Information card for entry 2108695

Structure parameters

• Common name: Neodymium calcium ferrite
• Chemical name: Neodymium calcium iron oxide
• Formula: Ca0.4 Fe Nd0.6 O3
• Calculated formula: Ca0.396764 Fe Nd0.603236 O3
• Title of publication: Ca-doped rare earth perovskite materials for tailored exsolution of metal nanoparticles
• Authors of publication: Lindenthal, Lorenz; Ruh, Thomas; Rameshan, Raffael; Summerer, Harald; Nenning, Andreas; Herzig, Christopher; Löffler, Stefan; Limbeck, Andreas; Opitz, Alexander Karl; Blaha, Peter; Rameshan, Christoph
• Journal of publication: Acta Crystallographica Section B
• Year of publication: 2020
• Journal volume: 76
• Journal issue: 6
• a: 5.533425 Å
• b: 7.725984 Å
• c: 5.448728 Å
• α: 90°
• β: 90°
• γ: 90°
• Cell volume: 232.939 ų
• Cell temperature: 295 K
• Ambient diffraction temperature: 295 K
• Number of distinct elements: 4
• Space group number: 62
• Hermann-Mauguin space group symbol: P n m a
• Hall space group symbol: -P 2ac 2n
• Residual factor R(I) for significantly intense reflections: 0.0111142
• Goodness-of-fit parameter for all reflections: 1.17277
• Method of determination: powder diffraction
• Diffraction radiation probe: x-ray
• Diffraction radiation wavelength: 1.5406 Å
• Diffraction radiation type: CuKα~1+2~
• Has coordinates: Yes
• Has disorder: No
• Has Fobs: No