Imaging CF3I Conical Intersection and Photodissociation Dynamics with Ultrafast Electron Diffraction

Published in Science, 361, 64 (2018), 2018

Recommended citation: J. Yang, X. Zhu, T. J. A. Wolf, et al. (2018). "Imaging CF3I Conical Intersection and Photodissociation Dynamics with Ultrafast Electron Diffraction." Science, 361(6397), 64-67. https://www.science.org/doi/10.1126/science.aat0049

Ultrafast gas-phase electron diffraction captures the real-space photodissociation dynamics of CF3I through a conical intersection.

  • Simultaneously characterizes one-photon and two-photon excitation channels in isolated CF3I molecules.
  • Maps out the real-space trajectories of a coherent nuclear wave packet bifurcating onto two potential energy surfaces at the conical intersection.
  • Resolves excitation of both umbrella and breathing vibrational modes in the CF3 fragment in multiple nuclear dimensions, benchmarking ab initio nonadiabatic dynamics calculations.