U.S. Department of EnergyOffice of Scientific and Technical Information
Materials Data on PbS by Materials Project
Abstract
PbS crystallizes in the monoclinic P2_1/m space group. The structure is three-dimensional. there are two inequivalent Pb2+ sites. In the first Pb2+ site, Pb2+ is bonded in a rectangular see-saw-like geometry to four S2- atoms. There are a spread of Pb–S bond distances ranging from 2.73–3.08 Å. In the second Pb2+ site, Pb2+ is bonded to six S2- atoms to form a mixture of distorted edge and corner-sharing PbS6 octahedra. The corner-sharing octahedral tilt angles are 11°. There are a spread of Pb–S bond distances ranging from 2.76–3.48 Å. There are two inequivalent S2- sites. In the first S2- site, S2- is bonded to five Pb2+ atoms to form a mixture of edge and corner-sharing SPb5 trigonal bipyramids. In the second S2- site, S2- is bonded in a 5-coordinate geometry to five Pb2+ atoms.
- Authors:
- Publication Date:
- Other Number(s):
- mp-1087486
- 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:
- 1685943
- DOI:
- https://doi.org/10.17188/1685943
Citation Formats
The Materials Project. Materials Data on PbS by Materials Project. United States: N. p., 2020.
Web. doi:10.17188/1685943.
The Materials Project. Materials Data on PbS by Materials Project. United States. doi:https://doi.org/10.17188/1685943
The Materials Project. 2020.
"Materials Data on PbS by Materials Project". United States. doi:https://doi.org/10.17188/1685943. https://www.osti.gov/servlets/purl/1685943. Pub date:Sun May 03 00:00:00 EDT 2020
@article{osti_1685943,
title = {Materials Data on PbS by Materials Project},
author = {The Materials Project},
abstractNote = {PbS crystallizes in the monoclinic P2_1/m space group. The structure is three-dimensional. there are two inequivalent Pb2+ sites. In the first Pb2+ site, Pb2+ is bonded in a rectangular see-saw-like geometry to four S2- atoms. There are a spread of Pb–S bond distances ranging from 2.73–3.08 Å. In the second Pb2+ site, Pb2+ is bonded to six S2- atoms to form a mixture of distorted edge and corner-sharing PbS6 octahedra. The corner-sharing octahedral tilt angles are 11°. There are a spread of Pb–S bond distances ranging from 2.76–3.48 Å. There are two inequivalent S2- sites. In the first S2- site, S2- is bonded to five Pb2+ atoms to form a mixture of edge and corner-sharing SPb5 trigonal bipyramids. In the second S2- site, S2- is bonded in a 5-coordinate geometry to five Pb2+ atoms.},
doi = {10.17188/1685943},
journal = {},
number = ,
volume = ,
place = {United States},
year = {2020},
month = {5}
}
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