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Focus Session: Ultrafast Non-adiabatic Dynamics in Molecules

FOCUS · Z04 · ID: 1442442

Presentations

  • Which form of the molecular Hamiltonian is the most suitable for simulating the nonadiabatic quantum dynamics at a conical intersection? [1]

    ORAL

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    Publication: [1] S. Choi and J. Vanícek, "Which form of the molecular Hamiltonian is the most suitable for simulating the nonadiabatic quantum dynamics at a conical intersection?" Communication, J. Chem. Phys. 153, 211101 (2020).<br>[2] S. Choi and J. Vanícek, "How important are the residual nonadiabatic couplings for an accurate simulation of the nonadiabatic quantum dynamics?" J. Chem. Phys. 154, 124119 (2021).

    Presenters

    • Jiri Vanicek

      Ecole Polytechnique Federale de Lausanne

    Authors

    • Jiri Vanicek

      Ecole Polytechnique Federale de Lausanne

    • Seonghoon Choi

      University of Toronto

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  • UV-induced Dissociation Dynamics of Bromoform Probed by Ultrafast Electron Diffraction

    ORAL

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    Presenters

    • Lars Hoffmann

      Lawrence Berkeley National Laboratory

    Authors

    • Lars Hoffmann

      Lawrence Berkeley National Laboratory

    • Benjamin W Toulson

      Lawrence Berkeley National Laboratory

    • Pedro Nunes

      University of Nebraska-Lincoln, University of Nebraska - Lincoln

    • Martin Centurion

      University of Nebraska - Lincoln, Department of Physics and Astronomy, University of Nebraska–Lincoln, Lincoln, NE, USA

    • Ming-Fu Lin

      SLAC - Natl Accelerator Lab, LCLS, SLAC National Accelerator Laboratory, Menlo Park, CA, USA, SLAC

    • Andrew Attar

      SLAC National Accelerator Laboratory

    • Jie Yang

      SLAC National Accelerator Laboratory

    • Michael W Zuerch

      University of California, Berkeley

    • Oliver Gessner

      Lawrence Berkeley National Laboratory

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  • Site Selective Coulomb Explosion Imaging of Excited State Structural Rearrangements in CS<sub>2</sub>

    ORAL

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    Presenters

    • Ruaridh Forbes

      SLAC National Accelerator Laboratory, LCLS, SLAC National Accelerator Laboratory, Menlo Park, CA, USA

    Authors

    • James Unwin

      Oxford University

    • Felix Allum

      Stanford University, Stanford PULSE Institute, Stanford PULSE Institute, Menlo Park, CA, USA

    • Ian Gabalski

      Stanford Univ, Stanford University

    • Benjamin Erk

      DESY

    • Michael Burt

      Oxford University

    • Ruaridh Forbes

      SLAC National Accelerator Laboratory, LCLS, SLAC National Accelerator Laboratory, Menlo Park, CA, USA

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  • X-ray induced Coulomb explosion images of toluene and its isomers

    ORAL

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    Presenters

    • Kurtis D Borne

      J.R. Macdonald Laboratory, Department of Physics, Kansas State University, Manhattan, KS, USA, Kansas State University

    Authors

    • Kurtis D Borne

      J.R. Macdonald Laboratory, Department of Physics, Kansas State University, Manhattan, KS, USA, Kansas State University

    • Rebecca Boll

      European XFEL, Schenfeld, Germany, European XFEL

    • Surjendu Bhattacharyya

      J.R. Macdonald Laboratory, Kansas State University, J.R. Macdonald Laboratory, Department of Physics, Kansas State University, Manhattan, KS, USA, Kansas State University

    • Till Jahnke

      European XFEL, Schenfeld, Germany

    • Xiang Li

      LCLS, SLAC National Accelerator Laboratory, Menlo Park, CA, USA, SLAC - Natl Accelerator Lab, SLAC

    • Enliang Wang

      J.R. Macdonald Laboratory, Department of Physics, Kansas State University, Manhattan, KS, USA, Kansas State university

    • Daniel Rolles

      J.R. Macdonald Laboratory, Kansas State University, J.R. Macdonald Laboratory, Department of Physics, Kansas State University, Manhattan, KS, USA, Kansas State, Kansas State University

    • Artem Rudenko

      J.R. Macdonald Laboratory, Kansas State University, J.R. Macdonald Laboratory, Department of Physics, Kansas State University, Manhattan, KS, USA, Kansas State University

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  • Investigating the UV-induced isomerization of Norbornadiene to Quadricyclane using ultrafast X-ray scattering

    ORAL

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    Presenters

    • Surjendu Bhattacharyya

      J.R. Macdonald Laboratory, Kansas State University, J.R. Macdonald Laboratory, Department of Physics, Kansas State University, Manhattan, KS, USA, Kansas State University

    Authors

    • Surjendu Bhattacharyya

      J.R. Macdonald Laboratory, Kansas State University, J.R. Macdonald Laboratory, Department of Physics, Kansas State University, Manhattan, KS, USA, Kansas State University

    • Artem Rudenko

      J.R. Macdonald Laboratory, Kansas State University, J.R. Macdonald Laboratory, Department of Physics, Kansas State University, Manhattan, KS, USA, Kansas State University

    • Peter M Weber

      Brown University

    • Martin Centurion

      University of Nebraska - Lincoln, Department of Physics and Astronomy, University of Nebraska–Lincoln, Lincoln, NE, USA

    • Michael Minitti

      SLAC National Accelerator Laboratory, SLAC Natl Accelerator Lab

    • Adam Kirrander

      University of Oxford, Oxford University

    • Daniel Rolles

      J.R. Macdonald Laboratory, Kansas State University, J.R. Macdonald Laboratory, Department of Physics, Kansas State University, Manhattan, KS, USA, Kansas State, Kansas State University

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  • Excited State Nonadiabatic Dynamics Of o-Nitrophenol: Theoretical Insight into Pump-probe Experiments and Dissociation Mechanisms

    ORAL

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    Publication: "Excited State Dynamics of o-Nitrophenol Studied with UV Pump VUV Probe Time Resolved Photoelectron and Photoion Spectroscopy" by Samuel McClung, Dakshitha Abeygunewardane, Spiridoula Matsika, and Thomas Weinacht. To be submitted to JCP.

    Presenters

    • Dakshitha Abeygunewardane

      Temple University

    Authors

    • Dakshitha Abeygunewardane

      Temple University

    View abstract →