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Title: Materials Data on PbBrCl by Materials Project

Abstract

PbClBr is Matlockite structured and crystallizes in the tetragonal P4/nmm space group. The structure is three-dimensional. Pb2+ is bonded in a 9-coordinate geometry to five equivalent Br1- and four equivalent Cl1- atoms. There are one shorter (3.18 Å) and four longer (3.48 Å) Pb–Br bond lengths. All Pb–Cl bond lengths are 2.99 Å. Br1- is bonded in a 1-coordinate geometry to five equivalent Pb2+ atoms. Cl1- is bonded to four equivalent Pb2+ atoms to form a mixture of edge and corner-sharing ClPb4 tetrahedra.

Publication Date:
Other Number(s):
mp-995147
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; PbBrCl; Br-Cl-Pb
OSTI Identifier:
1317011
DOI:
https://doi.org/10.17188/1317011

Citation Formats

The Materials Project. Materials Data on PbBrCl by Materials Project. United States: N. p., 2020. Web. doi:10.17188/1317011.
The Materials Project. Materials Data on PbBrCl by Materials Project. United States. doi:https://doi.org/10.17188/1317011
The Materials Project. 2020. "Materials Data on PbBrCl by Materials Project". United States. doi:https://doi.org/10.17188/1317011. https://www.osti.gov/servlets/purl/1317011. Pub date:Thu Jul 23 00:00:00 EDT 2020
@article{osti_1317011,
title = {Materials Data on PbBrCl by Materials Project},
author = {The Materials Project},
abstractNote = {PbClBr is Matlockite structured and crystallizes in the tetragonal P4/nmm space group. The structure is three-dimensional. Pb2+ is bonded in a 9-coordinate geometry to five equivalent Br1- and four equivalent Cl1- atoms. There are one shorter (3.18 Å) and four longer (3.48 Å) Pb–Br bond lengths. All Pb–Cl bond lengths are 2.99 Å. Br1- is bonded in a 1-coordinate geometry to five equivalent Pb2+ atoms. Cl1- is bonded to four equivalent Pb2+ atoms to form a mixture of edge and corner-sharing ClPb4 tetrahedra.},
doi = {10.17188/1317011},
journal = {},
number = ,
volume = ,
place = {United States},
year = {2020},
month = {7}
}