Probing electronic and vibrational dynamics in molecules by time-resolved photoelectron, Auger-electron, and X-ray photon scattering spectroscopy

Faraday Discussions
Kochise BennettShaul Mukamel

Abstract

We present a unified description for time-resolved electron and photon scattering spectroscopies from molecules prepared in nonstationary states. Signals are expressed in terms of superoperator Green's functions and a systematic procedure for treating various degrees of freedom consistently at different levels of theory is developed. The standard Fermi Golden Rule expressions for photoelectron spectra, which are limited to broad, slowly-varying signals, are obtained as a limiting case of our more general theory that applies to broader parameter regimes.

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Citations

Dec 23, 2015·Journal of Chemical Theory and Computation·Kochise BennettShaul Mukamel
Apr 12, 2016·The Journal of Physical Chemistry Letters·Triet S NguyenJohn Parkhill
Sep 3, 2016·Journal of Chemical Theory and Computation·Wilmer Arbelo-GonzálezMario Barbatti
Dec 26, 2018·Proceedings of the National Academy of Sciences of the United States of America·Lyuzhou YeShaul Mukamel
Oct 7, 2020·International Journal of Radiation Biology·Roger W Howell
Nov 6, 2018·Molecules : a Journal of Synthetic Chemistry and Natural Product Chemistry·Sebastian MaiSusanne Ullrich
May 17, 2018·Chemical Reviews·Rachel Crespo-Otero, Mario Barbatti

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