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Title: Materials Data on CuSnO6 by Materials Project

Abstract

CuSnO6 crystallizes in the tetragonal P4_2/nnm space group. The structure is three-dimensional. Cu is bonded to six O atoms to form CuO6 octahedra that share corners with six equivalent SnO6 octahedra. The corner-sharing octahedra tilt angles range from 50–63°. There is two shorter (1.80 Å) and four longer (2.16 Å) Cu–O bond length. Sn is bonded to six O atoms to form SnO6 octahedra that share corners with six equivalent CuO6 octahedra. The corner-sharing octahedra tilt angles range from 50–63°. There are two shorter (1.96 Å) and four longer (2.23 Å) Sn–O bond lengths. There are two inequivalent O sites. In the first O site, O is bonded in a distorted trigonal planar geometry to one Cu, one Sn, and one O atom. The O–O bond length is 1.40 Å. In the second O site, O is bonded in a bent 120 degrees geometry to one Cu and one Sn atom.

Authors:
Publication Date:
Other Number(s):
mp-1202466
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; CuSnO6; Cu-O-Sn
OSTI Identifier:
1738835
DOI:
https://doi.org/10.17188/1738835

Citation Formats

The Materials Project. Materials Data on CuSnO6 by Materials Project. United States: N. p., 2020. Web. doi:10.17188/1738835.
The Materials Project. Materials Data on CuSnO6 by Materials Project. United States. doi:https://doi.org/10.17188/1738835
The Materials Project. 2020. "Materials Data on CuSnO6 by Materials Project". United States. doi:https://doi.org/10.17188/1738835. https://www.osti.gov/servlets/purl/1738835. Pub date:Sat May 02 00:00:00 EDT 2020
@article{osti_1738835,
title = {Materials Data on CuSnO6 by Materials Project},
author = {The Materials Project},
abstractNote = {CuSnO6 crystallizes in the tetragonal P4_2/nnm space group. The structure is three-dimensional. Cu is bonded to six O atoms to form CuO6 octahedra that share corners with six equivalent SnO6 octahedra. The corner-sharing octahedra tilt angles range from 50–63°. There is two shorter (1.80 Å) and four longer (2.16 Å) Cu–O bond length. Sn is bonded to six O atoms to form SnO6 octahedra that share corners with six equivalent CuO6 octahedra. The corner-sharing octahedra tilt angles range from 50–63°. There are two shorter (1.96 Å) and four longer (2.23 Å) Sn–O bond lengths. There are two inequivalent O sites. In the first O site, O is bonded in a distorted trigonal planar geometry to one Cu, one Sn, and one O atom. The O–O bond length is 1.40 Å. In the second O site, O is bonded in a bent 120 degrees geometry to one Cu and one Sn atom.},
doi = {10.17188/1738835},
journal = {},
number = ,
volume = ,
place = {United States},
year = {2020},
month = {5}
}