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Title: Materials Data on TaIr3 by Materials Project

Dataset ·
DOI:https://doi.org/10.17188/1201180· OSTI ID:1201180

Ir3Ta is Uranium Silicide structured and crystallizes in the cubic Pm-3m space group. The structure is three-dimensional. Ta is bonded to twelve equivalent Ir atoms to form TaIr12 cuboctahedra that share corners with twelve equivalent TaIr12 cuboctahedra, edges with twenty-four equivalent IrTa4Ir8 cuboctahedra, faces with six equivalent TaIr12 cuboctahedra, and faces with twelve equivalent IrTa4Ir8 cuboctahedra. All Ta–Ir bond lengths are 2.78 Å. Ir is bonded to four equivalent Ta and eight equivalent Ir atoms to form distorted IrTa4Ir8 cuboctahedra that share corners with twelve equivalent IrTa4Ir8 cuboctahedra, edges with eight equivalent TaIr12 cuboctahedra, edges with sixteen equivalent IrTa4Ir8 cuboctahedra, faces with four equivalent TaIr12 cuboctahedra, and faces with fourteen equivalent IrTa4Ir8 cuboctahedra. All Ir–Ir bond lengths are 2.78 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:
1201180
Report Number(s):
mp-265
Resource Relation:
Related Information: https://materialsproject.org/citing
Country of Publication:
United States
Language:
English

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