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Title: Materials Data on PbS by Materials Project

Abstract

PbS crystallizes in the orthorhombic Cmc2_1 space group. The structure is two-dimensional and consists of two PbS sheets oriented in the (0, 0, 1) direction. there are two inequivalent Pb2+ sites. In the first Pb2+ site, Pb2+ is bonded to five S2- atoms to form a mixture of distorted corner and edge-sharing PbS5 square pyramids. There are a spread of Pb–S bond distances ranging from 2.69–3.06 Å. In the second Pb2+ site, Pb2+ is bonded to five S2- atoms to form a mixture of distorted corner and edge-sharing PbS5 square pyramids. There are a spread of Pb–S bond distances ranging from 2.69–3.01 Å. There are two inequivalent S2- sites. In the first S2- site, S2- is bonded in a single-bond geometry to five Pb2+ atoms. In the second S2- site, S2- is bonded in a single-bond geometry to five Pb2+ atoms.

Authors:
Publication Date:
Other Number(s):
mp-557719
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; PbS; Pb-S
OSTI Identifier:
1269971
DOI:
https://doi.org/10.17188/1269971

Citation Formats

The Materials Project. Materials Data on PbS by Materials Project. United States: N. p., 2020. Web. doi:10.17188/1269971.
The Materials Project. Materials Data on PbS by Materials Project. United States. doi:https://doi.org/10.17188/1269971
The Materials Project. 2020. "Materials Data on PbS by Materials Project". United States. doi:https://doi.org/10.17188/1269971. https://www.osti.gov/servlets/purl/1269971. Pub date:Wed Jul 15 00:00:00 EDT 2020
@article{osti_1269971,
title = {Materials Data on PbS by Materials Project},
author = {The Materials Project},
abstractNote = {PbS crystallizes in the orthorhombic Cmc2_1 space group. The structure is two-dimensional and consists of two PbS sheets oriented in the (0, 0, 1) direction. there are two inequivalent Pb2+ sites. In the first Pb2+ site, Pb2+ is bonded to five S2- atoms to form a mixture of distorted corner and edge-sharing PbS5 square pyramids. There are a spread of Pb–S bond distances ranging from 2.69–3.06 Å. In the second Pb2+ site, Pb2+ is bonded to five S2- atoms to form a mixture of distorted corner and edge-sharing PbS5 square pyramids. There are a spread of Pb–S bond distances ranging from 2.69–3.01 Å. There are two inequivalent S2- sites. In the first S2- site, S2- is bonded in a single-bond geometry to five Pb2+ atoms. In the second S2- site, S2- is bonded in a single-bond geometry to five Pb2+ atoms.},
doi = {10.17188/1269971},
journal = {},
number = ,
volume = ,
place = {United States},
year = {2020},
month = {7}
}