U.S. Department of EnergyOffice of Scientific and Technical Information
Materials Data on TlAg3Te2 by Materials Project
Abstract
Ag3TlTe2 is Zirconium Disilicide-derived structured and crystallizes in the orthorhombic Cmmm space group. The structure is three-dimensional. there are two inequivalent Ag1+ sites. In the first Ag1+ site, Ag1+ is bonded in a 4-coordinate geometry to six equivalent Te2- atoms. There are four shorter (3.05 Å) and two longer (3.52 Å) Ag–Te bond lengths. In the second Ag1+ site, Ag1+ is bonded in a distorted body-centered cubic geometry to four equivalent Tl1+ and four equivalent Te2- atoms. All Ag–Tl bond lengths are 3.00 Å. All Ag–Te bond lengths are 3.25 Å. Tl1+ is bonded in a 12-coordinate geometry to four equivalent Ag1+ and four equivalent Te2- atoms. All Tl–Te bond lengths are 3.33 Å. Te2- is bonded in a 10-coordinate geometry to eight Ag1+ and two equivalent Tl1+ atoms.
- Publication Date:
- Other Number(s):
- mp-8925
- 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; Ag-Te-Tl; TlAg3Te2; crystal structure
- OSTI Identifier:
- 1312833
- DOI:
- https://doi.org/10.17188/1312833
Citation Formats
Materials Data on TlAg3Te2 by Materials Project. United States: N. p., 2020.
Web. doi:10.17188/1312833.
Materials Data on TlAg3Te2 by Materials Project. United States. doi:https://doi.org/10.17188/1312833
2020.
"Materials Data on TlAg3Te2 by Materials Project". United States. doi:https://doi.org/10.17188/1312833. https://www.osti.gov/servlets/purl/1312833. Pub date:Thu Jul 16 00:00:00 EDT 2020
@article{osti_1312833,
title = {Materials Data on TlAg3Te2 by Materials Project},
abstractNote = {Ag3TlTe2 is Zirconium Disilicide-derived structured and crystallizes in the orthorhombic Cmmm space group. The structure is three-dimensional. there are two inequivalent Ag1+ sites. In the first Ag1+ site, Ag1+ is bonded in a 4-coordinate geometry to six equivalent Te2- atoms. There are four shorter (3.05 Å) and two longer (3.52 Å) Ag–Te bond lengths. In the second Ag1+ site, Ag1+ is bonded in a distorted body-centered cubic geometry to four equivalent Tl1+ and four equivalent Te2- atoms. All Ag–Tl bond lengths are 3.00 Å. All Ag–Te bond lengths are 3.25 Å. Tl1+ is bonded in a 12-coordinate geometry to four equivalent Ag1+ and four equivalent Te2- atoms. All Tl–Te bond lengths are 3.33 Å. Te2- is bonded in a 10-coordinate geometry to eight Ag1+ and two equivalent Tl1+ atoms.},
doi = {10.17188/1312833},
journal = {},
number = ,
volume = ,
place = {United States},
year = {2020},
month = {7}
}