U.S. Department of EnergyOffice of Scientific and Technical Information
Materials Data on ZnCuO3 by Materials Project
Abstract
CuZnO3 is (Cubic) Perovskite structured and crystallizes in the cubic Pm-3m space group. The structure is three-dimensional. Cu is bonded to six equivalent O atoms to form CuO6 octahedra that share corners with six equivalent CuO6 octahedra and faces with eight equivalent ZnO12 cuboctahedra. The corner-sharing octahedral tilt angles are 0°. All Cu–O bond lengths are 1.87 Å. Zn is bonded to twelve equivalent O atoms to form distorted ZnO12 cuboctahedra that share corners with twelve equivalent ZnO12 cuboctahedra, faces with six equivalent ZnO12 cuboctahedra, and faces with eight equivalent CuO6 octahedra. All Zn–O bond lengths are 2.64 Å. O is bonded in a linear geometry to two equivalent Cu and four equivalent Zn atoms.
- Publication Date:
- Other Number(s):
- mp-1100778
- DOE Contract Number:
- AC02-05CH11231
- Research Org.:
- LBNL Materials Project; Lawrence Berkeley National Laboratory (LBNL), Berkeley, CA (United States)
- Sponsoring Org.:
- USDOE Office of Science (SC), Basic Energy Sciences (BES) (SC-22)
- Collaborations:
- The Materials Project; MIT; UC Berkeley; Duke; U Louvain
- Subject:
- 36 MATERIALS SCIENCE; Cu-O-Zn; ZnCuO3; crystal structure
- OSTI Identifier:
- 1718751
- DOI:
- https://doi.org/10.17188/1718751
Citation Formats
Materials Data on ZnCuO3 by Materials Project. United States: N. p., 2020.
Web. doi:10.17188/1718751.
Materials Data on ZnCuO3 by Materials Project. United States. doi:https://doi.org/10.17188/1718751
2020.
"Materials Data on ZnCuO3 by Materials Project". United States. doi:https://doi.org/10.17188/1718751. https://www.osti.gov/servlets/purl/1718751. Pub date:Sun May 03 04:00:00 UTC 2020
@article{osti_1718751,
title = {Materials Data on ZnCuO3 by Materials Project},
abstractNote = {CuZnO3 is (Cubic) Perovskite structured and crystallizes in the cubic Pm-3m space group. The structure is three-dimensional. Cu is bonded to six equivalent O atoms to form CuO6 octahedra that share corners with six equivalent CuO6 octahedra and faces with eight equivalent ZnO12 cuboctahedra. The corner-sharing octahedral tilt angles are 0°. All Cu–O bond lengths are 1.87 Å. Zn is bonded to twelve equivalent O atoms to form distorted ZnO12 cuboctahedra that share corners with twelve equivalent ZnO12 cuboctahedra, faces with six equivalent ZnO12 cuboctahedra, and faces with eight equivalent CuO6 octahedra. All Zn–O bond lengths are 2.64 Å. O is bonded in a linear geometry to two equivalent Cu and four equivalent Zn atoms.},
doi = {10.17188/1718751},
journal = {},
number = ,
volume = ,
place = {United States},
year = {2020},
month = {5}
}
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