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• W2293427450 endingPage "67" @default.
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• W2293427450 abstract "Among chalcogenide semiconductors for thermoelectric applications, alkali-metal bismuth compounds occur in many complex compositions favorable for high performance. Although LiBi3S5 had been announced in 1977, the potential 1D lithium-ion conductor has hitherto eluded selective synthesis and structure determination. In this study, we present a solid-state route to phase-pure LiBi3S5 powder starting from LiBiS2 and Bi2S3. Neutron diffractograms and lithium NMR spectra reveal its crystal structure to be a cation-disordered variety of the AgBi3S5 type (synthetic pavonite; monoclinic, C2/m). Topological analyses and lithium NMR relaxometry suggest that correlated lithium-ion diffusion with activation energies up to 0.66(2) eV occurs along the channels in b direction including tetrahedral voids. Because of cation disorder, immobile bismuth(III) ions clog these pathways, making LiBi3S5 a moderate to poor ionic conductor. The synthesis route reported is nonetheless promising for new lithium bismuth sulfides with, possibly ordered, structure types of the pavonite homologous series." @default.
• W2293427450 created "2016-06-24" @default.
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• W2293427450 date "2016-06-01" @default.
• W2293427450 modified "2023-10-02" @default.
• W2293427450 title "LiBi3S5—A lithium bismuth sulfide with strong cation disorder" @default.
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• W2293427450 doi "https://doi.org/10.1016/j.jssc.2016.03.010" @default.
• W2293427450 hasPublicationYear "2016" @default.
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