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Title: Materials Data on ScPb3 by Materials Project

Abstract

ScPb3 crystallizes in the tetragonal I4/mmm space group. The structure is three-dimensional. Sc is bonded to twelve Pb atoms to form a mixture of face, edge, and corner-sharing ScPb12 cuboctahedra. There are four shorter (3.21 Å) and eight longer (3.57 Å) Sc–Pb bond lengths. There are two inequivalent Pb sites. In the first Pb site, Pb is bonded in a 12-coordinate geometry to four equivalent Sc and four equivalent Pb atoms. All Pb–Pb bond lengths are 3.21 Å. In the second Pb site, Pb is bonded in a square co-planar geometry to four equivalent Sc atoms.

Authors:
Publication Date:
Other Number(s):
mp-1186990
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; ScPb3; Pb-Sc
OSTI Identifier:
1667272
DOI:
https://doi.org/10.17188/1667272

Citation Formats

The Materials Project. Materials Data on ScPb3 by Materials Project. United States: N. p., 2020. Web. doi:10.17188/1667272.
The Materials Project. Materials Data on ScPb3 by Materials Project. United States. doi:https://doi.org/10.17188/1667272
The Materials Project. 2020. "Materials Data on ScPb3 by Materials Project". United States. doi:https://doi.org/10.17188/1667272. https://www.osti.gov/servlets/purl/1667272. Pub date:Thu Jul 23 00:00:00 EDT 2020
@article{osti_1667272,
title = {Materials Data on ScPb3 by Materials Project},
author = {The Materials Project},
abstractNote = {ScPb3 crystallizes in the tetragonal I4/mmm space group. The structure is three-dimensional. Sc is bonded to twelve Pb atoms to form a mixture of face, edge, and corner-sharing ScPb12 cuboctahedra. There are four shorter (3.21 Å) and eight longer (3.57 Å) Sc–Pb bond lengths. There are two inequivalent Pb sites. In the first Pb site, Pb is bonded in a 12-coordinate geometry to four equivalent Sc and four equivalent Pb atoms. All Pb–Pb bond lengths are 3.21 Å. In the second Pb site, Pb is bonded in a square co-planar geometry to four equivalent Sc atoms.},
doi = {10.17188/1667272},
journal = {},
number = ,
volume = ,
place = {United States},
year = {2020},
month = {7}
}