Materials Data on LuTlTe2 by Materials Project
Abstract
LuTlTe2 is Caswellsilverite structured and crystallizes in the trigonal R-3m space group. The structure is three-dimensional. Lu3+ is bonded to six equivalent Te2- atoms to form LuTe6 octahedra that share corners with six equivalent TlTe6 octahedra, edges with six equivalent LuTe6 octahedra, and edges with six equivalent TlTe6 octahedra. The corner-sharing octahedral tilt angles are 9°. All Lu–Te bond lengths are 3.05 Å. Tl1+ is bonded to six equivalent Te2- atoms to form distorted TlTe6 octahedra that share corners with six equivalent LuTe6 octahedra, edges with six equivalent LuTe6 octahedra, and edges with six equivalent TlTe6 octahedra. The corner-sharing octahedral tilt angles are 9°. All Tl–Te bond lengths are 3.49 Å. Te2- is bonded to three equivalent Lu3+ and three equivalent Tl1+ atoms to form a mixture of distorted edge and corner-sharing TeLu3Tl3 octahedra. The corner-sharing octahedral tilt angles are 0°.
- Authors:
- Publication Date:
- Other Number(s):
- mp-1017508
- DOE Contract Number:
- AC02-05CH11231; EDCBEE
- Research Org.:
- Lawrence Berkeley National Lab. (LBNL), Berkeley, CA (United States). LBNL Materials Project
- Sponsoring Org.:
- USDOE Office of Science (SC), Basic Energy Sciences (BES)
- Collaborations:
- MIT; UC Berkeley; Duke; U Louvain
- Subject:
- 36 MATERIALS SCIENCE
- Keywords:
- crystal structure; LuTlTe2; Lu-Te-Tl
- OSTI Identifier:
- 1349840
- DOI:
- https://doi.org/10.17188/1349840
Citation Formats
The Materials Project. Materials Data on LuTlTe2 by Materials Project. United States: N. p., 2020.
Web. doi:10.17188/1349840.
The Materials Project. Materials Data on LuTlTe2 by Materials Project. United States. doi:https://doi.org/10.17188/1349840
The Materials Project. 2020.
"Materials Data on LuTlTe2 by Materials Project". United States. doi:https://doi.org/10.17188/1349840. https://www.osti.gov/servlets/purl/1349840. Pub date:Thu Jul 16 00:00:00 EDT 2020
@article{osti_1349840,
title = {Materials Data on LuTlTe2 by Materials Project},
author = {The Materials Project},
abstractNote = {LuTlTe2 is Caswellsilverite structured and crystallizes in the trigonal R-3m space group. The structure is three-dimensional. Lu3+ is bonded to six equivalent Te2- atoms to form LuTe6 octahedra that share corners with six equivalent TlTe6 octahedra, edges with six equivalent LuTe6 octahedra, and edges with six equivalent TlTe6 octahedra. The corner-sharing octahedral tilt angles are 9°. All Lu–Te bond lengths are 3.05 Å. Tl1+ is bonded to six equivalent Te2- atoms to form distorted TlTe6 octahedra that share corners with six equivalent LuTe6 octahedra, edges with six equivalent LuTe6 octahedra, and edges with six equivalent TlTe6 octahedra. The corner-sharing octahedral tilt angles are 9°. All Tl–Te bond lengths are 3.49 Å. Te2- is bonded to three equivalent Lu3+ and three equivalent Tl1+ atoms to form a mixture of distorted edge and corner-sharing TeLu3Tl3 octahedra. The corner-sharing octahedral tilt angles are 0°.},
doi = {10.17188/1349840},
journal = {},
number = ,
volume = ,
place = {United States},
year = {2020},
month = {7}
}