First-principles Modeling of Excited-state Phenomena in Materials II: Many-body Perturbation Theory (Techniques and Applications)
FOCUS · B20
Presentations
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Correlated multi-particle excitations: Green’s function formalism for trions and biexcitons
Invited
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Presenters
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Felipe Da Jornada
Department of Physics, University of California, Berkeley, Department of Physics, University of California at Berkeley and Materials Sciences Division, Lawrence Berkeley National Laboratory, Physics, University of California at Berkeley, Lawrence Berkeley National Laboratory, University of California at Berkeley and Lawrence Berkeley National Laboratory, Physics, University of California, Berkeley, UC Berkeley and Lawrence Berkeley National Lab, Lawrence Berkeley National Lab, Lawrence Berkeley National Lab and University of California, Berkeley
Authors
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Felipe Da Jornada
Department of Physics, University of California, Berkeley, Department of Physics, University of California at Berkeley and Materials Sciences Division, Lawrence Berkeley National Laboratory, Physics, University of California at Berkeley, Lawrence Berkeley National Laboratory, University of California at Berkeley and Lawrence Berkeley National Laboratory, Physics, University of California, Berkeley, UC Berkeley and Lawrence Berkeley National Lab, Lawrence Berkeley National Lab, Lawrence Berkeley National Lab and University of California, Berkeley
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Andrea Cepellotti
University of California, Berkeley, UC Berkeley and Lawrence Berkeley National Lab, Physics and Materials Sciences, University of California at Berkeley and Lawrence Berkeley National Laboratory
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Steven G. Louie
Physics, UC Berkeley, University of California, Berkeley, Department of Physics, University of California, Berkeley, Physics Department, UC Berkeley and Lawrence Berkeley National Lab, Department of Physics, University of California at Berkeley and Materials Sciences Division, Lawrence Berkeley National Laboratory, Physics, University of California at Berkeley, University of California at Berkeley and Lawrence Berkeley National Lab, University of California at Berkeley and Lawrence Berkeley National Laboratory, Physics, University of California, Berkeley, UC Berkeley and Lawrence Berkeley National Lab, Physics, University of California - Berkeley, Physics and Materials Sciences, University of California at Berkeley and Lawrence Berkeley National Laboratory, Lawrence Berkeley National Lab and University of California, Berkeley, University of California - Berkeley, Lawrence Berkeley National Laboratory
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Exciton-phonon coupling in bulk hexagonal boron nitride from first principles: phonon-assisted UV absorption and emission spectra
ORAL
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Presenters
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Fulvio Paleari
Physics and Materials Science Research Unit, University of Luxembourg, University of Luxembourg
Authors
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Fulvio Paleari
Physics and Materials Science Research Unit, University of Luxembourg, University of Luxembourg
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Henrique Miranda
Universite catholique de Louvain, Université Catholique de Louvain
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Alejandro Molina-Sanchez
Institute of Materials Science, University of Valencia, Institute of Materials Science (ICMUV), University of Valencia, University of Valencia
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Ludger Wirtz
Physics and Materials Science Research Unit, University of Luxembourg, Faculty of Science, Technology and Communication, University of Luxembourg, University of Luxembourg
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Dynamical electronic screening and exciton binding in the Bethe-Salpeter approach
ORAL
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Presenters
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Xiao Zhang
University of Illinois at Urbana-Champaign
Authors
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Xiao Zhang
University of Illinois at Urbana-Champaign
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Andre Schleife
University of Illinois at Urbana-Champaign, Materials Science and Engineering, University of Illinois at Urbana-Champaign, Department of Materials Science and Engineering, University of Illinois at Urbana-Champaign
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Understanding Excited-States of a Perylene Diimide Nanowire from First Principles Theory
ORAL
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Presenters
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Tianlun Huang
Boston University
Authors
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Tianlun Huang
Boston University
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Sahar Sharifzadeh
Boston University, Department of Electrical and Computer Engineering, Boston University
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Structural Effects on Excitonic Phenomena in Organic Crystals
ORAL
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Presenters
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Sivan Refaely-Abramson
Department of Materials and Interfaces, Weizmann Institute of Science, Lawrence Berkeley National Laboratory, Materials and Interfaces, Weizmann Institute of Science, Israel, Weizmann Institute of Science, Lawrence Berkeley National Laboratory, University of California - Berkeley
Authors
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Sivan Refaely-Abramson
Department of Materials and Interfaces, Weizmann Institute of Science, Lawrence Berkeley National Laboratory, Materials and Interfaces, Weizmann Institute of Science, Israel, Weizmann Institute of Science, Lawrence Berkeley National Laboratory, University of California - Berkeley
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Jonah Haber
Physics, University of California Berkeley, Department of Physics, University of California, Berkeley, Physics, University of California, Berkeley
