Imaging CF 3 I conical intersection and photodissociation dynamics with ultrafast electron diffraction

Author:

Yang Jie12ORCID,Zhu Xiaolei23ORCID,Wolf Thomas J. A.2ORCID,Li Zheng245ORCID,Nunes J. Pedro F.6ORCID,Coffee Ryan278ORCID,Cryan James P.2,Gühr Markus29,Hegazy Kareem28ORCID,Heinz Tony F.210ORCID,Jobe Keith1,Li Renkai1ORCID,Shen Xiaozhe1ORCID,Veccione Theodore1,Weathersby Stephen1,Wilkin Kyle J.11,Yoneda Charles1,Zheng Qiang1,Martinez Todd J.23ORCID,Centurion Martin11,Wang Xijie1

Affiliation:

1. SLAC National Accelerator Laboratory, Menlo Park, CA, USA.

2. Stanford PULSE Institute, SLAC National Accelerator Laboratory, Menlo Park, CA, USA.

3. Department of Chemistry, Stanford University, Stanford, CA, USA.

4. Center for Free-Electron Laser Science, Deutsches Elektronen-Synchrotron (DESY), Hamburg, Germany.

5. Max Planck Institute for the Structure and Dynamics of Matter, Hamburg, Germany.

6. Department of Chemistry, University of York, Heslington, York, UK.

7. Linac Coherent Light Source, SLAC National Accelerator Laboratory, Menlo Park, CA, USA.

8. Department of Physics, Stanford University, Stanford, CA, USA.

9. Institut für Physik und Astronomie, Universität Potsdam, Potsdam, Germany.

10. Department of Applied Physics, Stanford University, Stanford, CA, USA.

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

Abstract

Motion picture of a conical intersection In most chemical reactions, electrons move earlier and faster than nuclei. It is therefore common to model reactions by using potential energy surfaces that depict nuclear motion in a particular electronic state. However, in certain cases, two such surfaces connect in a conical intersection that mingles ultrafast electronic and nuclear rearrangements. Yang et al. used electron diffraction to obtain time-resolved images of CF 3 I molecules traversing a conical intersection in the course of photolytic cleavage of the C–I bond (see the Perspective by Fielding). Science , this issue p. 64 ; see also p. 30

Funder

National Science Foundation

U.S. Department of Energy

Volkswagen Foundation

Publisher

American Association for the Advancement of Science (AAAS)

Subject

Multidisciplinary

Reference62 articles.

1. G. Herzberg Molecular Spectra and Molecular Structure III (Polyatomic Molecules) (1966).

2. J. Michl V. Bonacic-Koutecky Electronic Aspects of Organic Photochemistry (Wiley 1990).

3. W. Domcke D. R. Yarkony H. Köppel Conical Intersections—Electronic Structure Dynamics and Spectroscopy (World Scientific Pub 2004).

4. Dynamics of Light Harvesting in Photosynthesis

5. Conical intersection dynamics of the primary photoisomerization event in vision

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