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Title: Materials Data on Sr2GdReO6 by Materials Project

Abstract

Sr2GdReO6 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 GdO6 octahedra, and faces with four equivalent ReO6 octahedra. All Sr–O bond lengths are 2.98 Å. Gd3+ is bonded to six equivalent O2- atoms to form GdO6 octahedra that share corners with six equivalent ReO6 octahedra and faces with eight equivalent SrO12 cuboctahedra. The corner-sharing octahedral tilt angles are 0°. All Gd–O bond lengths are 2.24 Å. Re5+ is bonded to six equivalent O2- atoms to form ReO6 octahedra that share corners with six equivalent GdO6 octahedra and faces with eight equivalent SrO12 cuboctahedra. The corner-sharing octahedral tilt angles are 0°. All Re–O bond lengths are 1.97 Å. O2- is bonded in a distorted linear geometry to four equivalent Sr2+, one Gd3+, and one Re5+ atom.

Publication Date:
Other Number(s):
mp-13936
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; Sr2GdReO6; Gd-O-Re-Sr
OSTI Identifier:
1189825
DOI:
https://doi.org/10.17188/1189825

Citation Formats

The Materials Project. Materials Data on Sr2GdReO6 by Materials Project. United States: N. p., 2020. Web. doi:10.17188/1189825.
The Materials Project. Materials Data on Sr2GdReO6 by Materials Project. United States. doi:https://doi.org/10.17188/1189825
The Materials Project. 2020. "Materials Data on Sr2GdReO6 by Materials Project". United States. doi:https://doi.org/10.17188/1189825. https://www.osti.gov/servlets/purl/1189825. Pub date:Thu Jul 16 00:00:00 EDT 2020
@article{osti_1189825,
title = {Materials Data on Sr2GdReO6 by Materials Project},
author = {The Materials Project},
abstractNote = {Sr2GdReO6 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 GdO6 octahedra, and faces with four equivalent ReO6 octahedra. All Sr–O bond lengths are 2.98 Å. Gd3+ is bonded to six equivalent O2- atoms to form GdO6 octahedra that share corners with six equivalent ReO6 octahedra and faces with eight equivalent SrO12 cuboctahedra. The corner-sharing octahedral tilt angles are 0°. All Gd–O bond lengths are 2.24 Å. Re5+ is bonded to six equivalent O2- atoms to form ReO6 octahedra that share corners with six equivalent GdO6 octahedra and faces with eight equivalent SrO12 cuboctahedra. The corner-sharing octahedral tilt angles are 0°. All Re–O bond lengths are 1.97 Å. O2- is bonded in a distorted linear geometry to four equivalent Sr2+, one Gd3+, and one Re5+ atom.},
doi = {10.17188/1189825},
journal = {},
number = ,
volume = ,
place = {United States},
year = {2020},
month = {7}
}