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Title: Materials Data on PrCuSb2 by Materials Project

Abstract

PrCuSb2 crystallizes in the tetragonal P4/nmm space group. The structure is three-dimensional. Pr3+ is bonded in a 8-coordinate geometry to eight Sb2- atoms. There are four shorter (3.26 Å) and four longer (3.37 Å) Pr–Sb bond lengths. Cu1+ is bonded to four equivalent Sb2- atoms to form a mixture of edge and corner-sharing CuSb4 tetrahedra. All Cu–Sb bond lengths are 2.69 Å. There are two inequivalent Sb2- sites. In the first Sb2- site, Sb2- is bonded in a 8-coordinate geometry to four equivalent Pr3+ and four equivalent Sb2- atoms. All Sb–Sb bond lengths are 3.10 Å. In the second Sb2- site, Sb2- is bonded in a 8-coordinate geometry to four equivalent Pr3+ and four equivalent Cu1+ atoms.

Authors:
Publication Date:
Other Number(s):
mp-19848
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; PrCuSb2; Cu-Pr-Sb
OSTI Identifier:
1195041
DOI:
https://doi.org/10.17188/1195041

Citation Formats

The Materials Project. Materials Data on PrCuSb2 by Materials Project. United States: N. p., 2020. Web. doi:10.17188/1195041.
The Materials Project. Materials Data on PrCuSb2 by Materials Project. United States. doi:https://doi.org/10.17188/1195041
The Materials Project. 2020. "Materials Data on PrCuSb2 by Materials Project". United States. doi:https://doi.org/10.17188/1195041. https://www.osti.gov/servlets/purl/1195041. Pub date:Thu Jul 16 00:00:00 EDT 2020
@article{osti_1195041,
title = {Materials Data on PrCuSb2 by Materials Project},
author = {The Materials Project},
abstractNote = {PrCuSb2 crystallizes in the tetragonal P4/nmm space group. The structure is three-dimensional. Pr3+ is bonded in a 8-coordinate geometry to eight Sb2- atoms. There are four shorter (3.26 Å) and four longer (3.37 Å) Pr–Sb bond lengths. Cu1+ is bonded to four equivalent Sb2- atoms to form a mixture of edge and corner-sharing CuSb4 tetrahedra. All Cu–Sb bond lengths are 2.69 Å. There are two inequivalent Sb2- sites. In the first Sb2- site, Sb2- is bonded in a 8-coordinate geometry to four equivalent Pr3+ and four equivalent Sb2- atoms. All Sb–Sb bond lengths are 3.10 Å. In the second Sb2- site, Sb2- is bonded in a 8-coordinate geometry to four equivalent Pr3+ and four equivalent Cu1+ atoms.},
doi = {10.17188/1195041},
journal = {},
number = ,
volume = ,
place = {United States},
year = {2020},
month = {7}
}