Reaction Pathways of Water Dimer Following Single Ionization

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Abstract

Water dimer (H2O)2─a vital component of the earth’s atmosphere─is an important prototypical hydrogen-bonded system. It provides direct insights into fundamental chemical and biochemical processes, e.g., proton transfer and ionic supramolecular dynamics, occurring in astro- and atmospheric chemistry. Exploiting a purified molecular beam of water dimer and multimass ion imaging, we report the simultaneous detection of all generated ion products of (H2O)2+ fragmentation following single ionization. Detailed information about ion yields and reaction energetics of 13 ion-radical pathways, 6 of which are new, of (H2O)2+ are presented, including strong 18O-isotope effects.

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Vinklárek, I. S., Bromberger, H., Vadassery, N., Jin, W., Küpper, J., & Trippel, S. (2024). Reaction Pathways of Water Dimer Following Single Ionization. Journal of Physical Chemistry A, 128(9), 1593–1599. https://doi.org/10.1021/acs.jpca.3c07958

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