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Materials Data on LiTiRe by Materials Project

LiTiRe is half-Heusler structured and crystallizes in the cubic F-43m space group. The structure is three-dimensional. Li is bonded in a 10-coordinate geometry to four equivalent Ti and six equivalent Re atoms. All Li–Ti bond lengths are 2.58 Å. All Li–Re bond lengths are 2.98 Å. Ti is bonded in a body-centered cubic geometry to four equivalent Li and four equivalent Re atoms. All Ti–Re bond lengths are 2.58 Å. Re is bonded in a 10-coordinate geometry to six equivalent Li and four equivalent Ti atoms.

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