DOE Data Explorer title logo U.S. Department of Energy
Office of Scientific and Technical Information

Title: Materials Data on La3AsBr3 by Materials Project

Abstract

La3AsBr3 crystallizes in the cubic I4_132 space group. The structure is three-dimensional. La2+ is bonded to two equivalent As3- and four equivalent Br1- atoms to form a mixture of edge and corner-sharing LaAs2Br4 octahedra. The corner-sharing octahedra tilt angles range from 3–6°. Both La–As bond lengths are 2.94 Å. There are two shorter (3.12 Å) and two longer (3.17 Å) La–Br bond lengths. As3- is bonded to six equivalent La2+ atoms to form edge-sharing AsLa6 octahedra. Br1- is bonded in a rectangular see-saw-like geometry to four equivalent La2+ atoms.

Authors:
Publication Date:
Other Number(s):
mp-1211477
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; La3AsBr3; As-Br-La
OSTI Identifier:
1695248
DOI:
https://doi.org/10.17188/1695248

Citation Formats

The Materials Project. Materials Data on La3AsBr3 by Materials Project. United States: N. p., 2020. Web. doi:10.17188/1695248.
The Materials Project. Materials Data on La3AsBr3 by Materials Project. United States. doi:https://doi.org/10.17188/1695248
The Materials Project. 2020. "Materials Data on La3AsBr3 by Materials Project". United States. doi:https://doi.org/10.17188/1695248. https://www.osti.gov/servlets/purl/1695248. Pub date:Wed Apr 29 00:00:00 EDT 2020
@article{osti_1695248,
title = {Materials Data on La3AsBr3 by Materials Project},
author = {The Materials Project},
abstractNote = {La3AsBr3 crystallizes in the cubic I4_132 space group. The structure is three-dimensional. La2+ is bonded to two equivalent As3- and four equivalent Br1- atoms to form a mixture of edge and corner-sharing LaAs2Br4 octahedra. The corner-sharing octahedra tilt angles range from 3–6°. Both La–As bond lengths are 2.94 Å. There are two shorter (3.12 Å) and two longer (3.17 Å) La–Br bond lengths. As3- is bonded to six equivalent La2+ atoms to form edge-sharing AsLa6 octahedra. Br1- is bonded in a rectangular see-saw-like geometry to four equivalent La2+ atoms.},
doi = {10.17188/1695248},
journal = {},
number = ,
volume = ,
place = {United States},
year = {Wed Apr 29 00:00:00 EDT 2020},
month = {Wed Apr 29 00:00:00 EDT 2020}
}