Materials Data on Li3Mn2(NiO4)2 by Materials Project
LiMnO2(LiNiO2)2MnO2 crystallizes in the triclinic P-1 space group. The structure is one-dimensional and consists of one manganese hydroxide (mn(oh)2) molecule; one LiMnO2 ribbon oriented in the (1, 1, 1) direction; and two LiNiO2 ribbons oriented in the (1, 1, 1) direction. In the LiMnO2 ribbon, Li1+ is bonded in a distorted linear geometry to two equivalent O2- atoms. Both Li–O bond lengths are 1.60 Å. Mn+4.50+ is bonded in a distorted linear geometry to two equivalent O2- atoms. Both Mn–O bond lengths are 1.37 Å. O2- is bonded in a distorted linear geometry to one Li1+ and one Mn+4.50+ atom. In each LiNiO2 ribbon, Li1+ is bonded in a linear geometry to two equivalent O2- atoms. Both Li–O bond lengths are 1.45 Å. Ni2+ is bonded in a distorted linear geometry to two equivalent O2- atoms. Both Ni–O bond lengths are 1.56 Å. O2- is bonded in a 2-coordinate geometry to one Li1+ and one Ni2+ 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:
- 1293856
- Report Number(s):
- mp-763752
- Country of Publication:
- United States
- Language:
- English
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