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Materials Data on Zr5Ge3 by Materials Project

Dataset ·
DOI:https://doi.org/10.17188/1192647· OSTI ID:1192647
Zr5Ge3 crystallizes in the hexagonal P6_3/mcm space group. The structure is three-dimensional. there are two inequivalent Zr sites. In the first Zr site, Zr is bonded in a 5-coordinate geometry to five equivalent Ge atoms. There are a spread of Zr–Ge bond distances ranging from 2.77–3.03 Å. In the second Zr site, Zr is bonded in a 6-coordinate geometry to six equivalent Ge atoms. All Zr–Ge bond lengths are 2.88 Å. Ge is bonded in a 9-coordinate geometry to nine Zr 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:
1192647
Report Number(s):
mp-17706
Country of Publication:
United States
Language:
English

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