U.S. Department of EnergyOffice of Scientific and Technical Information
Materials Data on Tl4GeI6 by Materials Project
Abstract
Tl4GeI6 crystallizes in the tetragonal P4/mnc space group. The structure is three-dimensional. Tl1+ is bonded in a 8-coordinate geometry to eight I1- atoms. There are a spread of Tl–I bond distances ranging from 3.53–4.15 Å. Ge2+ is bonded in an octahedral geometry to six I1- atoms. There are two shorter (2.99 Å) and four longer (3.07 Å) Ge–I bond lengths. There are two inequivalent I1- sites. In the first I1- site, I1- is bonded to four equivalent Tl1+ and one Ge2+ atom to form distorted corner-sharing ITl4Ge square pyramids. In the second I1- site, I1- is bonded in a 7-coordinate geometry to six equivalent Tl1+ and one Ge2+ atom.
- Publication Date:
- Other Number(s):
- mp-1208159
- 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; Ge-I-Tl; Tl4GeI6; crystal structure
- OSTI Identifier:
- 1749793
- DOI:
- https://doi.org/10.17188/1749793
Citation Formats
Materials Data on Tl4GeI6 by Materials Project. United States: N. p., 2020.
Web. doi:10.17188/1749793.
Materials Data on Tl4GeI6 by Materials Project. United States. doi:https://doi.org/10.17188/1749793
2020.
"Materials Data on Tl4GeI6 by Materials Project". United States. doi:https://doi.org/10.17188/1749793. https://www.osti.gov/servlets/purl/1749793. Pub date:Thu Apr 30 00:00:00 EDT 2020
@article{osti_1749793,
title = {Materials Data on Tl4GeI6 by Materials Project},
abstractNote = {Tl4GeI6 crystallizes in the tetragonal P4/mnc space group. The structure is three-dimensional. Tl1+ is bonded in a 8-coordinate geometry to eight I1- atoms. There are a spread of Tl–I bond distances ranging from 3.53–4.15 Å. Ge2+ is bonded in an octahedral geometry to six I1- atoms. There are two shorter (2.99 Å) and four longer (3.07 Å) Ge–I bond lengths. There are two inequivalent I1- sites. In the first I1- site, I1- is bonded to four equivalent Tl1+ and one Ge2+ atom to form distorted corner-sharing ITl4Ge square pyramids. In the second I1- site, I1- is bonded in a 7-coordinate geometry to six equivalent Tl1+ and one Ge2+ atom.},
doi = {10.17188/1749793},
journal = {},
number = ,
volume = ,
place = {United States},
year = {2020},
month = {4}
}
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