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Materials Data on SmInNi by Materials Project

Dataset ·
DOI:https://doi.org/10.17188/1744591· OSTI ID:1744591
SmNiIn crystallizes in the hexagonal P-62m space group. The structure is three-dimensional. Sm is bonded in a 11-coordinate geometry to five Ni and six equivalent In atoms. There are four shorter (2.99 Å) and one longer (3.11 Å) Sm–Ni bond lengths. There are two shorter (3.20 Å) and four longer (3.35 Å) Sm–In bond lengths. There are two inequivalent Ni sites. In the first Ni site, Ni is bonded in a 9-coordinate geometry to three equivalent Sm and six equivalent In atoms. All Ni–In bond lengths are 2.71 Å. In the second Ni site, Ni is bonded in a 9-coordinate geometry to six equivalent Sm and three equivalent In atoms. All Ni–In bond lengths are 2.87 Å. In is bonded in a 10-coordinate geometry to six equivalent Sm and four 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:
1744591
Report Number(s):
mp-1078856
Country of Publication:
United States
Language:
English

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