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Materials Data on IrO2 by Materials Project

Dataset ·
DOI:https://doi.org/10.17188/1337314· OSTI ID:1337314
IrO2 is beta Vanadium nitride-like structured and crystallizes in the tetragonal I4_1/amd space group. The structure is three-dimensional. Ir4+ is bonded to six equivalent O2- atoms to form a mixture of edge and corner-sharing IrO6 octahedra. The corner-sharing octahedral tilt angles are 23°. There are four shorter (2.00 Å) and two longer (2.05 Å) Ir–O bond lengths. O2- is bonded in a distorted T-shaped geometry to three equivalent Ir4+ 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:
1337314
Report Number(s):
mp-1014261
Country of Publication:
United States
Language:
English

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