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Title: Materials Data on Sr2CuSO2 by Materials Project

Abstract

Sr2CuSO2 crystallizes in the tetragonal P4/mmm space group. The structure is three-dimensional. Sr2+ is bonded in a 8-coordinate geometry to four equivalent S2- and four equivalent O2- atoms. All Sr–S bond lengths are 3.25 Å. All Sr–O bond lengths are 2.60 Å. Cu2+ is bonded in a square co-planar geometry to four equivalent O2- atoms. All Cu–O bond lengths are 1.95 Å. S2- is bonded in a body-centered cubic geometry to eight equivalent Sr2+ atoms. O2- is bonded to four equivalent Sr2+ and two equivalent Cu2+ atoms to form a mixture of edge, face, and corner-sharing OSr4Cu2 octahedra. The corner-sharing octahedral tilt angles are 0°.

Authors:
Publication Date:
Other Number(s):
mp-1147582
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; Sr2CuSO2; Cu-O-S-Sr
OSTI Identifier:
1732791
DOI:
https://doi.org/10.17188/1732791

Citation Formats

The Materials Project. Materials Data on Sr2CuSO2 by Materials Project. United States: N. p., 2020. Web. doi:10.17188/1732791.
The Materials Project. Materials Data on Sr2CuSO2 by Materials Project. United States. doi:https://doi.org/10.17188/1732791
The Materials Project. 2020. "Materials Data on Sr2CuSO2 by Materials Project". United States. doi:https://doi.org/10.17188/1732791. https://www.osti.gov/servlets/purl/1732791. Pub date:Sat May 02 00:00:00 EDT 2020
@article{osti_1732791,
title = {Materials Data on Sr2CuSO2 by Materials Project},
author = {The Materials Project},
abstractNote = {Sr2CuSO2 crystallizes in the tetragonal P4/mmm space group. The structure is three-dimensional. Sr2+ is bonded in a 8-coordinate geometry to four equivalent S2- and four equivalent O2- atoms. All Sr–S bond lengths are 3.25 Å. All Sr–O bond lengths are 2.60 Å. Cu2+ is bonded in a square co-planar geometry to four equivalent O2- atoms. All Cu–O bond lengths are 1.95 Å. S2- is bonded in a body-centered cubic geometry to eight equivalent Sr2+ atoms. O2- is bonded to four equivalent Sr2+ and two equivalent Cu2+ atoms to form a mixture of edge, face, and corner-sharing OSr4Cu2 octahedra. The corner-sharing octahedral tilt angles are 0°.},
doi = {10.17188/1732791},
journal = {},
number = ,
volume = ,
place = {United States},
year = {2020},
month = {5}
}