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Title: Materials Data on Na2CuO2 by Materials Project

Abstract

Na2CuO2 is Ilmenite-like structured and crystallizes in the orthorhombic Immm space group. The structure is three-dimensional. Na1+ is bonded to four equivalent O2- atoms to form a mixture of distorted edge and corner-sharing NaO4 trigonal pyramids. All Na–O bond lengths are 2.33 Å. Cu2+ is bonded in a square co-planar geometry to four equivalent O2- atoms. All Cu–O bond lengths are 2.00 Å. O2- is bonded to four equivalent Na1+ and two equivalent Cu2+ atoms to form a mixture of edge and corner-sharing ONa4Cu2 octahedra. The corner-sharing octahedra tilt angles range from 0–28°.

Publication Date:
Other Number(s):
mp-755974
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; Na2CuO2; Cu-Na-O
OSTI Identifier:
1290281
DOI:
10.17188/1290281

Citation Formats

The Materials Project. Materials Data on Na2CuO2 by Materials Project. United States: N. p., 2020. Web. doi:10.17188/1290281.
The Materials Project. Materials Data on Na2CuO2 by Materials Project. United States. doi:10.17188/1290281.
The Materials Project. 2020. "Materials Data on Na2CuO2 by Materials Project". United States. doi:10.17188/1290281. https://www.osti.gov/servlets/purl/1290281. Pub date:Sat Jul 18 00:00:00 EDT 2020
@article{osti_1290281,
title = {Materials Data on Na2CuO2 by Materials Project},
author = {The Materials Project},
abstractNote = {Na2CuO2 is Ilmenite-like structured and crystallizes in the orthorhombic Immm space group. The structure is three-dimensional. Na1+ is bonded to four equivalent O2- atoms to form a mixture of distorted edge and corner-sharing NaO4 trigonal pyramids. All Na–O bond lengths are 2.33 Å. Cu2+ is bonded in a square co-planar geometry to four equivalent O2- atoms. All Cu–O bond lengths are 2.00 Å. O2- is bonded to four equivalent Na1+ and two equivalent Cu2+ atoms to form a mixture of edge and corner-sharing ONa4Cu2 octahedra. The corner-sharing octahedra tilt angles range from 0–28°.},
doi = {10.17188/1290281},
journal = {},
number = ,
volume = ,
place = {United States},
year = {2020},
month = {7}
}

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