Electronic Structure and Dynamics

ORAL · Z01 · ID: 48502

Presentations

  • ORAL

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    Publication: Photosynthesis tunes quantum mechanical mixing of electronic and vibrational states to steer exciton energy transfer, J. S. Higgins, L. T. Lloyd, S. H. Sohail, M. A. Allodi, J. P. Otto, R. G. Saer, R. E. Wood, S. C. Massey, P.-C. Ting, R. E. Blankenship, G. S. Engel, Proceedings of the National Academy of Sciences 118 e2018240118 (2021).

    Redox conditions correlated with vibronic coupling modulate quantum beats in photosynthetic pigment-protein complexes, J. S. Higgins*, M. A. Allodi*, L. T. Lloyd, J. P. Otto, S. H. Sohail, R. G. Saer, R. E. Wood, S. C. Massey, P.-C. Ting, R. E. Blankenship, G. S. Engel, Proceedings of the National Academy of Sciences (accepted) [*Equal Contribution].

    Presenters

    • Jacob S Higgins

      • University of Chicago

    Authors

    • Jacob S Higgins

      • University of Chicago

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  • ORAL

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    Publication: Clock Transitions Guard Against Spin Decoherence in Singlet Fission, listed on arXiv --- submitted to Journal of Chemical Physics

    Presenters

    • Sina G Lewis

      • University of Colorado Boulder

    Authors

    • Sina G Lewis

      • University of Colorado Boulder

    • Kori E Smyser

      • University of Colorado Boulder

    • Joel D Eaves

      • University of Colorado Boulder

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  • ORAL

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    Presenters

    • Vijay R Singh

      • Department of Chemical Engineering, University of Illinois at Chicago, Chicago, Illinois 60608, United States, Materials Science Division, ANL, Argonne, IL, USA
      • Department of Physics, University of Illinois at Chicago, Chicago, IL, 60607
      • Univ Illinois at Chicago & MSD, ANL
      • University of Illinois at Chicago
      • Chemical Engineering Department, University of Illinois at Chicago
      • Department of Chemical Engineering, University of Illinois at Chicago, Chicago, Illinois 60608, United States, Materials Science Division, Argonne National Laboratory, IL, USA

    Authors

    • Vijay R Singh

      • Department of Chemical Engineering, University of Illinois at Chicago, Chicago, Illinois 60608, United States, Materials Science Division, ANL, Argonne, IL, USA
      • Department of Physics, University of Illinois at Chicago, Chicago, IL, 60607
      • Univ Illinois at Chicago & MSD, ANL
      • University of Illinois at Chicago
      • Chemical Engineering Department, University of Illinois at Chicago
      • Department of Chemical Engineering, University of Illinois at Chicago, Chicago, Illinois 60608, United States, Materials Science Division, Argonne National Laboratory, IL, USA

    • Naveen Dandu

      • Materials Science Division, Argonne National Laboratory, Argonne, IL, USA, Joint Center for Energy Storage Research (JCESR), Argonne, IL, USA
      • Univ Illinois at Chicago & MSD, ANL

    • Larry A Curtiss

      • Materials Science Division, Argonne National Laboratory, Argonne, IL, USA, Joint Center for Energy Storage Research (JCESR), Argonne, IL, USA.
      • MSD, ANL
      • Argonne National Laboratory
      • Materials Science Division, Argonne National Laboratory

    • Saw W Hla

      • Nanoscale and Quantum Phenomena Institute, Physics & Astronomy Department, Ohio University, Athens, Ohio 45701, United States, Center for Nanoscale Materials, ANL, IL, USA
      • Center for Nanoscale Materials, Argonne National Laboratory, Lemont, Illinois 60439, United States
      • Ohio University
      • Ohio University and Argonne National Laboratory
      • Ohio University & Argonne National Laboratory

    • Anh T Ngo

      • Department of Chemical Engineering, University of Illinois at Chicago, Chicago, Illinois 60608, United States, Materials Science Division, ANL, Argonne, IL, USA
      • Department of Chemical Engineering, University of Illinois at Chicago, Chicago, Illinois 60608, United States, Materials Science Division, Argonne National Laboratory, IL, USA
      • University of Illinois in Chicago

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  • ORAL

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    Publication: Tyler A. Anderson and C. J. Umrigar , "Nonlocal pseudopotentials and time-step errors in diffusion Monte Carlo", J. Chem. Phys. 154, 214110 (2021) https://doi.org/10.1063/5.0052838

    Presenters

    • Tyler A Anderson

      • Cornell University

    Authors

    • Tyler A Anderson

      • Cornell University

    • Cyrus J Umrigar

      • Cornell University

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  • ORAL

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    Presenters

    • Preston A Vargas

      • University of Florida

    Authors

    • Preston A Vargas

      • University of Florida

    • Luke Holtzman

      • Columbia University

    • Katayun Barmak

      • Columbia Univ
      • Columbia University

    • Richard G. G Hennig

      • University of Florida
      • Department of Materials Science and Engineering, University of Florida
      • Department of Materials Science and Engineering, University of Florida, Gainesville, Florida 32611, United States

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  • ORAL

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    Publication: Zeiser C.*, Moretti L.*,Lepple D., Cerullo G., Maiuri M., Broch K. (*contributed equally, co-first author), "Singlet heterofission in tetracene‐pentacene thin‐film blends" Angewandte Chemie International Editon, 2020 DOI: 10.1002/anie.202007412

    Presenters

    • Luca Moretti

      • Politecnico di Milano Univ
      • Department of Physics, Politecnico di Milano

    Authors

    • Luca Moretti

      • Politecnico di Milano Univ
      • Department of Physics, Politecnico di Milano

    • Clemens Zeiser

      • Tubingen University

    • Daniel Leppe

      • Tubingen University

    • Giulio Cerullo

      • Politecnico di Milano
      • Politecnico di Milano + Istituto di Fotonica e Nanotecnologie CNR
      • Department of Physics, Politecnico di Milano

    • Margherita Maiuri

      • Politecnico di Milano
      • Department of Physics, Politecnico di Milano
      • Politecnico do Milano

    • Katharina Broch

      • Tubingen University

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  • ORAL

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    Presenters

    • Debendra P Panda

      • Jawaharlal Nehru Centre for Advanced Scientific Research, Bangalore

    Authors

    • Debendra P Panda

      • Jawaharlal Nehru Centre for Advanced Scientific Research, Bangalore

    • Diptikanta Swain

      • ICT, Bhubaneswar

    • Athinarayan Sundaresan

      • Jawaharlal Nehru Centre for Advanced Scientific Research, Bangalore

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