Challenges for excited states and dynamics II
FOCUS · V03 ·
Presentations
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Non-adiabatic couplings in the EOM-CC framework
Invited
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Presenters
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Anna Krylov
- Univ of Southern California
- University of Southern California
Authors
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Anna Krylov
- Univ of Southern California
- University of Southern California
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Partial Hydrodynamic Representation of Quantum Molecular Dynamics
ORAL
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Presenters
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Ignacio Franco
- Univ of Rochester
- University of Rochester
- Chemistry , University of Rochester
Authors
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Bing Gu
- Univ of Rochester
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Ignacio Franco
- Univ of Rochester
- University of Rochester
- Chemistry , University of Rochester
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Machine Learning Optimal Effective Hamiltonians for Excited State Molecular Systems
ORAL
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Presenters
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Ben Nebgen
- Los Alamos National Lab
Authors
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Ben Nebgen
- Los Alamos National Lab
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Nick Lubbers
- Los Alamos National Lab
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Andrey Lokhov
- Los Alamos National Lab
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Kipton Barros
- Theoretical Division, Los Alamos National Laboratory
- Los Alamos National Lab
- Los Alamos National Laboratory
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Sergei Tretiak
- Los Alamos Natl Lab
- Los Alamos National Lab
- Los Alamos National Laboratory
- Physics and Chemistry of Materials, Los Alamos National Laboratory
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Electronic Delocalization, Vibrational Dynamics, and Energy Transfer in Organic Chromophores
ORAL
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Presenters
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Tammie Nelson
- Los Alamos Natl Lab
- Los Alamos National Laboratory
Authors
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Tammie Nelson
- Los Alamos Natl Lab
- Los Alamos National Laboratory
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Sebastian Fernandez Alberti
- Universidad Nacional de Quilmes
- Department of Science and Technology, National University of Quilmes
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Adrian Roitberg
- University of Florida
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Sergei Tretiak
- Los Alamos Natl Lab
- Los Alamos National Lab
- Los Alamos National Laboratory
- Physics and Chemistry of Materials, Los Alamos National Laboratory
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Open challenges in nonadiabatic dynamics: photons and electron-hole pairs
Invited
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Presenters
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Joseph Subotnik
- Univ of Pennsylvania
Authors
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Joseph Subotnik
- Univ of Pennsylvania
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Quantum Mechanical Photochemistry
Invited
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Presenters
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Donald Truhlar
- Chemistry, University of Minnesota
- Univ of Minnesota - Twin Cities
- Univ of Minn - Minneapolis
Authors
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Donald Truhlar
- Chemistry, University of Minnesota
- Univ of Minnesota - Twin Cities
- Univ of Minn - Minneapolis
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Quinonile Photobasicity is Mediated by Hole Injection
ORAL
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Presenters
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Saswata Roy
- Chemistry, University of California, Irvine
Authors
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Saswata Roy
- Chemistry, University of California, Irvine
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Filipp Furche
- Chemistry, University of California, Irvine
- Chemistry Department, University of California
- University of California Irvine
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Splitting a system into small fragments: Electron dynamics from real-time density matrix embedding theory
ORAL
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Presenters
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Joshua Kretchmer
- Caltech
Authors
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Joshua Kretchmer
- Caltech
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Garnet Chan
- Caltech
- CCE, California Institute of Technology
- Division of Chemistry and Chemical Engineering, California Institute of Technology
- Division of Chemistry and Chemical Engineering, Caltech
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Quantifying Early Time Quantum Decoherence Dynamics through Fluctuations
ORAL
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Presenters
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Bing Gu
- University of Rochester
- Chemistry , University of Rochester
Authors
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Bing Gu
- University of Rochester
- Chemistry , University of Rochester
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Ignacio Franco
- Univ of Rochester
- University of Rochester
- Chemistry , University of Rochester
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