Distinct transient structural rearrangement of ionized water revealed by XFEL X-ray pump X-ray probe experiment

Fuente: arXiv
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Autori principali: Stransky, Michal, Lane, Thomas J., Gorel, Alexander, Boutet, Sébastien, Schlichting, Ilme, Mancuso, Adrian P., Jurek, Zoltan, Ziaja, Beata
Natura: Preprint
Pubblicazione: 2024
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author Stransky, Michal
Lane, Thomas J.
Gorel, Alexander
Boutet, Sébastien
Schlichting, Ilme
Mancuso, Adrian P.
Jurek, Zoltan
Ziaja, Beata
author_facet Stransky, Michal
Lane, Thomas J.
Gorel, Alexander
Boutet, Sébastien
Schlichting, Ilme
Mancuso, Adrian P.
Jurek, Zoltan
Ziaja, Beata
contents Using X-ray free electron laser (XFEL) radiation to conduct an X-ray pump X-ray probe experiment, we studied strongly ionized water as part of our ongoing work on radiation damage. After irradiance with a pump pulse with a nominal fluence of ~$5 \times 10^5$ J/cm$^2$, we observed for pump-probe delays of 75 fs and longer an unexpected structural rearrangement, exhibiting a characteristic length scale of ~9 Å. Simulations suggest that the experiment probes a superposition of ionized water in two distinct regimes. In the first, fluences expected at the X-ray focus create nearly completely ionized water, which as a result becomes effectively transparent to the probe. In the second regime, out of focus pump radiation produces O$^{1+}$ and O$^{2+}$ ions, which rearrange due to Coulombic repulsion over 10s of fs. Importantly, structural changes in the low fluence regime have implications for the design of two-pulse X-ray experiments that aim to study unperturbed liquid samples. Our simulations account for two key observations in the experimental data: the decrease in ambient water signal and an increase in low-angle X-ray scattering. They cannot, however, account for the experimentally observed 9 Å feature. A satisfactory account of this feature presents a new challenge for theory.
format Preprint
id arxiv_https___arxiv_org_abs_2402_10840
institution arXiv
publishDate 2024
record_format arxiv
spellingShingle Distinct transient structural rearrangement of ionized water revealed by XFEL X-ray pump X-ray probe experiment
Stransky, Michal
Lane, Thomas J.
Gorel, Alexander
Boutet, Sébastien
Schlichting, Ilme
Mancuso, Adrian P.
Jurek, Zoltan
Ziaja, Beata
Plasma Physics
Using X-ray free electron laser (XFEL) radiation to conduct an X-ray pump X-ray probe experiment, we studied strongly ionized water as part of our ongoing work on radiation damage. After irradiance with a pump pulse with a nominal fluence of ~$5 \times 10^5$ J/cm$^2$, we observed for pump-probe delays of 75 fs and longer an unexpected structural rearrangement, exhibiting a characteristic length scale of ~9 Å. Simulations suggest that the experiment probes a superposition of ionized water in two distinct regimes. In the first, fluences expected at the X-ray focus create nearly completely ionized water, which as a result becomes effectively transparent to the probe. In the second regime, out of focus pump radiation produces O$^{1+}$ and O$^{2+}$ ions, which rearrange due to Coulombic repulsion over 10s of fs. Importantly, structural changes in the low fluence regime have implications for the design of two-pulse X-ray experiments that aim to study unperturbed liquid samples. Our simulations account for two key observations in the experimental data: the decrease in ambient water signal and an increase in low-angle X-ray scattering. They cannot, however, account for the experimentally observed 9 Å feature. A satisfactory account of this feature presents a new challenge for theory.
title Distinct transient structural rearrangement of ionized water revealed by XFEL X-ray pump X-ray probe experiment
topic Plasma Physics
url https://arxiv.org/abs/2402.10840