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Title: Materials Data on Co21(B3Sb)2 by Materials Project

Abstract

Co(Co10B3Sb)2 crystallizes in the cubic Fm-3m space group. The structure is three-dimensional and consists of four cobalt molecules and one Co10B3Sb framework. In the Co10B3Sb framework, there are two inequivalent Co+1.14+ sites. In the first Co+1.14+ site, Co+1.14+ is bonded to three equivalent B3- and one Sb3- atom to form a mixture of corner and edge-sharing CoB3Sb tetrahedra. All Co–B bond lengths are 2.07 Å. The Co–Sb bond length is 2.44 Å. In the second Co+1.14+ site, Co+1.14+ is bonded in a bent 150 degrees geometry to two equivalent B3- atoms. Both Co–B bond lengths are 2.10 Å. B3- is bonded in a 8-coordinate geometry to eight Co+1.14+ atoms. Sb3- is bonded in a distorted tetrahedral geometry to four equivalent Co+1.14+ atoms.

Authors:
Contributors:
Researcher:
Publication Date:
Other Number(s):
mp-505544
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; Co21(B3Sb)2; B-Co-Sb
OSTI Identifier:
1262581
DOI:
10.17188/1262581

Citation Formats

Persson, Kristin, and Project, Materials. Materials Data on Co21(B3Sb)2 by Materials Project. United States: N. p., 2020. Web. doi:10.17188/1262581.
Persson, Kristin, & Project, Materials. Materials Data on Co21(B3Sb)2 by Materials Project. United States. doi:10.17188/1262581.
Persson, Kristin, and Project, Materials. 2020. "Materials Data on Co21(B3Sb)2 by Materials Project". United States. doi:10.17188/1262581. https://www.osti.gov/servlets/purl/1262581. Pub date:Thu Jul 23 00:00:00 EDT 2020
@article{osti_1262581,
title = {Materials Data on Co21(B3Sb)2 by Materials Project},
author = {Persson, Kristin and Project, Materials},
abstractNote = {Co(Co10B3Sb)2 crystallizes in the cubic Fm-3m space group. The structure is three-dimensional and consists of four cobalt molecules and one Co10B3Sb framework. In the Co10B3Sb framework, there are two inequivalent Co+1.14+ sites. In the first Co+1.14+ site, Co+1.14+ is bonded to three equivalent B3- and one Sb3- atom to form a mixture of corner and edge-sharing CoB3Sb tetrahedra. All Co–B bond lengths are 2.07 Å. The Co–Sb bond length is 2.44 Å. In the second Co+1.14+ site, Co+1.14+ is bonded in a bent 150 degrees geometry to two equivalent B3- atoms. Both Co–B bond lengths are 2.10 Å. B3- is bonded in a 8-coordinate geometry to eight Co+1.14+ atoms. Sb3- is bonded in a distorted tetrahedral geometry to four equivalent Co+1.14+ atoms.},
doi = {10.17188/1262581},
journal = {},
number = ,
volume = ,
place = {United States},
year = {2020},
month = {7}
}

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