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Title: Materials Data on ScIr2 by Materials Project

Dataset ·
DOI:https://doi.org/10.17188/1198838· OSTI ID:1198838

ScIr2 is Cubic Laves structured and crystallizes in the cubic Fd-3m space group. The structure is three-dimensional. Sc is bonded in a 12-coordinate geometry to twelve equivalent Ir atoms. All Sc–Ir bond lengths are 3.07 Å. Ir is bonded to six equivalent Sc and six equivalent Ir atoms to form a mixture of edge, corner, and face-sharing IrSc6Ir6 cuboctahedra. All Ir–Ir bond lengths are 2.62 Å.

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:
1198838
Report Number(s):
mp-2263
Resource Relation:
Related Information: https://materialsproject.org/citing
Country of Publication:
United States
Language:
English

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