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Title: Materials Data on LaOF by Materials Project

Abstract

LaOF crystallizes in the trigonal R-3m space group. The structure is three-dimensional. La3+ is bonded in a body-centered cubic geometry to four equivalent O2- and four equivalent F1- atoms. There are one shorter (2.40 Å) and three longer (2.43 Å) La–O bond lengths. There are three shorter (2.59 Å) and one longer (2.65 Å) La–F bond lengths. O2- is bonded to four equivalent La3+ atoms to form OLa4 tetrahedra that share corners with six equivalent OLa4 tetrahedra, corners with ten equivalent FLa4 tetrahedra, edges with three equivalent OLa4 tetrahedra, and edges with three equivalent FLa4 tetrahedra. F1- is bonded to four equivalent La3+ atoms to form distorted FLa4 tetrahedra that share corners with six equivalent FLa4 tetrahedra, corners with ten equivalent OLa4 tetrahedra, edges with three equivalent OLa4 tetrahedra, and edges with three equivalent FLa4 tetrahedra.

Authors:
Publication Date:
Other Number(s):
mp-8111
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; LaOF; F-La-O
OSTI Identifier:
1282211
DOI:
https://doi.org/10.17188/1282211

Citation Formats

The Materials Project. Materials Data on LaOF by Materials Project. United States: N. p., 2020. Web. doi:10.17188/1282211.
The Materials Project. Materials Data on LaOF by Materials Project. United States. doi:https://doi.org/10.17188/1282211
The Materials Project. 2020. "Materials Data on LaOF by Materials Project". United States. doi:https://doi.org/10.17188/1282211. https://www.osti.gov/servlets/purl/1282211. Pub date:Wed Jul 15 00:00:00 EDT 2020
@article{osti_1282211,
title = {Materials Data on LaOF by Materials Project},
author = {The Materials Project},
abstractNote = {LaOF crystallizes in the trigonal R-3m space group. The structure is three-dimensional. La3+ is bonded in a body-centered cubic geometry to four equivalent O2- and four equivalent F1- atoms. There are one shorter (2.40 Å) and three longer (2.43 Å) La–O bond lengths. There are three shorter (2.59 Å) and one longer (2.65 Å) La–F bond lengths. O2- is bonded to four equivalent La3+ atoms to form OLa4 tetrahedra that share corners with six equivalent OLa4 tetrahedra, corners with ten equivalent FLa4 tetrahedra, edges with three equivalent OLa4 tetrahedra, and edges with three equivalent FLa4 tetrahedra. F1- is bonded to four equivalent La3+ atoms to form distorted FLa4 tetrahedra that share corners with six equivalent FLa4 tetrahedra, corners with ten equivalent OLa4 tetrahedra, edges with three equivalent OLa4 tetrahedra, and edges with three equivalent FLa4 tetrahedra.},
doi = {10.17188/1282211},
journal = {},
number = ,
volume = ,
place = {United States},
year = {Wed Jul 15 00:00:00 EDT 2020},
month = {Wed Jul 15 00:00:00 EDT 2020}
}