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Title: Materials Data on CeSb2Au by Materials Project

Abstract

CeAuSb2 crystallizes in the tetragonal P4/nmm space group. The structure is three-dimensional. Ce3+ is bonded in a 8-coordinate geometry to eight Sb3- atoms. There are four shorter (3.24 Å) and four longer (3.33 Å) Ce–Sb bond lengths. Au3+ is bonded to four equivalent Sb3- atoms to form a mixture of corner and edge-sharing AuSb4 tetrahedra. All Au–Sb bond lengths are 2.90 Å. There are two inequivalent Sb3- sites. In the first Sb3- site, Sb3- is bonded in a 8-coordinate geometry to four equivalent Ce3+ and four equivalent Sb3- atoms. All Sb–Sb bond lengths are 3.16 Å. In the second Sb3- site, Sb3- is bonded in a 8-coordinate geometry to four equivalent Ce3+ and four equivalent Au3+ atoms.

Publication Date:
Other Number(s):
mp-1079698
DOE Contract Number:  
AC02-05CH11231
Research Org.:
LBNL Materials Project; Lawrence Berkeley National Laboratory (LBNL), Berkeley, CA (United States)
Sponsoring Org.:
USDOE Office of Science (SC), Basic Energy Sciences (BES) (SC-22)
Collaborations:
The Materials Project; MIT; UC Berkeley; Duke; U Louvain
Subject:
36 MATERIALS SCIENCE; Au-Ce-Sb; CeSb2Au; crystal structure
OSTI Identifier:
1711126
DOI:
https://doi.org/10.17188/1711126

Citation Formats

Materials Data on CeSb2Au by Materials Project. United States: N. p., 2020. Web. doi:10.17188/1711126.
Materials Data on CeSb2Au by Materials Project. United States. doi:https://doi.org/10.17188/1711126
2020. "Materials Data on CeSb2Au by Materials Project". United States. doi:https://doi.org/10.17188/1711126. https://www.osti.gov/servlets/purl/1711126. Pub date:Sun May 03 04:00:00 UTC 2020
@article{osti_1711126,
title = {Materials Data on CeSb2Au by Materials Project},
abstractNote = {CeAuSb2 crystallizes in the tetragonal P4/nmm space group. The structure is three-dimensional. Ce3+ is bonded in a 8-coordinate geometry to eight Sb3- atoms. There are four shorter (3.24 Å) and four longer (3.33 Å) Ce–Sb bond lengths. Au3+ is bonded to four equivalent Sb3- atoms to form a mixture of corner and edge-sharing AuSb4 tetrahedra. All Au–Sb bond lengths are 2.90 Å. There are two inequivalent Sb3- sites. In the first Sb3- site, Sb3- is bonded in a 8-coordinate geometry to four equivalent Ce3+ and four equivalent Sb3- atoms. All Sb–Sb bond lengths are 3.16 Å. In the second Sb3- site, Sb3- is bonded in a 8-coordinate geometry to four equivalent Ce3+ and four equivalent Au3+ atoms.},
doi = {10.17188/1711126},
journal = {},
number = ,
volume = ,
place = {United States},
year = {2020},
month = {5}
}