U.S. Department of EnergyOffice of Scientific and Technical Information
Materials Data on Cs3Ni by Materials Project
Abstract
Cs3Ni is alpha bismuth trifluoride structured and crystallizes in the tetragonal I4/mmm space group. The structure is three-dimensional. there are two inequivalent Cs sites. In the first Cs site, Cs is bonded in a 12-coordinate geometry to eight Cs and four equivalent Ni atoms. There are four shorter (4.42 Å) and four longer (4.55 Å) Cs–Cs bond lengths. All Cs–Ni bond lengths are 4.42 Å. In the second Cs site, Cs is bonded in a 8-coordinate geometry to eight equivalent Cs atoms. Ni is bonded in a 8-coordinate geometry to eight equivalent Cs atoms.
- Publication Date:
- Other Number(s):
- mp-985605
- 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; Cs-Ni; Cs3Ni; crystal structure
- OSTI Identifier:
- 1316736
- DOI:
- https://doi.org/10.17188/1316736
Citation Formats
Materials Data on Cs3Ni by Materials Project. United States: N. p., 2020.
Web. doi:10.17188/1316736.
Materials Data on Cs3Ni by Materials Project. United States. doi:https://doi.org/10.17188/1316736
2020.
"Materials Data on Cs3Ni by Materials Project". United States. doi:https://doi.org/10.17188/1316736. https://www.osti.gov/servlets/purl/1316736. Pub date:Thu Jul 23 00:00:00 EDT 2020
@article{osti_1316736,
title = {Materials Data on Cs3Ni by Materials Project},
abstractNote = {Cs3Ni is alpha bismuth trifluoride structured and crystallizes in the tetragonal I4/mmm space group. The structure is three-dimensional. there are two inequivalent Cs sites. In the first Cs site, Cs is bonded in a 12-coordinate geometry to eight Cs and four equivalent Ni atoms. There are four shorter (4.42 Å) and four longer (4.55 Å) Cs–Cs bond lengths. All Cs–Ni bond lengths are 4.42 Å. In the second Cs site, Cs is bonded in a 8-coordinate geometry to eight equivalent Cs atoms. Ni is bonded in a 8-coordinate geometry to eight equivalent Cs atoms.},
doi = {10.17188/1316736},
journal = {},
number = ,
volume = ,
place = {United States},
year = {2020},
month = {7}
}
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