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Title: Materials Data on CuSiO3 by Materials Project

Abstract

CuSiO3 crystallizes in the orthorhombic Pmma space group. The structure is two-dimensional and consists of one CuSiO3 sheet oriented in the (0, 1, 0) direction. Cu2+ is bonded in a square co-planar geometry to four equivalent O2- atoms. All Cu–O bond lengths are 1.93 Å. Si4+ is bonded to four O2- atoms to form corner-sharing SiO4 tetrahedra. There is two shorter (1.64 Å) and two longer (1.67 Å) Si–O bond length. There are two inequivalent O2- sites. In the first O2- site, O2- is bonded in a bent 120 degrees geometry to two equivalent Si4+ atoms. In the second O2- site, O2- is bonded in a distorted trigonal planar geometry to two equivalent Cu2+ and one Si4+ atom.

Publication Date:
Other Number(s):
mp-16053
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; CuSiO3; Cu-O-Si
OSTI Identifier:
1191542
DOI:
https://doi.org/10.17188/1191542

Citation Formats

The Materials Project. Materials Data on CuSiO3 by Materials Project. United States: N. p., 2020. Web. doi:10.17188/1191542.
The Materials Project. Materials Data on CuSiO3 by Materials Project. United States. doi:https://doi.org/10.17188/1191542
The Materials Project. 2020. "Materials Data on CuSiO3 by Materials Project". United States. doi:https://doi.org/10.17188/1191542. https://www.osti.gov/servlets/purl/1191542. Pub date:Thu Jul 16 00:00:00 EDT 2020
@article{osti_1191542,
title = {Materials Data on CuSiO3 by Materials Project},
author = {The Materials Project},
abstractNote = {CuSiO3 crystallizes in the orthorhombic Pmma space group. The structure is two-dimensional and consists of one CuSiO3 sheet oriented in the (0, 1, 0) direction. Cu2+ is bonded in a square co-planar geometry to four equivalent O2- atoms. All Cu–O bond lengths are 1.93 Å. Si4+ is bonded to four O2- atoms to form corner-sharing SiO4 tetrahedra. There is two shorter (1.64 Å) and two longer (1.67 Å) Si–O bond length. There are two inequivalent O2- sites. In the first O2- site, O2- is bonded in a bent 120 degrees geometry to two equivalent Si4+ atoms. In the second O2- site, O2- is bonded in a distorted trigonal planar geometry to two equivalent Cu2+ and one Si4+ atom.},
doi = {10.17188/1191542},
journal = {},
number = ,
volume = ,
place = {United States},
year = {2020},
month = {7}
}