Materials Data on TiTeS by Materials Project
TiTeS crystallizes in the trigonal P3m1 space group. The structure is two-dimensional and consists of one TiTeS sheet oriented in the (0, 0, 1) direction. Ti4+ is bonded to three equivalent Te2- and three equivalent S2- atoms to form distorted edge-sharing TiTe3S3 octahedra. All Ti–Te bond lengths are 2.82 Å. All Ti–S bond lengths are 2.41 Å. Te2- is bonded in a 3-coordinate geometry to three equivalent Ti4+ atoms. S2- is bonded in a 3-coordinate geometry to three equivalent Ti4+ atoms.
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