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Title: Materials Data on Li4FeNi3O8 by Materials Project

Abstract

LiFeO2(LiNiO2)3 crystallizes in the triclinic P-1 space group. The structure is one-dimensional and consists of one LiFeO2 ribbon oriented in the (0, 1, 1) direction and three LiNiO2 ribbons oriented in the (0, 1, 1) direction. In the LiFeO2 ribbon, Li1+ is bonded in a linear geometry to two equivalent O2- atoms. Both Li–O bond lengths are 1.49 Å. Fe3+ is bonded in a distorted linear geometry to two equivalent O2- atoms. Both Fe–O bond lengths are 1.47 Å. O2- is bonded in a distorted linear geometry to one Li1+ and one Fe3+ atom. In each LiNiO2 ribbon, Li1+ is bonded in a linear geometry to two equivalent O2- atoms. Both Li–O bond lengths are 1.58 Å. Ni3+ is bonded in a linear geometry to two equivalent O2- atoms. Both Ni–O bond lengths are 1.43 Å. O2- is bonded in a distorted bent 150 degrees geometry to one Li1+ and one Ni3+ atom.

Publication Date:
Other Number(s):
mp-765712
DOE Contract Number:  
AC02-05CH11231; EDCBEE
Product Type:
Dataset
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)
Subject:
36 MATERIALS SCIENCE
Keywords:
crystal structure; Li4FeNi3O8; Fe-Li-Ni-O
OSTI Identifier:
1296223
DOI:
10.17188/1296223

Citation Formats

The Materials Project. Materials Data on Li4FeNi3O8 by Materials Project. United States: N. p., 2020. Web. doi:10.17188/1296223.
The Materials Project. Materials Data on Li4FeNi3O8 by Materials Project. United States. doi:10.17188/1296223.
The Materials Project. 2020. "Materials Data on Li4FeNi3O8 by Materials Project". United States. doi:10.17188/1296223. https://www.osti.gov/servlets/purl/1296223. Pub date:Fri Jun 05 00:00:00 EDT 2020
@article{osti_1296223,
title = {Materials Data on Li4FeNi3O8 by Materials Project},
author = {The Materials Project},
abstractNote = {LiFeO2(LiNiO2)3 crystallizes in the triclinic P-1 space group. The structure is one-dimensional and consists of one LiFeO2 ribbon oriented in the (0, 1, 1) direction and three LiNiO2 ribbons oriented in the (0, 1, 1) direction. In the LiFeO2 ribbon, Li1+ is bonded in a linear geometry to two equivalent O2- atoms. Both Li–O bond lengths are 1.49 Å. Fe3+ is bonded in a distorted linear geometry to two equivalent O2- atoms. Both Fe–O bond lengths are 1.47 Å. O2- is bonded in a distorted linear geometry to one Li1+ and one Fe3+ atom. In each LiNiO2 ribbon, Li1+ is bonded in a linear geometry to two equivalent O2- atoms. Both Li–O bond lengths are 1.58 Å. Ni3+ is bonded in a linear geometry to two equivalent O2- atoms. Both Ni–O bond lengths are 1.43 Å. O2- is bonded in a distorted bent 150 degrees geometry to one Li1+ and one Ni3+ atom.},
doi = {10.17188/1296223},
journal = {},
number = ,
volume = ,
place = {United States},
year = {2020},
month = {6}
}

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