U.S. Department of EnergyOffice of Scientific and Technical Information
Materials Data on KRb3 by Materials Project
Abstract
Rb3K crystallizes in the tetragonal I4/mmm space group. The structure is three-dimensional. there are two inequivalent Rb sites. In the first Rb site, Rb is bonded in a 12-coordinate geometry to eight Rb atoms. There are four shorter (4.86 Å) and four longer (5.04 Å) Rb–Rb bond lengths. In the second Rb site, Rb is bonded to eight equivalent Rb and four equivalent K atoms to form a mixture of corner, edge, and face-sharing RbK4Rb8 cuboctahedra. All Rb–K bond lengths are 4.86 Å. K is bonded in a square co-planar geometry to four equivalent Rb atoms.
- Publication Date:
- Other Number(s):
- mp-973508
- 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; K-Rb; KRb3; crystal structure
- OSTI Identifier:
- 1314127
- DOI:
- https://doi.org/10.17188/1314127
Citation Formats
Materials Data on KRb3 by Materials Project. United States: N. p., 2020.
Web. doi:10.17188/1314127.
Materials Data on KRb3 by Materials Project. United States. doi:https://doi.org/10.17188/1314127
2020.
"Materials Data on KRb3 by Materials Project". United States. doi:https://doi.org/10.17188/1314127. https://www.osti.gov/servlets/purl/1314127. Pub date:Wed Jul 22 00:00:00 EDT 2020
@article{osti_1314127,
title = {Materials Data on KRb3 by Materials Project},
abstractNote = {Rb3K crystallizes in the tetragonal I4/mmm space group. The structure is three-dimensional. there are two inequivalent Rb sites. In the first Rb site, Rb is bonded in a 12-coordinate geometry to eight Rb atoms. There are four shorter (4.86 Å) and four longer (5.04 Å) Rb–Rb bond lengths. In the second Rb site, Rb is bonded to eight equivalent Rb and four equivalent K atoms to form a mixture of corner, edge, and face-sharing RbK4Rb8 cuboctahedra. All Rb–K bond lengths are 4.86 Å. K is bonded in a square co-planar geometry to four equivalent Rb atoms.},
doi = {10.17188/1314127},
journal = {},
number = ,
volume = ,
place = {United States},
year = {2020},
month = {7}
}
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