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Materials Data on ErMnNi4 by Materials Project

Dataset ·
DOI:https://doi.org/10.17188/1754243· OSTI ID:1754243
ErMnNi4 is Hexagonal Laves-derived structured and crystallizes in the cubic F-43m space group. The structure is three-dimensional. Er is bonded in a 12-coordinate geometry to four equivalent Mn and twelve equivalent Ni atoms. All Er–Mn bond lengths are 2.98 Å. All Er–Ni bond lengths are 2.86 Å. Mn is bonded in a 12-coordinate geometry to four equivalent Er and twelve equivalent Ni atoms. All Mn–Ni bond lengths are 2.86 Å. Ni is bonded to three equivalent Er, three equivalent Mn, and six equivalent Ni atoms to form a mixture of corner, edge, and face-sharing NiEr3Mn3Ni6 cuboctahedra. There are three shorter (2.42 Å) and three longer (2.45 Å) Ni–Ni bond lengths.
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:
1754243
Report Number(s):
mp-1077334
Country of Publication:
United States
Language:
English

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