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Title: Materials Data on Sr2InSbO6 by Materials Project

Abstract

Sr2InSbO6 is Orthorhombic Perovskite-derived structured and crystallizes in the monoclinic P2_1/c space group. The structure is three-dimensional. Sr2+ is bonded in a 8-coordinate geometry to eight O2- atoms. There are a spread of Sr–O bond distances ranging from 2.53–2.90 Å. In3+ is bonded to six O2- atoms to form InO6 octahedra that share corners with six equivalent SbO6 octahedra. The corner-sharing octahedra tilt angles range from 24–25°. There are four shorter (2.19 Å) and two longer (2.20 Å) In–O bond lengths. Sb5+ is bonded to six O2- atoms to form SbO6 octahedra that share corners with six equivalent InO6 octahedra. The corner-sharing octahedra tilt angles range from 24–25°. All Sb–O bond lengths are 2.02 Å. There are three inequivalent O2- sites. In the first O2- site, O2- is bonded in a 5-coordinate geometry to three equivalent Sr2+, one In3+, and one Sb5+ atom. In the second O2- site, O2- is bonded in a 5-coordinate geometry to three equivalent Sr2+, one In3+, and one Sb5+ atom. In the third O2- site, O2- is bonded in a 4-coordinate geometry to two equivalent Sr2+, one In3+, and one Sb5+ atom.

Authors:
Publication Date:
Other Number(s):
mp-22355
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; Sr2InSbO6; In-O-Sb-Sr
OSTI Identifier:
1197582
DOI:
https://doi.org/10.17188/1197582

Citation Formats

The Materials Project. Materials Data on Sr2InSbO6 by Materials Project. United States: N. p., 2020. Web. doi:10.17188/1197582.
The Materials Project. Materials Data on Sr2InSbO6 by Materials Project. United States. doi:https://doi.org/10.17188/1197582
The Materials Project. 2020. "Materials Data on Sr2InSbO6 by Materials Project". United States. doi:https://doi.org/10.17188/1197582. https://www.osti.gov/servlets/purl/1197582. Pub date:Wed Jul 15 00:00:00 EDT 2020
@article{osti_1197582,
title = {Materials Data on Sr2InSbO6 by Materials Project},
author = {The Materials Project},
abstractNote = {Sr2InSbO6 is Orthorhombic Perovskite-derived structured and crystallizes in the monoclinic P2_1/c space group. The structure is three-dimensional. Sr2+ is bonded in a 8-coordinate geometry to eight O2- atoms. There are a spread of Sr–O bond distances ranging from 2.53–2.90 Å. In3+ is bonded to six O2- atoms to form InO6 octahedra that share corners with six equivalent SbO6 octahedra. The corner-sharing octahedra tilt angles range from 24–25°. There are four shorter (2.19 Å) and two longer (2.20 Å) In–O bond lengths. Sb5+ is bonded to six O2- atoms to form SbO6 octahedra that share corners with six equivalent InO6 octahedra. The corner-sharing octahedra tilt angles range from 24–25°. All Sb–O bond lengths are 2.02 Å. There are three inequivalent O2- sites. In the first O2- site, O2- is bonded in a 5-coordinate geometry to three equivalent Sr2+, one In3+, and one Sb5+ atom. In the second O2- site, O2- is bonded in a 5-coordinate geometry to three equivalent Sr2+, one In3+, and one Sb5+ atom. In the third O2- site, O2- is bonded in a 4-coordinate geometry to two equivalent Sr2+, one In3+, and one Sb5+ atom.},
doi = {10.17188/1197582},
journal = {},
number = ,
volume = ,
place = {United States},
year = {2020},
month = {7}
}