First-principles study of CaB <sub>12</sub> H <sub>12</sub> as a potential solid-state conductor for Ca
Article 2020 en
Authors
JK
Julius Koettgen
CB
Christopher J. Bartel
JS
Jimmy‐Xuan Shen
Abstract
1 min read
Calcium dodecahydro- <italic>closo</italic> -dodecaborate, CaB <sub>12</sub> H <sub>12</sub> , has a percolating Ca migration path with low activation barrier (650 meV) and can be doped with Al, Bi, or a number of trivalent rare-earth cations.
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