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Title: Materials Data on PrSbO4 by Materials Project

Abstract

PrSbO4 crystallizes in the monoclinic P2/c space group. The structure is three-dimensional. Pr3+ is bonded in a 8-coordinate geometry to eight O2- atoms. There are a spread of Pr–O bond distances ranging from 2.36–2.69 Å. Sb5+ is bonded in a 4-coordinate geometry to four O2- atoms. There are a spread of Sb–O bond distances ranging from 1.98–2.42 Å. There are four inequivalent O2- sites. In the first O2- site, O2- is bonded in a 4-coordinate geometry to two equivalent Pr3+, one Sb5+, and one O2- atom. The O–O bond length is 1.51 Å. In the second O2- site, O2- is bonded in a 3-coordinate geometry to two equivalent Pr3+ and one O2- atom. In the third O2- site, O2- is bonded in a 4-coordinate geometry to two equivalent Pr3+ and two equivalent Sb5+ atoms. In the fourth O2- site, O2- is bonded in a distorted trigonal non-coplanar geometry to two equivalent Pr3+ and one Sb5+ atom.

Publication Date:
Other Number(s):
mp-554878
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; PrSbO4; O-Pr-Sb
OSTI Identifier:
1268211
DOI:
10.17188/1268211

Citation Formats

The Materials Project. Materials Data on PrSbO4 by Materials Project. United States: N. p., 2020. Web. doi:10.17188/1268211.
The Materials Project. Materials Data on PrSbO4 by Materials Project. United States. doi:10.17188/1268211.
The Materials Project. 2020. "Materials Data on PrSbO4 by Materials Project". United States. doi:10.17188/1268211. https://www.osti.gov/servlets/purl/1268211. Pub date:Sat May 02 00:00:00 EDT 2020
@article{osti_1268211,
title = {Materials Data on PrSbO4 by Materials Project},
author = {The Materials Project},
abstractNote = {PrSbO4 crystallizes in the monoclinic P2/c space group. The structure is three-dimensional. Pr3+ is bonded in a 8-coordinate geometry to eight O2- atoms. There are a spread of Pr–O bond distances ranging from 2.36–2.69 Å. Sb5+ is bonded in a 4-coordinate geometry to four O2- atoms. There are a spread of Sb–O bond distances ranging from 1.98–2.42 Å. There are four inequivalent O2- sites. In the first O2- site, O2- is bonded in a 4-coordinate geometry to two equivalent Pr3+, one Sb5+, and one O2- atom. The O–O bond length is 1.51 Å. In the second O2- site, O2- is bonded in a 3-coordinate geometry to two equivalent Pr3+ and one O2- atom. In the third O2- site, O2- is bonded in a 4-coordinate geometry to two equivalent Pr3+ and two equivalent Sb5+ atoms. In the fourth O2- site, O2- is bonded in a distorted trigonal non-coplanar geometry to two equivalent Pr3+ and one Sb5+ atom.},
doi = {10.17188/1268211},
journal = {},
number = ,
volume = ,
place = {United States},
year = {2020},
month = {5}
}

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