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Title: Materials Data on Zr6Sb2Pt by Materials Project

Dataset ·
DOI:https://doi.org/10.17188/1189299· OSTI ID:1189299

Zr6PtSb2 crystallizes in the hexagonal P-62m 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 one Pt and four equivalent Sb atoms. The Zr–Pt bond length is 3.19 Å. All Zr–Sb bond lengths are 3.03 Å. In the second Zr site, Zr is bonded in a 4-coordinate geometry to two equivalent Pt and two equivalent Sb atoms. Both Zr–Pt bond lengths are 2.72 Å. Both Zr–Sb bond lengths are 3.00 Å. Pt is bonded in a 9-coordinate geometry to nine Zr atoms. Sb is bonded in a 9-coordinate geometry to nine Zr 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:
1189299
Report Number(s):
mp-12972
Resource Relation:
Related Information: https://materialsproject.org/citing
Country of Publication:
United States
Language:
English

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