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Title: Materials Data on Sr2ScOsO6 by Materials Project

Abstract

Sr2ScOsO6 is (Cubic) Perovskite-derived structured and crystallizes in the cubic Fm-3m space group. The structure is three-dimensional. Sr2+ is bonded to twelve equivalent O2- atoms to form SrO12 cuboctahedra that share corners with twelve equivalent SrO12 cuboctahedra, faces with six equivalent SrO12 cuboctahedra, faces with four equivalent ScO6 octahedra, and faces with four equivalent OsO6 octahedra. All Sr–O bond lengths are 2.86 Å. Sc3+ is bonded to six equivalent O2- atoms to form ScO6 octahedra that share corners with six equivalent OsO6 octahedra and faces with eight equivalent SrO12 cuboctahedra. The corner-sharing octahedral tilt angles are 0°. All Sc–O bond lengths are 2.08 Å. Os5+ is bonded to six equivalent O2- atoms to form OsO6 octahedra that share corners with six equivalent ScO6 octahedra and faces with eight equivalent SrO12 cuboctahedra. The corner-sharing octahedral tilt angles are 0°. All Os–O bond lengths are 1.97 Å. O2- is bonded in a distorted linear geometry to four equivalent Sr2+, one Sc3+, and one Os5+ atom.

Authors:
Publication Date:
Other Number(s):
mp-1205575
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; Sr2ScOsO6; O-Os-Sc-Sr
OSTI Identifier:
1746501
DOI:
https://doi.org/10.17188/1746501

Citation Formats

The Materials Project. Materials Data on Sr2ScOsO6 by Materials Project. United States: N. p., 2020. Web. doi:10.17188/1746501.
The Materials Project. Materials Data on Sr2ScOsO6 by Materials Project. United States. doi:https://doi.org/10.17188/1746501
The Materials Project. 2020. "Materials Data on Sr2ScOsO6 by Materials Project". United States. doi:https://doi.org/10.17188/1746501. https://www.osti.gov/servlets/purl/1746501. Pub date:Tue May 05 00:00:00 EDT 2020
@article{osti_1746501,
title = {Materials Data on Sr2ScOsO6 by Materials Project},
author = {The Materials Project},
abstractNote = {Sr2ScOsO6 is (Cubic) Perovskite-derived structured and crystallizes in the cubic Fm-3m space group. The structure is three-dimensional. Sr2+ is bonded to twelve equivalent O2- atoms to form SrO12 cuboctahedra that share corners with twelve equivalent SrO12 cuboctahedra, faces with six equivalent SrO12 cuboctahedra, faces with four equivalent ScO6 octahedra, and faces with four equivalent OsO6 octahedra. All Sr–O bond lengths are 2.86 Å. Sc3+ is bonded to six equivalent O2- atoms to form ScO6 octahedra that share corners with six equivalent OsO6 octahedra and faces with eight equivalent SrO12 cuboctahedra. The corner-sharing octahedral tilt angles are 0°. All Sc–O bond lengths are 2.08 Å. Os5+ is bonded to six equivalent O2- atoms to form OsO6 octahedra that share corners with six equivalent ScO6 octahedra and faces with eight equivalent SrO12 cuboctahedra. The corner-sharing octahedral tilt angles are 0°. All Os–O bond lengths are 1.97 Å. O2- is bonded in a distorted linear geometry to four equivalent Sr2+, one Sc3+, and one Os5+ atom.},
doi = {10.17188/1746501},
journal = {},
number = ,
volume = ,
place = {United States},
year = {2020},
month = {5}
}