Information card for entry 4002600

Structure parameters

• Formula: Ba Co2 Gd O5.389
• Calculated formula: Ba Co2 Gd O5.3889
• Title of publication: Structural Evolution of GdBaCo2O5+δ(δ = 7/18) at Elevated Temperatures
• Authors of publication: Ishizawa, Nobuo; Asaka, Toru; Kudo, Tatsunari; Fukuda, Koichiro; Yasuhara, Akira; Abe, Nobuyuki; Arima, Taka-hisa
• Journal of publication: Chemistry of Materials
• Year of publication: 2014
• Pages of publication: 141114094038007
• a: 3.8764 ± 0.0005 Å
• b: 7.8337 ± 0.0008 Å
• c: 7.5594 ± 0.0008 Å
• α: 90°
• β: 90°
• γ: 90°
• Cell volume: 229.55 ± 0.04 ų
• Cell temperature: 404 K
• Ambient diffraction temperature: 404 K
• Number of distinct elements: 4
• Space group number: 47
• Hermann-Mauguin space group symbol: P m m m
• Hall space group symbol: -P 2 2
• Residual factor for all reflections: 0.0437
• Residual factor for significantly intense reflections: 0.0388
• Weighted residual factors for significantly intense reflections: 0.0479
• Weighted residual factors for all reflections included in the refinement: 0.0486
• Goodness-of-fit parameter for significantly intense reflections: 2.56
• Goodness-of-fit parameter for all reflections included in the refinement: 2.34
• Diffraction radiation probe: x-ray
• Diffraction radiation wavelength: 0.71069 Å
• Diffraction radiation type: MoKα
• Has coordinates: Yes
• Has disorder: No
• Has Fobs: No