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Title: Materials Data on Lu3Sb5O12 by Materials Project

Abstract

Lu3Sb5O12 crystallizes in the cubic I-43m space group. The structure is three-dimensional. Lu3+ is bonded in a 8-coordinate geometry to eight O2- atoms. There are four shorter (2.21 Å) and four longer (2.55 Å) Lu–O bond lengths. There are two inequivalent Sb3+ sites. In the first Sb3+ site, Sb3+ is bonded in a 3-coordinate geometry to three equivalent O2- atoms. All Sb–O bond lengths are 2.04 Å. In the second Sb3+ site, Sb3+ is bonded in a 4-coordinate geometry to four O2- atoms. There are two shorter (1.99 Å) and two longer (2.22 Å) Sb–O bond lengths. There are two inequivalent O2- sites. In the first O2- site, O2- is bonded in a 4-coordinate geometry to two equivalent Lu3+ and two Sb3+ atoms. In the second O2- site, O2- is bonded in a 3-coordinate geometry to two equivalent Lu3+ and one Sb3+ atom.

Authors:
Contributors:
Researcher:
Publication Date:
Other Number(s):
mp-768483
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; Lu3Sb5O12; Lu-O-Sb
OSTI Identifier:
1298433
DOI:
10.17188/1298433

Citation Formats

Persson, Kristin, and Project, Materials. Materials Data on Lu3Sb5O12 by Materials Project. United States: N. p., 2020. Web. doi:10.17188/1298433.
Persson, Kristin, & Project, Materials. Materials Data on Lu3Sb5O12 by Materials Project. United States. doi:10.17188/1298433.
Persson, Kristin, and Project, Materials. 2020. "Materials Data on Lu3Sb5O12 by Materials Project". United States. doi:10.17188/1298433. https://www.osti.gov/servlets/purl/1298433. Pub date:Wed Apr 29 00:00:00 EDT 2020
@article{osti_1298433,
title = {Materials Data on Lu3Sb5O12 by Materials Project},
author = {Persson, Kristin and Project, Materials},
abstractNote = {Lu3Sb5O12 crystallizes in the cubic I-43m space group. The structure is three-dimensional. Lu3+ is bonded in a 8-coordinate geometry to eight O2- atoms. There are four shorter (2.21 Å) and four longer (2.55 Å) Lu–O bond lengths. There are two inequivalent Sb3+ sites. In the first Sb3+ site, Sb3+ is bonded in a 3-coordinate geometry to three equivalent O2- atoms. All Sb–O bond lengths are 2.04 Å. In the second Sb3+ site, Sb3+ is bonded in a 4-coordinate geometry to four O2- atoms. There are two shorter (1.99 Å) and two longer (2.22 Å) Sb–O bond lengths. There are two inequivalent O2- sites. In the first O2- site, O2- is bonded in a 4-coordinate geometry to two equivalent Lu3+ and two Sb3+ atoms. In the second O2- site, O2- is bonded in a 3-coordinate geometry to two equivalent Lu3+ and one Sb3+ atom.},
doi = {10.17188/1298433},
journal = {},
number = ,
volume = ,
place = {United States},
year = {2020},
month = {4}
}

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