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Title: Materials Data on BiBr3 by Materials Project

Abstract

BiBr3 is Aluminum trichloride structured and crystallizes in the monoclinic C2/m space group. The structure is two-dimensional and consists of one BiBr3 sheet oriented in the (0, 0, 1) direction. Bi3+ is bonded to six Br1- atoms to form edge-sharing BiBr6 octahedra. There are four shorter (2.90 Å) and two longer (2.91 Å) Bi–Br bond lengths. There are two inequivalent Br1- sites. In the first Br1- site, Br1- is bonded in an L-shaped geometry to two equivalent Bi3+ atoms. In the second Br1- site, Br1- is bonded in an L-shaped geometry to two equivalent Bi3+ atoms.

Publication Date:
Other Number(s):
mp-568301
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; BiBr3; Bi-Br
OSTI Identifier:
1274351
DOI:
https://doi.org/10.17188/1274351

Citation Formats

The Materials Project. Materials Data on BiBr3 by Materials Project. United States: N. p., 2020. Web. doi:10.17188/1274351.
The Materials Project. Materials Data on BiBr3 by Materials Project. United States. doi:https://doi.org/10.17188/1274351
The Materials Project. 2020. "Materials Data on BiBr3 by Materials Project". United States. doi:https://doi.org/10.17188/1274351. https://www.osti.gov/servlets/purl/1274351. Pub date:Thu Jul 16 00:00:00 EDT 2020
@article{osti_1274351,
title = {Materials Data on BiBr3 by Materials Project},
author = {The Materials Project},
abstractNote = {BiBr3 is Aluminum trichloride structured and crystallizes in the monoclinic C2/m space group. The structure is two-dimensional and consists of one BiBr3 sheet oriented in the (0, 0, 1) direction. Bi3+ is bonded to six Br1- atoms to form edge-sharing BiBr6 octahedra. There are four shorter (2.90 Å) and two longer (2.91 Å) Bi–Br bond lengths. There are two inequivalent Br1- sites. In the first Br1- site, Br1- is bonded in an L-shaped geometry to two equivalent Bi3+ atoms. In the second Br1- site, Br1- is bonded in an L-shaped geometry to two equivalent Bi3+ atoms.},
doi = {10.17188/1274351},
journal = {},
number = ,
volume = ,
place = {United States},
year = {2020},
month = {7}
}