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Autori principali: Bauerle, Lauren, Jaron, Agnieszka
Natura: Preprint
Pubblicazione: 2024
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Accesso online:https://arxiv.org/abs/2408.02216
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author Bauerle, Lauren
Jaron, Agnieszka
author_facet Bauerle, Lauren
Jaron, Agnieszka
contents Using Time-Dependent Density Functional Theory (TDDFT) nonlinear nonperturbative response of the molecular system is studied for photoisomerization reaction. The 1,3-cyclohexadiene photoisomerization is probed by the high-harmonic generation (HHG) process induced by the ultrashort few femtosecond intense laser pulse. For each of the long-lived or stable isomers, we present results for HHG spectra and HHG ellipticities, as well as multi-photon ionization. Moreover, the laser-induced electronic excitations are calculated and the effect of excitations on HHG spectra is discussed. We describe the characteristic properties of the nonlinear response for each of the isomers that can be used for ultrafast detection of the isomers by tracking the specific changes in HHG response.
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publishDate 2024
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spellingShingle High-order harmonic generation probing of a ring-opening reaction
Bauerle, Lauren
Jaron, Agnieszka
Chemical Physics
Quantum Physics
Using Time-Dependent Density Functional Theory (TDDFT) nonlinear nonperturbative response of the molecular system is studied for photoisomerization reaction. The 1,3-cyclohexadiene photoisomerization is probed by the high-harmonic generation (HHG) process induced by the ultrashort few femtosecond intense laser pulse. For each of the long-lived or stable isomers, we present results for HHG spectra and HHG ellipticities, as well as multi-photon ionization. Moreover, the laser-induced electronic excitations are calculated and the effect of excitations on HHG spectra is discussed. We describe the characteristic properties of the nonlinear response for each of the isomers that can be used for ultrafast detection of the isomers by tracking the specific changes in HHG response.
title High-order harmonic generation probing of a ring-opening reaction
topic Chemical Physics
Quantum Physics
url https://arxiv.org/abs/2408.02216