Materials Data on TiI3 by Materials Project
TiI3 crystallizes in the hexagonal P6_3/mcm space group. The structure is one-dimensional and consists of one TiI3 ribbon oriented in the (0, 0, 1) direction. Ti3+ is bonded to six equivalent I1- atoms to form face-sharing TiI6 octahedra. All Ti–I bond lengths are 2.80 Å. I1- is bonded in a 2-coordinate geometry to two equivalent Ti3+ atoms.
- Research Organization:
- LBNL Materials Project; Lawrence Berkeley National Laboratory (LBNL), Berkeley, CA (United States)
- Sponsoring Organization:
- USDOE Office of Science (SC), Basic Energy Sciences (BES) (SC-22)
- Contributing Organization:
- The Materials Project; MIT; UC Berkeley; Duke; U Louvain
- DOE Contract Number:
- AC02-05CH11231
- OSTI ID:
- 1199342
- Report Number(s):
- mp-23223
- Country of Publication:
- United States
- Language:
- English
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