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Materials Data on Li2TlAu by Materials Project

Dataset ·
DOI:https://doi.org/10.17188/1204814· OSTI ID:1204814
Li2AuTl crystallizes in the cubic F-43m space group. The structure is three-dimensional. there are two inequivalent Li sites. In the first Li site, Li is bonded to four equivalent Au atoms to form distorted corner-sharing LiAu4 tetrahedra. All Li–Au bond lengths are 2.89 Å. In the second Li site, Li is bonded to four equivalent Tl atoms to form distorted corner-sharing LiTl4 tetrahedra. All Li–Tl bond lengths are 2.89 Å. Au is bonded in a body-centered cubic geometry to four equivalent Li and four equivalent Tl atoms. All Au–Tl bond lengths are 2.89 Å. Tl is bonded in a body-centered cubic geometry to four equivalent Li and four equivalent Au atoms.
Research Organization:
LBNL Materials Project; Lawrence Berkeley National Laboratory (LBNL), Berkeley, CA (United States)
Sponsoring Organization:
USDOE Office of Science (SC), Basic Energy Sciences (BES) (SC-22)
Contributing Organization:
The Materials Project; MIT; UC Berkeley; Duke; U Louvain
DOE Contract Number:
AC02-05CH11231
OSTI ID:
1204814
Report Number(s):
mp-30406
Country of Publication:
United States
Language:
English

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