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Felipe Da Jornada
Department of Physics, University of California, Berkeley, Department of Physics, University of California at Berkeley and Materials Sciences Division, Lawrence Berkeley National Laboratory, Physics, University of California at Berkeley, Lawrence Berkeley National Laboratory, University of California at Berkeley and Lawrence Berkeley National Laboratory, Physics, University of California, Berkeley, UC Berkeley and Lawrence Berkeley National Lab, Lawrence Berkeley National Lab, Lawrence Berkeley National Lab and University of California, Berkeley
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Steven G. Louie
Physics, UC Berkeley, University of California, Berkeley, Department of Physics, University of California, Berkeley, Physics Department, UC Berkeley and Lawrence Berkeley National Lab, Department of Physics, University of California at Berkeley and Materials Sciences Division, Lawrence Berkeley National Laboratory, Physics, University of California at Berkeley, University of California at Berkeley and Lawrence Berkeley National Lab, University of California at Berkeley and Lawrence Berkeley National Laboratory, Physics, University of California, Berkeley, UC Berkeley and Lawrence Berkeley National Lab, Physics, University of California - Berkeley, Physics and Materials Sciences, University of California at Berkeley and Lawrence Berkeley National Laboratory, Lawrence Berkeley National Lab and University of California, Berkeley, University of California - Berkeley, Lawrence Berkeley National Laboratory
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Jeffrey B Neaton
Molecular Foundry, Lawrence Berkeley National Lab, University of California, Berkeley, Lawrence Berkeley National Laboratory, Molecular Foundry, Lawrence Berkeley National Laboratory, Department of Physics, University of California, Berkeley, UC Berkeley/Lawrence Berkeley Natl Lab, Lawrence Berkeley National Lab, Berkeley, CA, Physics, University of California, Berkeley, Molecular Foundry, LBNL; UC Berkeley; Kavli ENSI, Lawrence Berkeley National Laboratory, University of California - Berkeley, Kavli Energy NanoSciences Institute at Berkeley
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Computational discovery of new materials for intermolecular singlet fission in the solid state
Invited
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Presenters
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Noa Marom
Carnegie Mellon University
Authors
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Noa Marom
Carnegie Mellon University
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Phenylated Acene Derivatives as Candidates for Intermolecular Singlet Fission
ORAL
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Presenters
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Xiaopeng Wang
Carnegie Mellon University
Authors
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Xiaopeng Wang
Carnegie Mellon University
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Xingyu Alfred Liu
Carnegie Mellon University
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Rithwik Tom
Carnegie Mellon University
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Cameron Cook
Cal Poly Pomona
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Bohdan Schatschneider
Cal Poly Pomona
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Noa Marom
Carnegie Mellon University
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The Spin-Flip BSE approach and applications to simple molecular systems
ORAL
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Presenters
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Bradford Barker
Department of Physics, University of California, Berkeley, Physics, University of California, Merced
Authors
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Bradford Barker
Department of Physics, University of California, Berkeley, Physics, University of California, Merced
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David Strubbe
University of California, Merced, Department of Physics, University of California, Merced, Physics, University of California, Merced
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Conjugation length dependence on the electronic and optical properties of oligothiophene-F4TCNQ complexes
ORAL
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Presenters
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Ana Valencia
Department of Physics, Humboldt-Universitaet zu Berlin, Germany
Authors
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Ana Valencia
Department of Physics, Humboldt-Universitaet zu Berlin, Germany
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Caterina Cocchi
Institut fur Physik and IRIS Adlershof, Humboldt Universität zu Berlin, Department of Physics, Humboldt-Universitaet zu Berlin, Germany
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First-principles prediction of free-electron screening of the electron-hole interaction in hybrid perovskite MAPbI<sub>3</sub>
ORAL
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Presenters
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Joshua Leveillee
University of Illinois at Urbana-Champaign
Authors
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Joshua Leveillee
University of Illinois at Urbana-Champaign
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Andre Schleife
University of Illinois at Urbana-Champaign, Materials Science and Engineering, University of Illinois at Urbana-Champaign, Department of Materials Science and Engineering, University of Illinois at Urbana-Champaign
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First-principles Studies of Tl Activated Halide Scintillator Phosphor Materials: Towards an Understanding of the Scintillation Mechanism
ORAL
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Presenters
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Andrew Canning
Lawrence Berkeley National Laboratory
Authors
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Andrew Canning
Lawrence Berkeley National Laboratory
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Mauro Del Ben
Lawrence Berkeley National Laboratory
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Edith Bourret
Lawrence Berkeley National Laboratory
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