Materials Data on TiCuSn by Materials Project
CuSnTi crystallizes in the hexagonal P6_3mc space group. The structure is three-dimensional. Ti is bonded in a 12-coordinate geometry to two equivalent Ti, six equivalent Cu, and six equivalent Sn atoms. Both Ti–Ti bond lengths are 3.02 Å. There are three shorter (2.88 Å) and three longer (3.05 Å) Ti–Cu bond lengths. There are three shorter (2.95 Å) and three longer (2.98 Å) Ti–Sn bond lengths. Cu is bonded in a 11-coordinate geometry to six equivalent Ti and five equivalent Sn atoms. There are a spread of Cu–Sn bond distances ranging from 2.56–3.21 Å. Sn is bonded in a 11-coordinate geometry to six equivalent Ti and five equivalent Cu atoms.
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