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- W2076281624 abstract "Abstract The X-ray crystal structure of BaIrO3 has been determined using a four-circle diffractometer and a small untwinned crystal grown in a molten BaCl2 flux. The single crystal studies indicated the space group C2/m with unit cell parameters: a = 10.0052(4) A , b = 5.7514(2) A , c = 15.1742(7) A , and β = 103.274(5) °. The crystal structure of BaIrO3 is similar to that of the nine-layer BaRuO3, but with a monoclinic distortion. It is also closely related to the structure recently reported for the compound Ba7Ir6O19. The structure consists of three face-shared IrO6 octahedra that are linked by terminal vertices to other trimeric clusters along the c-axis. The Ba atoms mostly remain in 12-coordinated sites, these sites are similar to those found in other hexagonal-layer perovskite polytypes. The original 18R structure, observed on multi-twinned crystals, is only an approximate pseudo-structure, and this model did not yield a suitable refinement to the actual structure since single crystals lack the three-fold axis. The stoichiometry was determined from chemical analysis, and this was further supported by the refinement of population and thermal parameters." @default.
- W2076281624 created "2016-06-24" @default.
- W2076281624 creator A5006576166 @default.
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- W2076281624 date "2010-08-22" @default.
- W2076281624 modified "2023-09-23" @default.
- W2076281624 title "ChemInform Abstract: The Crystal Structure of BaIrO3." @default.
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- W2076281624 doi "https://doi.org/10.1002/chin.199136003" @default.
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