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Title: Materials Data on BiPbBrO2 by Materials Project

Abstract

PbBiO2Br crystallizes in the tetragonal I4mm space group. The structure is three-dimensional. Pb2+ is bonded in a 4-coordinate geometry to four equivalent O2- and four equivalent Br1- atoms. All Pb–O bond lengths are 2.43 Å. All Pb–Br bond lengths are 3.52 Å. Bi3+ is bonded in a 4-coordinate geometry to four equivalent O2- and four equivalent Br1- atoms. All Bi–O bond lengths are 2.29 Å. All Bi–Br bond lengths are 3.49 Å. O2- is bonded to two equivalent Pb2+ and two equivalent Bi3+ atoms to form a mixture of edge and corner-sharing OBi2Pb2 tetrahedra. Br1- is bonded in a body-centered cubic geometry to four equivalent Pb2+ and four equivalent Bi3+ atoms.

Publication Date:
Other Number(s):
mp-1227444
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; BiPbBrO2; Bi-Br-O-Pb
OSTI Identifier:
1729410
DOI:
https://doi.org/10.17188/1729410

Citation Formats

The Materials Project. Materials Data on BiPbBrO2 by Materials Project. United States: N. p., 2020. Web. doi:10.17188/1729410.
The Materials Project. Materials Data on BiPbBrO2 by Materials Project. United States. doi:https://doi.org/10.17188/1729410
The Materials Project. 2020. "Materials Data on BiPbBrO2 by Materials Project". United States. doi:https://doi.org/10.17188/1729410. https://www.osti.gov/servlets/purl/1729410. Pub date:Sun May 03 00:00:00 EDT 2020
@article{osti_1729410,
title = {Materials Data on BiPbBrO2 by Materials Project},
author = {The Materials Project},
abstractNote = {PbBiO2Br crystallizes in the tetragonal I4mm space group. The structure is three-dimensional. Pb2+ is bonded in a 4-coordinate geometry to four equivalent O2- and four equivalent Br1- atoms. All Pb–O bond lengths are 2.43 Å. All Pb–Br bond lengths are 3.52 Å. Bi3+ is bonded in a 4-coordinate geometry to four equivalent O2- and four equivalent Br1- atoms. All Bi–O bond lengths are 2.29 Å. All Bi–Br bond lengths are 3.49 Å. O2- is bonded to two equivalent Pb2+ and two equivalent Bi3+ atoms to form a mixture of edge and corner-sharing OBi2Pb2 tetrahedra. Br1- is bonded in a body-centered cubic geometry to four equivalent Pb2+ and four equivalent Bi3+ atoms.},
doi = {10.17188/1729410},
journal = {},
number = ,
volume = ,
place = {United States},
year = {2020},
month = {5}
}