ISIS Neutron and Muon Source Data Journal

This is a page describing data taken during an experiment at the ISIS Neutron and Muon Source. Information about the ISIS Neutron and Muon Source can be found at https://www.isis.stfc.ac.uk.


Li+ diffusion mechanism in solid-state superionic conductors by QENS

Abstract: Li7-xLa3Zr2-xAxO12 (A=Al, Ga, Nb, Ta; LLZO) is one of the premier electrolyte materials for all solid-state batteries, combining high ionic conductivity, good chemical stability, and a wide electrochemical window. To these days, a conclusive description of the lithium diffusion mechanism that leads to the high conductivity is absent in the literature, with the role of collective motions and ion correlation not fully investigated. We have recently begun a systematic study of LLZO with A = Nb and x = 0.5 to fully elucidate its structure and dynamics, aiming to fill this knowledge gap by focusing our attention on the role of collective motions and phonons in the diffusion. We have so far carried out inelastic neutron scattering measurements of the phonons using the MERLIN and MARI instruments, as well as a preliminary polarized QENS experiment on LET instrument a using powder sample with a slightly different composition. Now we wish to better understand the effect of temperature on the quasi-elastic diffuse scattering by performing a Rapid access measurement on powder sample of LLZO;Nb 0.5 on the IRIS instrument. We have prepared a large (20g) powder sample, and plan to measure the system at approximately 4 temperatures for 16 hours each.

Principal Investigator: Dr Gøran Nilsen
Experimenter: Mr Cristhian David Hinostroza Vargas Machuca
Experimenter: Mr Zhongxun Cui
Experimenter: Dr Diana Lucia Quintero Castro
Experimenter: Dr Robin Perry
Local Contact: Dr Ian Silverwood

DOI: 10.5286/ISIS.E.RB2500054

ISIS Experiment Number: RB2500054

Part DOI Instrument Public release date Download Link
10.5286/ISIS.E.RB2500054-1 IRIS 16 July 2028 Download

Publisher: STFC ISIS Neutron and Muon Source

Data format: RAW/Nexus
Select the data format above to find out more about it.

Data Citation

The recommended format for citing this dataset in a research publication is as:
[author], [date], [title], [publisher], [doi]

For Example:
Dr Gøran Nilsen et al; (2025): Li+ diffusion mechanism in solid-state superionic conductors by QENS , STFC ISIS Neutron and Muon Source, https://doi.org/10.5286/ISIS.E.RB2500054

Data is released under the CC-BY-4.0 license.



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