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Ultrafast Hydrogen Migration and Fragmentation Dynamics in 1- and 2-Propanol

POSTER

Abstract

We present a comparative study of laser-induced fragmentation and hydrogen migration dynamics, triggered through ionization, for the two structural isomers, 1-propanol and 2-propanol. Using pump-probe spectroscopy in combination with coincident ion-momentum imaging techniques, we identify the channels showing direct breakup and single/double hydrogen migration for both the isomers. We extract the kinetic energy release (KER) as a function of pump-probe delay, which helps determine the timescales of the different processes. Interestingly, we observe different features in the KER for the two isomers, indicating different reaction pathways resulting in the same final ionic fragments. Our experimental results are interpreted by state-of-the-art ab initio molecular dynamics calculations.

 
 
 

Publication: 1. M. McDonnell, A. C. LaForge, J. Reino-Gonzalez, M. Disla, N. G. Kling, D. Mishra, R. Obaid, M. Sundberg, V. Svoboda, S. Díaz-Tendero, et al., Ultrafast Laser-Induced Isomerization Dynamics in Acetonitrile. J. Phys. Chem. Lett., 11, 6724 (2020).<br><br>2. N.G. Kling, S. Díaz-Tendero, R. Obaid, M. Disla, H. Xiong, M. Sundberg, S. Khosravi, M. Davino, P. Drach, A. Carroll, et al., Time-resolved molecular dynamics of single and double hydrogen migration in ethanol, Nat. Commun. 10, 1 (2019).

Presenters

  • Debadarshini Mishra

    University of Connecticut

Authors

  • Debadarshini Mishra

    University of Connecticut

  • J. Reino-Gonzalez

    Departamento de Quimica, Modulo 13, Universidad Autonoma de Madrid, 28049 Madrid, Spain

  • Razib Obaid

    University of Connecticut

  • Aaron C LaForge

    University of Connecticut

  • Sergio Díaz-Tendero

    Departamento de Quimica, Modulo 13, Universidad Autonoma de Madrid, 28049 Madrid, Spain, Departamento de Quimica, Modulo 13, Universidad Autonoma de Madrid, 28049 Madrid

  • Fernando Martin

    Universidad Autónoma de Madrid, Departamento de Quimica, Modulo 13, Universidad Autonoma de Madrid, 28049 Madrid, Spain, Departamento de Quimica, Modulo 13, Universidad Autonoma de Madrid, 28049 Madrid

  • Nora Berrah

    University of Connecticut