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Title: Materials Data on PrCoSb2 by Materials Project

Abstract

PrCoSb2 crystallizes in the tetragonal P4/nmm space group. The structure is three-dimensional. Pr3+ is bonded in a 8-coordinate geometry to eight Sb+2.50- atoms. There are four shorter (3.30 Å) and four longer (3.37 Å) Pr–Sb bond lengths. Co2+ is bonded to four equivalent Sb+2.50- atoms to form a mixture of edge and corner-sharing CoSb4 tetrahedra. All Co–Sb bond lengths are 2.54 Å. There are two inequivalent Sb+2.50- sites. In the first Sb+2.50- site, Sb+2.50- is bonded in a 8-coordinate geometry to four equivalent Pr3+ and four equivalent Sb+2.50- atoms. All Sb–Sb bond lengths are 3.10 Å. In the second Sb+2.50- site, Sb+2.50- is bonded in a 8-coordinate geometry to four equivalent Pr3+ and four equivalent Co2+ atoms.

Publication Date:
Other Number(s):
mp-1078839
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; PrCoSb2; Co-Pr-Sb
OSTI Identifier:
1679424
DOI:
https://doi.org/10.17188/1679424

Citation Formats

The Materials Project. Materials Data on PrCoSb2 by Materials Project. United States: N. p., 2020. Web. doi:10.17188/1679424.
The Materials Project. Materials Data on PrCoSb2 by Materials Project. United States. doi:https://doi.org/10.17188/1679424
The Materials Project. 2020. "Materials Data on PrCoSb2 by Materials Project". United States. doi:https://doi.org/10.17188/1679424. https://www.osti.gov/servlets/purl/1679424. Pub date:Sat May 02 00:00:00 EDT 2020
@article{osti_1679424,
title = {Materials Data on PrCoSb2 by Materials Project},
author = {The Materials Project},
abstractNote = {PrCoSb2 crystallizes in the tetragonal P4/nmm space group. The structure is three-dimensional. Pr3+ is bonded in a 8-coordinate geometry to eight Sb+2.50- atoms. There are four shorter (3.30 Å) and four longer (3.37 Å) Pr–Sb bond lengths. Co2+ is bonded to four equivalent Sb+2.50- atoms to form a mixture of edge and corner-sharing CoSb4 tetrahedra. All Co–Sb bond lengths are 2.54 Å. There are two inequivalent Sb+2.50- sites. In the first Sb+2.50- site, Sb+2.50- is bonded in a 8-coordinate geometry to four equivalent Pr3+ and four equivalent Sb+2.50- atoms. All Sb–Sb bond lengths are 3.10 Å. In the second Sb+2.50- site, Sb+2.50- is bonded in a 8-coordinate geometry to four equivalent Pr3+ and four equivalent Co2+ atoms.},
doi = {10.17188/1679424},
journal = {},
number = ,
volume = ,
place = {United States},
year = {2020},
month = {5}
}