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Title: Materials Data on HfNiSn by Materials Project

Dataset ·
DOI:https://doi.org/10.17188/1195656· OSTI ID:1195656

HfNiSn is half-Heusler structured and crystallizes in the cubic F-43m space group. The structure is three-dimensional. Hf is bonded to six equivalent Ni and four equivalent Sn atoms to form a mixture of distorted corner and face-sharing HfNi6Sn4 tetrahedra. All Hf–Ni bond lengths are 3.17 Å. All Hf–Sn bond lengths are 2.74 Å. Ni is bonded in a distorted q6 geometry to six equivalent Hf and four equivalent Sn atoms. All Ni–Sn bond lengths are 2.74 Å. Sn is bonded in a body-centered cubic geometry to four equivalent Hf and four equivalent Ni 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:
1195656
Report Number(s):
mp-20523
Resource Relation:
Related Information: https://materialsproject.org/citing
Country of Publication:
United States
Language:
English

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