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Materials Data on Mn2NiSn by Materials Project

Dataset ·
DOI:https://doi.org/10.17188/1708767· OSTI ID:1708767
Mn2NiSn is Zintl Phase-derived structured and crystallizes in the cubic F-43m space group. The structure is three-dimensional. there are two inequivalent Mn sites. In the first Mn site, Mn is bonded in a 4-coordinate geometry to four equivalent Mn, four equivalent Ni, and six equivalent Sn atoms. All Mn–Mn bond lengths are 2.62 Å. All Mn–Ni bond lengths are 2.62 Å. All Mn–Sn bond lengths are 3.02 Å. In the second Mn site, Mn is bonded to four equivalent Mn, six equivalent Ni, and four equivalent Sn atoms to form a mixture of distorted face and corner-sharing MnMn4Ni6Sn4 tetrahedra. All Mn–Ni bond lengths are 3.02 Å. All Mn–Sn bond lengths are 2.62 Å. Ni is bonded in a 8-coordinate geometry to ten Mn and four equivalent Sn atoms. All Ni–Sn bond lengths are 2.62 Å. Sn is bonded in a 8-coordinate geometry to ten Mn and four equivalent Ni 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:
1708767
Report Number(s):
mp-1221821
Country of Publication:
United States
Language:
English

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