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Title: Materials Data on Sr2TaCoO6 by Materials Project

Abstract

Sr2TaCoO6 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 TaO6 octahedra, and faces with four equivalent CoO6 octahedra. All Sr–O bond lengths are 2.82 Å. Ta5+ is bonded to six equivalent O2- atoms to form TaO6 octahedra that share corners with six equivalent CoO6 octahedra and faces with eight equivalent SrO12 cuboctahedra. The corner-sharing octahedral tilt angles are 0°. All Ta–O bond lengths are 1.99 Å. Co3+ is bonded to six equivalent O2- atoms to form CoO6 octahedra that share corners with six equivalent TaO6 octahedra and faces with eight equivalent SrO12 cuboctahedra. The corner-sharing octahedral tilt angles are 0°. All Co–O bond lengths are 2.00 Å. O2- is bonded in a distorted linear geometry to four equivalent Sr2+, one Ta5+, and one Co3+ atom.

Publication Date:
Other Number(s):
mp-1208733
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; Sr2TaCoO6; Co-O-Sr-Ta
OSTI Identifier:
1751111
DOI:
https://doi.org/10.17188/1751111

Citation Formats

The Materials Project. Materials Data on Sr2TaCoO6 by Materials Project. United States: N. p., 2020. Web. doi:10.17188/1751111.
The Materials Project. Materials Data on Sr2TaCoO6 by Materials Project. United States. doi:https://doi.org/10.17188/1751111
The Materials Project. 2020. "Materials Data on Sr2TaCoO6 by Materials Project". United States. doi:https://doi.org/10.17188/1751111. https://www.osti.gov/servlets/purl/1751111. Pub date:Sun May 03 00:00:00 EDT 2020
@article{osti_1751111,
title = {Materials Data on Sr2TaCoO6 by Materials Project},
author = {The Materials Project},
abstractNote = {Sr2TaCoO6 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 TaO6 octahedra, and faces with four equivalent CoO6 octahedra. All Sr–O bond lengths are 2.82 Å. Ta5+ is bonded to six equivalent O2- atoms to form TaO6 octahedra that share corners with six equivalent CoO6 octahedra and faces with eight equivalent SrO12 cuboctahedra. The corner-sharing octahedral tilt angles are 0°. All Ta–O bond lengths are 1.99 Å. Co3+ is bonded to six equivalent O2- atoms to form CoO6 octahedra that share corners with six equivalent TaO6 octahedra and faces with eight equivalent SrO12 cuboctahedra. The corner-sharing octahedral tilt angles are 0°. All Co–O bond lengths are 2.00 Å. O2- is bonded in a distorted linear geometry to four equivalent Sr2+, one Ta5+, and one Co3+ atom.},
doi = {10.17188/1751111},
journal = {},
number = ,
volume = ,
place = {United States},
year = {2020},
month = {5}
}