Materials Data on TiTeRu by Materials Project
TiRuTe is half-Heusler structured and crystallizes in the cubic F-43m space group. The structure is three-dimensional. Ti is bonded to four equivalent Ru and six equivalent Te atoms to form a mixture of distorted corner and face-sharing TiTe6Ru4 tetrahedra. All Ti–Ru bond lengths are 2.66 Å. All Ti–Te bond lengths are 3.07 Å. Ru is bonded in a body-centered cubic geometry to four equivalent Ti and four equivalent Te atoms. All Ru–Te bond lengths are 2.66 Å. Te is bonded in a 10-coordinate geometry to six equivalent Ti and four equivalent Ru 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:
- 1749173
- Report Number(s):
- mp-1100412
- Country of Publication:
- United States
- Language:
- English
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