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Materials Data on TbRe2 by Materials Project

Dataset ·
DOI:https://doi.org/10.17188/1747937· OSTI ID:1747937
TbRe2 is Hexagonal Laves structured and crystallizes in the hexagonal P6_3/mmc space group. The structure is three-dimensional. Tb is bonded in a 12-coordinate geometry to twelve Re atoms. There are three shorter (3.16 Å) and nine longer (3.19 Å) Tb–Re bond lengths. There are two inequivalent Re sites. In the first Re site, Re is bonded to six equivalent Tb and six equivalent Re atoms to form a mixture of corner, edge, and face-sharing ReTb6Re6 cuboctahedra. All Re–Re bond lengths are 2.74 Å. In the second Re site, Re is bonded to six equivalent Tb and six Re atoms to form a mixture of corner, edge, and face-sharing ReTb6Re6 cuboctahedra. There are two shorter (2.65 Å) and two longer (2.80 Å) Re–Re bond lengths.
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:
1747937
Report Number(s):
mp-1102249
Country of Publication:
United States
Language:
English

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