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Materials Data on NiTe by Materials Project

Dataset ·
DOI:https://doi.org/10.17188/1195425· OSTI ID:1195425
NiTe is Tungsten Carbide-like structured and crystallizes in the hexagonal P6_3/mmc space group. The structure is three-dimensional. Ni2+ is bonded to six equivalent Te2- atoms to form a mixture of face, edge, and corner-sharing NiTe6 octahedra. The corner-sharing octahedral tilt angles are 52°. All Ni–Te bond lengths are 2.67 Å. Te2- is bonded in a 6-coordinate geometry to six equivalent Ni2+ 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:
1195425
Report Number(s):
mp-203
Country of Publication:
United States
Language:
English

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