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Title: Materials Data on Sr2O3 by Materials Project

Abstract

Sr2O3 is (Cubic) Perovskite-derived structured and crystallizes in the cubic Pm-3m space group. The structure is three-dimensional. there are two inequivalent Sr sites. In the first Sr site, Sr is bonded to twelve equivalent O atoms to form SrO12 cuboctahedra that share corners with twelve equivalent SrO12 cuboctahedra, faces with six equivalent SrO12 cuboctahedra, and faces with eight equivalent SrO6 octahedra. All Sr–O bond lengths are 3.24 Å. In the second Sr site, Sr is bonded to six equivalent O atoms to form SrO6 octahedra that share corners with six equivalent SrO6 octahedra and faces with eight equivalent SrO12 cuboctahedra. The corner-sharing octahedral tilt angles are 0°. All Sr–O bond lengths are 2.29 Å. O is bonded in a linear geometry to six Sr atoms.

Authors:
Publication Date:
Other Number(s):
mp-1187089
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; Sr2O3; O-Sr
OSTI Identifier:
1666693
DOI:
https://doi.org/10.17188/1666693

Citation Formats

The Materials Project. Materials Data on Sr2O3 by Materials Project. United States: N. p., 2020. Web. doi:10.17188/1666693.
The Materials Project. Materials Data on Sr2O3 by Materials Project. United States. doi:https://doi.org/10.17188/1666693
The Materials Project. 2020. "Materials Data on Sr2O3 by Materials Project". United States. doi:https://doi.org/10.17188/1666693. https://www.osti.gov/servlets/purl/1666693. Pub date:Sat Jul 18 00:00:00 EDT 2020
@article{osti_1666693,
title = {Materials Data on Sr2O3 by Materials Project},
author = {The Materials Project},
abstractNote = {Sr2O3 is (Cubic) Perovskite-derived structured and crystallizes in the cubic Pm-3m space group. The structure is three-dimensional. there are two inequivalent Sr sites. In the first Sr site, Sr is bonded to twelve equivalent O atoms to form SrO12 cuboctahedra that share corners with twelve equivalent SrO12 cuboctahedra, faces with six equivalent SrO12 cuboctahedra, and faces with eight equivalent SrO6 octahedra. All Sr–O bond lengths are 3.24 Å. In the second Sr site, Sr is bonded to six equivalent O atoms to form SrO6 octahedra that share corners with six equivalent SrO6 octahedra and faces with eight equivalent SrO12 cuboctahedra. The corner-sharing octahedral tilt angles are 0°. All Sr–O bond lengths are 2.29 Å. O is bonded in a linear geometry to six Sr atoms.},
doi = {10.17188/1666693},
journal = {},
number = ,
volume = ,
place = {United States},
year = {2020},
month = {7}
}