2020
DOI: 10.1016/j.jssc.2020.121263
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Crystal structures and ionic conductivity in Li2OHX (X = Cl, Br) antiperovskites

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Cited by 30 publications
(42 citation statements)
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“…This activation energy is similar to that of Li 2 OHBr (0.55 eV). 24 We note again that the Li vacancies are introduced in the Li1 and Li3 sites and that the rock-salt type LiBr layer is rigid. This implies that Li-ion hopping conduction through the vacant sites are conned within the two-dimensional double antiperovskite layers.…”
Section: Resultsmentioning
confidence: 76%
See 1 more Smart Citation
“…This activation energy is similar to that of Li 2 OHBr (0.55 eV). 24 We note again that the Li vacancies are introduced in the Li1 and Li3 sites and that the rock-salt type LiBr layer is rigid. This implies that Li-ion hopping conduction through the vacant sites are conned within the two-dimensional double antiperovskite layers.…”
Section: Resultsmentioning
confidence: 76%
“…The obtained conductivity at 30 C is 1.27 Â 10 À7 S cm À1 , which is comparable to that of the simple antiperovskite Li 2 -OHBr (1.33 Â 10 À7 S cm À1 ). 24 A DC polarization measurement at the same temperature (Fig. S4 †) reveals that the electronic conductivity is of the order of 10 À11 S cm À1 , which is about four orders of magnitude lower than the total conductivity.…”
Section: Resultsmentioning
confidence: 94%
“…Compared to lithium oxyhalide SSEs, the pure phase of lithium halide hydroxide SSEs is easier to be experimentally obtained by facile solid-state sintering. 30 And theoretical calculations also demonstrated that the formation energy of Li 2 OHCl from LiOH + LiCl is significantly lower than that of Li 3 OCl. 65 However, the calculated value of formation energy of Li 2 OHCl is positive, meaning that Li 2 OHCl is also thermodynamically unstable.…”
Section: Phase Stabilitymentioning
confidence: 94%
“…Moreover, Li 2 OHCl exhibits an orthorhombic phase at low temperature and transforms into a cubic structure when heated to around 40 C, 30,32,34 accompanied with the enhanced ionic conductivity by two orders of magnitude. It indicates that a high-symmetry structure facilitates Li + motion in LiRAPs.…”
Section: Phase Stabilitymentioning
confidence: 99%
“…Later, the proton-rich derivatives Li 2 OHX (X = Cl, Br, I) have also been synthesized and showed higher purity and milder synthesis process ( Hood et al, 2016 ; Li et al, 2016 ; Xiao et al, 2021 ). The Li 2 OHX (X = Cl, Br, I) electrolytes possess high lithium content and a similar crystal structure to Li 3 OX but with higher phase stability and can be prepared from low-price starting materials ( Hood et al, 2016 ; Li et al, 2016 ; Koedtruad et al, 2020 ; Lu et al, 2020 ; Deng et al, 2021 ; Guo et al, 2021 ). They have also displayed remarkable chemical and electrochemical stabilities toward lithium metals even at elevated temperatures ( Guo et al, 2021 ; Lai et al, 2021 ).…”
Section: Introductionmentioning
confidence: 99%