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$$\hbox {H}_2$$-roaming dynamics in the formation of $$\hbox {H}_{3}^{+}$$ following two-photon double ionization of ethanol and aminoethanol

Aaron Ngai, Sebastian Hartweg, Jakob D. Asmussen, Björn Bastian, M. Bonanomi, Carlo Callegari, M. Danailov, Michele Di Fraia, R. Feifel, Sarang Dev Ganeshamandiram, Sivarama Krishnan, Aaron LaForge, Friedemann Landmesser, Ltaief Ben Ltaief, Moritz Michelbach, Nitish Pal, Oksana Plekan, Nicolas Rendler, Lorenzo Raimondi, Fabian Richter, Audrey Scognamiglio, Tobias Sixt, Richard J. Squibb, Katrin Dulitz, F. Stienkemeier, M. Mudrich

2025Scientific Reports7 citationsDOIOpen Access PDF

Abstract

Roaming reactions involving a neutral fragment of a molecule that transiently wanders around another fragment before forming a new bond are intriguing and peculiar pathways for molecular rearrangement. Such reactions can occur for example upon double ionization of small organic molecules, and have recently sparked much scientific interest. We have studied the dynamics of the [Formula: see text]-roaming reaction leading to the formation of [Formula: see text] after two-photon double ionization of ethanol and 2-aminoethanol, using an XUV-UV pump-probe scheme. For ethanol, we find dynamics similar to previous studies employing different pump-probe schemes, indicating the independence of the observed dynamics from the method of ionization and the photon energy of the disruptive probe pulse. Surprisingly, we do not observe a kinetic isotope effect in ethanol-[Formula: see text], in contrast to previous experiments on methanol where such an effect was observed. This distinction indicates fundamental differences in the energetics of the reaction pathways as compared to the methanol molecule. The larger number of possible roaming pathways compared to methanol complicates the analysis considerably. In contrast to previous studies, we additionally analyze a broad range of dissociative ionization products, which feature distinct dynamics from that of [Formula: see text] and allow initial insight into the action of the disruptive UV-probe pulse.

Topics & Concepts

RoamingDynamics (music)IonizationEthanolPhysicsAtomic physicsTwo-photon excitation microscopyPhotonChemistryComputer scienceIonOpticsQuantum mechanicsTelecommunicationsExcitationBiochemistryAcousticsLaser-Matter Interactions and ApplicationsSpectroscopy and Quantum Chemical StudiesMass Spectrometry Techniques and Applications
$\hbox {H}_2$-roaming dynamics in the formation of $\hbox {H}_{3}^{+}$ following two-photon double ionization of ethanol and aminoethanol | Litcius