Study of the influence of lattice polarisability on Li+ diffusion in LiMX4 (M = Al, Ga; X= Cl, Br, I) using INS

DOI

In the current work, we study inorganic solid-state electrolytes for lithium-ion batteries. These materials, unlike liquid electrolytes, could lead to a breakthrough in battery lifetime and safety, since the use of flammable organic solvents is no longer needed. Our aim is to study the ways in which the ionic conductivity can be tuned and contribute to the understanding of the synthesis-structure-property relationships. We propose to perform INS experiments on a series of LiMX4 (M= Al, Ga; X = Cl, Br, I) samples. Our interest is to asses the effect of both the mechanochemical synthesis and the varying polarisability of the anion framework (as a function of X). In order to explain experimental observations we have also performed phonon calculations by DFT. These complementary studies will be of key importance to propose valid correlations and interpret experimental data.

Identifier
DOI https://doi.org/10.5286/ISIS.E.RB2010525-1
Metadata Access https://icatisis.esc.rl.ac.uk/oaipmh/request?verb=GetRecord&metadataPrefix=oai_datacite&identifier=oai:icatisis.esc.rl.ac.uk:inv/109978454
Provenance
Creator Mr Ross McFadzean; Dr Dimitrios Toroz; Dr Svemir Rudic; Mr Nicolas Andres Flores Gonzalez; Professor Duncan Gregory; Dr Devis Di Tommaso
Publisher ISIS Neutron and Muon Source
Publication Year 2023
Rights CC-BY Attribution 4.0 International; https://creativecommons.org/licenses/by/4.0/
OpenAccess true
Contact isisdata(at)stfc.ac.uk
Representation
Resource Type Dataset
Discipline Chemistry; Natural Sciences
Temporal Coverage Begin 2020-03-05T09:00:00Z
Temporal Coverage End 2020-03-11T09:35:49Z