1. Novel Mg-ion conductive oxide of μ-cordierite Mg 0.6 Al 1.2 Si 1.8 O 6 .
- Author
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Takeda H, Nakano K, Tanibata N, and Nakayama M
- Abstract
Solid electrolytes with high Mg-ion conductivity are required to develop solid-state Mg-ion batteries. The migration energies of the Mg
2+ ions of 5,576 Mg compounds tabulated from the inorganic crystal structure database (ICSD) were evaluated via high-throughput calculations. Among the computational results, we focused on the Mg2+ ion diffusion in Mg0.6 Al1.2 Si1.8 O6 , as this material showed a relatively low migration energy for Mg2+ and was composed solely of ubiquitous elements. Furthermore, first-principles molecular dynamics calculations confirmed a single-phase Mg2+ ion conductor. The bulk material with a single Mg0.6 Al1.2 Si1.8 O6 phase was successfully prepared using the sol-gel method. The relative density of the sample was 81%. AC impedance measurements indicated an electrical conductivity of 1.6 × 10-6 Scm-1 at 500°C. The activation energy was 1.32 eV, which is comparable to that of monoclinic-type Mg0.5 Zr2 (PO4 )3 ., (© 2020 The Author(s). Published by National Institute for Materials Science in partnership with Taylor & Francis Group.)- Published
- 2020
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