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Materials Data on Yb3Hf by Materials Project

Dataset ·
DOI:https://doi.org/10.17188/1655971· OSTI ID:1655971

Yb3Hf is alpha bismuth trifluoride structured and crystallizes in the cubic Fm-3m space group. The structure is three-dimensional. there are two inequivalent Yb sites. In the first Yb site, Yb is bonded in a distorted body-centered cubic geometry to four equivalent Yb and four equivalent Hf atoms. All Yb–Yb bond lengths are 3.44 Å. All Yb–Hf bond lengths are 3.44 Å. In the second Yb site, Yb is bonded in a 8-coordinate geometry to eight equivalent Yb and six equivalent Hf atoms. All Yb–Hf bond lengths are 3.98 Å. Hf is bonded in a distorted body-centered cubic geometry to fourteen 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:
1655971
Report Number(s):
mp-1232422
Country of Publication:
United States
Language:
English

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