U.S. Department of EnergyOffice of Scientific and Technical Information
Materials Data on TlSbF6 by Materials Project
Abstract
TlSbF6 crystallizes in the trigonal R-3m space group. The structure is three-dimensional. Tl1+ is bonded to twelve equivalent F1- atoms to form TlF12 cuboctahedra that share corners with six equivalent SbF6 octahedra, edges with six equivalent TlF12 cuboctahedra, and faces with two equivalent SbF6 octahedra. The corner-sharing octahedral tilt angles are 32°. There are six shorter (3.05 Å) and six longer (3.27 Å) Tl–F bond lengths. Sb5+ is bonded to six equivalent F1- atoms to form SbF6 octahedra that share corners with six equivalent TlF12 cuboctahedra and faces with two equivalent TlF12 cuboctahedra. All Sb–F bond lengths are 1.92 Å. F1- is bonded in a distorted single-bond geometry to two equivalent Tl1+ and one Sb5+ atom.
- Publication Date:
- Other Number(s):
- mp-8348
- 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; F-Sb-Tl; TlSbF6; crystal structure
- OSTI Identifier:
- 1308047
- DOI:
- https://doi.org/10.17188/1308047
Citation Formats
Materials Data on TlSbF6 by Materials Project. United States: N. p., 2020.
Web. doi:10.17188/1308047.
Materials Data on TlSbF6 by Materials Project. United States. doi:https://doi.org/10.17188/1308047
2020.
"Materials Data on TlSbF6 by Materials Project". United States. doi:https://doi.org/10.17188/1308047. https://www.osti.gov/servlets/purl/1308047. Pub date:Thu Jul 16 00:00:00 EDT 2020
@article{osti_1308047,
title = {Materials Data on TlSbF6 by Materials Project},
abstractNote = {TlSbF6 crystallizes in the trigonal R-3m space group. The structure is three-dimensional. Tl1+ is bonded to twelve equivalent F1- atoms to form TlF12 cuboctahedra that share corners with six equivalent SbF6 octahedra, edges with six equivalent TlF12 cuboctahedra, and faces with two equivalent SbF6 octahedra. The corner-sharing octahedral tilt angles are 32°. There are six shorter (3.05 Å) and six longer (3.27 Å) Tl–F bond lengths. Sb5+ is bonded to six equivalent F1- atoms to form SbF6 octahedra that share corners with six equivalent TlF12 cuboctahedra and faces with two equivalent TlF12 cuboctahedra. All Sb–F bond lengths are 1.92 Å. F1- is bonded in a distorted single-bond geometry to two equivalent Tl1+ and one Sb5+ atom.},
doi = {10.17188/1308047},
journal = {},
number = ,
volume = ,
place = {United States},
year = {2020},
month = {7}
}
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