Wednesday, March 6, 2024
8:00AM - 8:36AM
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M58.00001: Ab initio approach for exciton-phonon interactions and exciton dynamics
Invited Speaker:
Hsiao-Yi Chen
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Wednesday, March 6, 2024
8:36AM - 8:48AM
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M58.00002: First-principles ultrafast phonon dynamics by solving the real-time Boltzmann transport equation with adaptive multirate time stepping
Jia Yao, Ivan Maliyov, David J Gardner, Carol S Woodward, Marco Bernardi
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Wednesday, March 6, 2024
8:48AM - 9:00AM
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M58.00003: Ultrafast dynamics and dichroism of chiral valley phonons in monolayer MoS2
Yiming Pan, Fabio Caruso
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Wednesday, March 6, 2024
9:00AM - 9:12AM
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M58.00004: Ultrafast photo-induced lattice dynamics in MoTe_2 studied using ab-initio MD simulations and MeV Ultrafast Electron Diffraction (MUED)
Tobias Zier, Sumit Khadka, Sean Guthrie, M. Hasan Doha, Junjie Li, Mikhail Fedurin, Mark A Palmer, Hugh O Churchill, Byron Freelon, David A Strubbe
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Wednesday, March 6, 2024
9:12AM - 9:24AM
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M58.00005: First-principles characterization for the nitrogen dimer electronic free energy surface within the free-energy Born—Oppenheimer approximation.
William Z Van Benschoten, Hayley R Petras, James J Shepherd
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Wednesday, March 6, 2024
9:24AM - 10:00AM
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M58.00006: Light induced phase transitions in GeTe and SnSe monochalcogenides.
Invited Speaker:
Matteo Calandra
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Wednesday, March 6, 2024
10:00AM - 10:12AM
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M58.00007: Designing Active Spaces with Periodic-like Properties for Charge Transport in Multiconfigurational Nanoscale Systems
Erik P Hoy, Andrew M Sand, Jamie A Clapp
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Wednesday, March 6, 2024
10:12AM - 10:24AM
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M58.00008: Ab initio excited state forces in the study of self-trapped excitons and coherent phonon generation.
Rafael R Del Grande, David A Strubbe
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Wednesday, March 6, 2024
10:24AM - 10:36AM
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M58.00009: Fully relativistic first-principles calculation by using extended Hubbard energy functionals
Wooil Yang, Young-Woo Son
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Wednesday, March 6, 2024
10:36AM - 10:48AM
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M58.00010: Progress towards a more efficient denisty matrix quantum Monte Carlo method
Gabriel Smith, William Z Van Benschoten, James J Shepherd
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Wednesday, March 6, 2024
10:48AM - 11:00AM
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M58.00011: Towards combining dynamical mean-field theory with diagrammatic Monte Carlo
Stephan Humeniuk, Gabriel Kotliar, Kristjan Haule
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