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Title: Materials Data on Zr3Ni3Sb4 by Materials Project

Dataset ·
DOI:https://doi.org/10.17188/1192779· OSTI ID:1192779

Zr3Ni3Sb4 crystallizes in the cubic I-43d space group. The structure is three-dimensional. Zr2+ is bonded in a 8-coordinate geometry to eight equivalent Sb3- atoms. There are four shorter (3.16 Å) and four longer (3.17 Å) Zr–Sb bond lengths. Ni2+ is bonded in a 4-coordinate geometry to four equivalent Sb3- atoms. All Ni–Sb bond lengths are 2.55 Å. Sb3- is bonded in a 9-coordinate geometry to six equivalent Zr2+ and three equivalent Ni2+ atoms.

Research Organization:
Lawrence Berkeley National Lab. (LBNL), Berkeley, CA (United States). LBNL Materials Project
Sponsoring Organization:
USDOE Office of Science (SC), Basic Energy Sciences (BES)
Contributing Organization:
MIT; UC Berkeley; Duke; U Louvain
DOE Contract Number:
AC02-05CH11231; EDCBEE
OSTI ID:
1192779
Report Number(s):
mp-17926
Resource Relation:
Related Information: https://materialsproject.org/citing
Country of Publication:
United States
Language:
English

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