0100482736

open access

Accepted Manuscript

Quasi-elastic neutron scattering studies on fast dynamics of water molecules in tetra-n-butylammonium bromide semiclathrate hydrate

English (英語)

Applied Physics Letters

123(4)

044104

AIP Publishing

2023-07-26

2023-08-03

The dynamics of the water molecules in tetra-n-butyl-d36-ammonium bromide semiclathrate hydrate was investigated by quasi-elastic neutron scattering (QENS). The QENS results clearly revealed a fast reorientation motion of water molecules in the temperature range of 212–278 K. The mean jump distance of hydrogen atoms was within 1.5–2.0 Å. The relaxation time of water reorientation was estimated to be 100–410 ps with an activation energy of 10.2 ± 5.8 kJ·mol⁻¹. The activation energy was in good agreement with the cleavage energy of hydrogen bonds. Such a short relaxation time of water reorientation is possibly due to strong interaction between a bromide anion and its surrounding water molecules (similar to so-called negative hydration), which suggests a unique strategy for designing efficient, safe, and inexpensive proton conductors having the framework of semiclathrate hydrates.

Scattering theory

学術雑誌論文

This article may be downloaded for personal use only. Any other use requires prior permission of the author and AIP Publishing. This article appeared in (citation of published article) and may be found at https://doi.org/10.1063/5.0157560.