First Principles Modeling of Excited-State Phenomena in Materials: Electron-Phonon
FOCUS · F59 · ID: 2155718
Presentations
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Ultrafast phonon dynamics in two-dimensional and layered materials.
ORAL · Invited
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Publication: [1] Y. Pan, F. Caruso, Nano Lett. 23, 7463 (2023)
[2] H. Seiler, D. Zahn, M. Zacharias, P. Hildebrandt, T. Vasileiadis, Y. W. Windsor, Y. Qi, C. Carbogno, C. Draxl, R. Ernstorfer, F. Caruso Nano Lett. 21, 6171 (2021)
[3] F. Caruso, M. Zacharias, Phys. Rev. B 107, 054102 (2023)
[4] F. Caruso, J. Phys. Chem. Lett. 12, 1734 (2021)Presenters
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Fabio Caruso
Kiel University, Christian-Albrechts-Universität
Authors
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Fabio Caruso
Kiel University, Christian-Albrechts-Universität
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Density Matrix Dynamics for Electron-Phonon Interactions
ORAL
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Presenters
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Vibha Padmanabhan
California Institute of Technology
Authors
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Vibha Padmanabhan
California Institute of Technology
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Ivan Maliyov
CNRS, Caltech
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Marco Bernardi
Caltech
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Nanoplasmonic hot carriers: from excitation to catalysis
ORAL · Invited
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Publication: "Plasmon-Induced Hot Carriers from Interband and Intraband Transitions in Large Noble Metal Nanoparticles", by Jin et al., PRX Energy 1, 013006 (2022)
"Theory of Hot-Carrier Generation in Bimetallic Plasmonic Catalysts", by Jin et al., ACS Photonics 10, 3629 (2023)
"Atomistic theory of hot carrier relaxation in large plasmonic nanoparticles" by Joao and Lischner, arXiv:2308.03957Presenters
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Johannes C Lischner
Imperial College London
Authors
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Johannes C Lischner
Imperial College London
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Auger-Meitner Recombination in Semiconductors from First Principles
ORAL
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Publication: Phys. Rev. Lett. 131, 076902 (2023)
arXiv:2309:09927 (2023)Presenters
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Kyle M Bushick
University of Michigan
Authors
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Kyle M Bushick
University of Michigan
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Amanda X Wang
University of Michigan
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Nick Pant
University of Michigan, University of Texas at Austin
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Emmanouil Kioupakis
University of Michigan
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Auger-Meitner recombination in InP from first principles
ORAL
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Presenters
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Amanda X Wang
University of Michigan
Authors
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Amanda X Wang
University of Michigan
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Kyle M Bushick
University of Michigan
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Emmanouil Kioupakis
University of Michigan
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Title:Oral: Polarons in the thermoelectric compound SnSe
ORAL
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Presenters
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Kaifa Luo
University of Texas at Austin
Authors
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Kaifa Luo
University of Texas at Austin
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Jon Lafuente-Bartolome
The University of Texas at Austin
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Viet-Anh Ha
University of Texas at Austin
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Feliciano Giustino
University of Texas at Austin, University of Texas
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Polarons in the emerging ultra-wide-band-gap semiconductor rutile GeO<sub>2</sub>
ORAL
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Presenters
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Nick Pant
University of Michigan, University of Texas at Austin
Authors
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Nick Pant
University of Michigan, University of Texas at Austin
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Feliciano Giustino
University of Texas at Austin, University of Texas
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First-principles many-body calculations of polarons in materials
ORAL
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Presenters
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Donghwan Kim
The University of Texas at Austin
Authors
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Donghwan Kim
The University of Texas at Austin
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Jon Lafuente-Bartolome
The University of Texas at Austin
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Feliciano Giustino
University of Texas at Austin, University of Texas
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Ab initio Bethe-Salpeter equation calculations of light absorption and emission in the metal-organic framework Zn-MFU-4l
ORAL
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Presenters
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Alex Smith
University of California, Berkeley
Authors
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Alex Smith
University of California, Berkeley
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Beatriz Mouriño
Laboratory of Molecular Simulation (LSMO), Institut des Sciences et Ingénierie Chimiques, Ecole Polytechnique Fédérale de Lausanne (EPFL)
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Antonios M Alvertis
KBR, Inc, NASA Ames Research Center, Moffett Field, Californ, Lawrence Berkeley National Laboratory and NASA Ames Research Center, Lawrence Berkeley National Laboratory, KBR Inc, NASA Ames Research Center, Moffett Field, Materials Science Division, LBNL
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Jeffrey B Neaton
Lawrence Berkeley National Laboratory and UC-Berkeley
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Static and time-dependent optical properties of CuI
ORAL
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Presenters
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Andre Schleife
University of Illinois at Urbana-Champaign
Authors
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Andre Schleife
University of Illinois at Urbana-Champaign
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Brian Robinson
University of Illinois Urbana-Champaign
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