U.S. Department of EnergyOffice of Scientific and Technical Information
Materials Data on MnCuF6 by Materials Project
Abstract
CuMnF6 crystallizes in the triclinic P-1 space group. The structure is one-dimensional and consists of one CuMnF6 ribbon oriented in the (0, 1, 1) direction. Mn4+ is bonded in a linear geometry to two equivalent F1- atoms. Both Mn–F bond lengths are 1.10 Å. Cu2+ is bonded in a 6-coordinate geometry to six F1- atoms. There are a spread of Cu–F bond distances ranging from 1.80–2.52 Å. There are three inequivalent F1- sites. In the first F1- site, F1- is bonded in a distorted single-bond geometry to one Cu2+ atom. In the second F1- site, F1- is bonded in a single-bond geometry to one Cu2+ atom. In the third F1- site, F1- is bonded in a 1-coordinate geometry to one Mn4+ and one Cu2+ atom.
- Publication Date:
- Other Number(s):
- mp-1206085
- 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-Mn; MnCuF6; crystal structure
- OSTI Identifier:
- 1695036
- DOI:
- https://doi.org/10.17188/1695036
Citation Formats
Materials Data on MnCuF6 by Materials Project. United States: N. p., 2019.
Web. doi:10.17188/1695036.
Materials Data on MnCuF6 by Materials Project. United States. doi:https://doi.org/10.17188/1695036
2019.
"Materials Data on MnCuF6 by Materials Project". United States. doi:https://doi.org/10.17188/1695036. https://www.osti.gov/servlets/purl/1695036. Pub date:Fri Jan 11 23:00:00 EST 2019
@article{osti_1695036,
title = {Materials Data on MnCuF6 by Materials Project},
abstractNote = {CuMnF6 crystallizes in the triclinic P-1 space group. The structure is one-dimensional and consists of one CuMnF6 ribbon oriented in the (0, 1, 1) direction. Mn4+ is bonded in a linear geometry to two equivalent F1- atoms. Both Mn–F bond lengths are 1.10 Å. Cu2+ is bonded in a 6-coordinate geometry to six F1- atoms. There are a spread of Cu–F bond distances ranging from 1.80–2.52 Å. There are three inequivalent F1- sites. In the first F1- site, F1- is bonded in a distorted single-bond geometry to one Cu2+ atom. In the second F1- site, F1- is bonded in a single-bond geometry to one Cu2+ atom. In the third F1- site, F1- is bonded in a 1-coordinate geometry to one Mn4+ and one Cu2+ atom.},
doi = {10.17188/1695036},
journal = {},
number = ,
volume = ,
place = {United States},
year = {2019},
month = {1}
}
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