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Title: Materials Data on LiCr(CO3)2 by Materials Project

Abstract

LiCr(CO3)2 is Calcite-derived structured and crystallizes in the trigonal R-3 space group. The structure is three-dimensional. Li1+ is bonded to six equivalent O2- atoms to form LiO6 octahedra that share corners with six equivalent CrO6 octahedra. The corner-sharing octahedral tilt angles are 59°. All Li–O bond lengths are 2.21 Å. Cr3+ is bonded to six equivalent O2- atoms to form CrO6 octahedra that share corners with six equivalent LiO6 octahedra. The corner-sharing octahedral tilt angles are 59°. All Cr–O bond lengths are 2.03 Å. C4+ is bonded in a trigonal planar geometry to three equivalent O2- atoms. All C–O bond lengths are 1.29 Å. O2- is bonded in a trigonal planar geometry to one Li1+, one Cr3+, and one C4+ atom.

Publication Date:
Other Number(s):
mp-770839
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; LiCr(CO3)2; C-Cr-Li-O
OSTI Identifier:
1300118
DOI:
10.17188/1300118

Citation Formats

The Materials Project. Materials Data on LiCr(CO3)2 by Materials Project. United States: N. p., 2020. Web. doi:10.17188/1300118.
The Materials Project. Materials Data on LiCr(CO3)2 by Materials Project. United States. doi:10.17188/1300118.
The Materials Project. 2020. "Materials Data on LiCr(CO3)2 by Materials Project". United States. doi:10.17188/1300118. https://www.osti.gov/servlets/purl/1300118. Pub date:Sat May 09 00:00:00 EDT 2020
@article{osti_1300118,
title = {Materials Data on LiCr(CO3)2 by Materials Project},
author = {The Materials Project},
abstractNote = {LiCr(CO3)2 is Calcite-derived structured and crystallizes in the trigonal R-3 space group. The structure is three-dimensional. Li1+ is bonded to six equivalent O2- atoms to form LiO6 octahedra that share corners with six equivalent CrO6 octahedra. The corner-sharing octahedral tilt angles are 59°. All Li–O bond lengths are 2.21 Å. Cr3+ is bonded to six equivalent O2- atoms to form CrO6 octahedra that share corners with six equivalent LiO6 octahedra. The corner-sharing octahedral tilt angles are 59°. All Cr–O bond lengths are 2.03 Å. C4+ is bonded in a trigonal planar geometry to three equivalent O2- atoms. All C–O bond lengths are 1.29 Å. O2- is bonded in a trigonal planar geometry to one Li1+, one Cr3+, and one C4+ atom.},
doi = {10.17188/1300118},
journal = {},
number = ,
volume = ,
place = {United States},
year = {2020},
month = {5}
}

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