U.S. Department of EnergyOffice of Scientific and Technical Information
Materials Data on Na2CuF4 by Materials Project
Abstract
Na2CuF4 crystallizes in the monoclinic P2_1/c space group. The structure is three-dimensional. Na1+ is bonded in a 7-coordinate geometry to seven F1- atoms. There are a spread of Na–F bond distances ranging from 2.31–2.68 Å. Cu2+ is bonded to six F1- atoms to form edge-sharing CuF6 octahedra. There are a spread of Cu–F bond distances ranging from 1.93–2.49 Å. There are two inequivalent F1- sites. In the first F1- site, F1- is bonded in a 5-coordinate geometry to three equivalent Na1+ and two equivalent Cu2+ atoms. In the second F1- site, F1- is bonded in a 5-coordinate geometry to four equivalent Na1+ and one Cu2+ atom.
- Publication Date:
- Other Number(s):
- mp-3237
- 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-F-Na; Na2CuF4; crystal structure
- OSTI Identifier:
- 1206171
- DOI:
- https://doi.org/10.17188/1206171
Citation Formats
Materials Data on Na2CuF4 by Materials Project. United States: N. p., 2020.
Web. doi:10.17188/1206171.
Materials Data on Na2CuF4 by Materials Project. United States. doi:https://doi.org/10.17188/1206171
2020.
"Materials Data on Na2CuF4 by Materials Project". United States. doi:https://doi.org/10.17188/1206171. https://www.osti.gov/servlets/purl/1206171. Pub date:Wed Jul 15 00:00:00 EDT 2020
@article{osti_1206171,
title = {Materials Data on Na2CuF4 by Materials Project},
abstractNote = {Na2CuF4 crystallizes in the monoclinic P2_1/c space group. The structure is three-dimensional. Na1+ is bonded in a 7-coordinate geometry to seven F1- atoms. There are a spread of Na–F bond distances ranging from 2.31–2.68 Å. Cu2+ is bonded to six F1- atoms to form edge-sharing CuF6 octahedra. There are a spread of Cu–F bond distances ranging from 1.93–2.49 Å. There are two inequivalent F1- sites. In the first F1- site, F1- is bonded in a 5-coordinate geometry to three equivalent Na1+ and two equivalent Cu2+ atoms. In the second F1- site, F1- is bonded in a 5-coordinate geometry to four equivalent Na1+ and one Cu2+ atom.},
doi = {10.17188/1206171},
journal = {},
number = ,
volume = ,
place = {United States},
year = {2020},
month = {7}
}
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