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Title: Materials Data on CeInNi by Materials Project

Dataset ·
DOI:https://doi.org/10.17188/1196945· OSTI ID:1196945

CeNiIn crystallizes in the hexagonal P-62m space group. The structure is three-dimensional. Ce 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 (3.05 Å) Ce–Ni bond lengths. There are two shorter (3.19 Å) and four longer (3.33 Å) Ce–In bond lengths. There are two inequivalent Ni sites. In the first Ni site, Ni is bonded in a 9-coordinate geometry to six equivalent Ce and three equivalent In atoms. All Ni–In bond lengths are 2.81 Å. In the second Ni site, Ni is bonded in a 9-coordinate geometry to three equivalent Ce and six equivalent In atoms. All Ni–In bond lengths are 2.71 Å. In is bonded in a 12-coordinate geometry to six equivalent Ce and four 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:
1196945
Report Number(s):
mp-21492
Resource Relation:
Related Information: https://materialsproject.org/citing
Country of Publication:
United States
Language:
English

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