U.S. Department of EnergyOffice of Scientific and Technical Information
Materials Data on LiMnO2 by Materials Project
Abstract
LiMnO2 crystallizes in the orthorhombic Pnnm space group. The structure is three-dimensional. Li1+ is bonded to six equivalent O2- atoms to form LiO6 octahedra that share corners with four equivalent MnO6 octahedra, corners with eight equivalent LiO6 octahedra, edges with two equivalent LiO6 octahedra, edges with four equivalent MnO6 octahedra, and faces with two equivalent MnO6 octahedra. The corner-sharing octahedra tilt angles range from 45–49°. There are two shorter (2.12 Å) and four longer (2.21 Å) Li–O bond lengths. Mn3+ is bonded to six equivalent O2- atoms to form MnO6 octahedra that share corners with four equivalent LiO6 octahedra, corners with eight equivalent MnO6 octahedra, edges with two equivalent MnO6 octahedra, edges with four equivalent LiO6 octahedra, and faces with two equivalent LiO6 octahedra. The corner-sharing octahedra tilt angles range from 45–49°. There are four shorter (1.97 Å) and two longer (2.34 Å) Mn–O bond lengths. O2- is bonded in a 6-coordinate geometry to three equivalent Li1+ and three equivalent Mn3+ atoms.
- Authors:
- Publication Date:
- Other Number(s):
- mp-1002572
- DOE Contract Number:
- AC02-05CH11231; EDCBEE
- Research Org.:
- Lawrence Berkeley National Lab. (LBNL), Berkeley, CA (United States). LBNL Materials Project
- Sponsoring Org.:
- USDOE Office of Science (SC), Basic Energy Sciences (BES)
- Collaborations:
- MIT; UC Berkeley; Duke; U Louvain
- Subject:
- 36 MATERIALS SCIENCE
- Keywords:
- crystal structure; LiMnO2; Li-Mn-O
- OSTI Identifier:
- 1276788
- DOI:
- https://doi.org/10.17188/1276788
Citation Formats
The Materials Project. Materials Data on LiMnO2 by Materials Project. United States: N. p., 2020.
Web. doi:10.17188/1276788.
The Materials Project. Materials Data on LiMnO2 by Materials Project. United States. doi:https://doi.org/10.17188/1276788
The Materials Project. 2020.
"Materials Data on LiMnO2 by Materials Project". United States. doi:https://doi.org/10.17188/1276788. https://www.osti.gov/servlets/purl/1276788. Pub date:Sun May 03 00:00:00 EDT 2020
@article{osti_1276788,
title = {Materials Data on LiMnO2 by Materials Project},
author = {The Materials Project},
abstractNote = {LiMnO2 crystallizes in the orthorhombic Pnnm space group. The structure is three-dimensional. Li1+ is bonded to six equivalent O2- atoms to form LiO6 octahedra that share corners with four equivalent MnO6 octahedra, corners with eight equivalent LiO6 octahedra, edges with two equivalent LiO6 octahedra, edges with four equivalent MnO6 octahedra, and faces with two equivalent MnO6 octahedra. The corner-sharing octahedra tilt angles range from 45–49°. There are two shorter (2.12 Å) and four longer (2.21 Å) Li–O bond lengths. Mn3+ is bonded to six equivalent O2- atoms to form MnO6 octahedra that share corners with four equivalent LiO6 octahedra, corners with eight equivalent MnO6 octahedra, edges with two equivalent MnO6 octahedra, edges with four equivalent LiO6 octahedra, and faces with two equivalent LiO6 octahedra. The corner-sharing octahedra tilt angles range from 45–49°. There are four shorter (1.97 Å) and two longer (2.34 Å) Mn–O bond lengths. O2- is bonded in a 6-coordinate geometry to three equivalent Li1+ and three equivalent Mn3+ atoms.},
doi = {10.17188/1276788},
journal = {},
number = ,
volume = ,
place = {United States},
year = {2020},
month = {5}
}