Shenwei Wu

    Columbia University

  • Mark A Mathis

    Los Alamos National Laboratory

  • Enda Xiao

    Columbia University

  • Sasaank Bandi

    Columbia University

  • Chris A Marianetti

    Columbia University

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• Phonon lifetime and thermal transport in uranium dioxide via self-consistent perturbation theory

  ORAL

  March 18, 2025, 8:36 PM – March 18, 2025, 8:48 PM

  Publication: S. Zhou, et al., Phonon Thermal Transport in UO2 via Self-Consistent Perturbation Theory, Phys. Rev. Lett. 132, 106502 (2024) (https://doi.org/10.1103/PhysRevLett.132.106502, https://arxiv.org/abs/2310.09282)

  Presenters

  • Shuxiang Zhou

    Idaho National Laboratory

  Authors

  • Shuxiang Zhou

    Idaho National Laboratory

  • Enda Xiao

    Columbia University

  • Hao Ma

    Oak Ridge National Laboratory

  • Krzysztof Gofryk

    Idaho National Laboratory, Center for Quantum Actinide Science and Technology, Idaho National Laboratory

  • Chao Jiang

    Idaho National Laboratory

  • Michael E Manley

    Oak Ridge National Laboratory

  • David H Hurley

    Idaho National Laboratory

  • Chris A Marianetti

    Columbia University

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