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Materials Data on Yb3Al by Materials Project

Dataset ·
DOI:https://doi.org/10.17188/1704441· OSTI ID:1704441
Yb3Al is alpha bismuth trifluoride structured and crystallizes in the tetragonal I4/mmm space group. The structure is three-dimensional. there are two inequivalent Yb sites. In the first Yb site, Yb is bonded to four equivalent Yb and four equivalent Al atoms to form a mixture of distorted corner, edge, and face-sharing YbYb4Al4 tetrahedra. All Yb–Yb bond lengths are 3.39 Å. All Yb–Al bond lengths are 3.39 Å. In the second Yb site, Yb is bonded in a body-centered cubic geometry to eight equivalent Yb atoms. Al is bonded in a body-centered cubic geometry to eight equivalent Yb 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:
1704441
Report Number(s):
mp-1187947
Country of Publication:
United States
Language:
English

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