Materials Data on Li3Ti2(FeO4)2 by Materials Project
LiTiO2(LiFeO2)2TiO2 crystallizes in the triclinic P-1 space group. The structure is one-dimensional and consists of one titanium dihydroxide molecule; two LiFeO2 ribbons oriented in the (1, 1, 1) direction; and one LiTiO2 ribbon oriented in the (1, 1, 1) direction. In each LiFeO2 ribbon, Li1+ is bonded in a linear geometry to two equivalent O2- atoms. Both Li–O bond lengths are 1.43 Å. Fe+2.50+ is bonded in a distorted linear geometry to two equivalent O2- atoms. Both Fe–O bond lengths are 1.68 Å. O2- is bonded in a 2-coordinate geometry to one Li1+ and one Fe+2.50+ atom. In the LiTiO2 ribbon, Li1+ is bonded in a distorted linear geometry to two equivalent O2- atoms. Both Li–O bond lengths are 1.70 Å. Ti4+ is bonded in a linear geometry to two equivalent O2- atoms. Both Ti–O bond lengths are 1.36 Å. O2- is bonded in a distorted linear geometry to one Li1+ and one Ti4+ atom.
- 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:
- 1292854
- Report Number(s):
- mp-762702
- Country of Publication:
- United States
- Language:
- English
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