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Title: Materials Data on CrIr3 by Materials Project

Dataset ·
DOI:https://doi.org/10.17188/1188560· OSTI ID:1188560

Ir3Cr is Uranium Silicide structured and crystallizes in the cubic Pm-3m space group. The structure is three-dimensional. Cr is bonded to twelve equivalent Ir atoms to form CrIr12 cuboctahedra that share corners with twelve equivalent CrIr12 cuboctahedra, edges with twenty-four equivalent IrCr4Ir8 cuboctahedra, faces with six equivalent CrIr12 cuboctahedra, and faces with twelve equivalent IrCr4Ir8 cuboctahedra. All Cr–Ir bond lengths are 2.70 Å. Ir is bonded to four equivalent Cr and eight equivalent Ir atoms to form distorted IrCr4Ir8 cuboctahedra that share corners with twelve equivalent IrCr4Ir8 cuboctahedra, edges with eight equivalent CrIr12 cuboctahedra, edges with sixteen equivalent IrCr4Ir8 cuboctahedra, faces with four equivalent CrIr12 cuboctahedra, and faces with fourteen equivalent IrCr4Ir8 cuboctahedra. All Ir–Ir bond lengths are 2.70 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:
1188560
Report Number(s):
mp-12083
Resource Relation:
Related Information: https://materialsproject.org/citing
Country of Publication:
United States
Language:
English

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