Information card for entry 2312751

Structure parameters

• Formula: Fe0.16 Li0.16 Mg0.69 O3 Si
• Calculated formula: Fe0.15675 Li0.15675 Mg0.6865 O3 Si
• Title of publication: Crystal structure and doping in synthetic enstatite: an analysis of Li/Fe³⁺-doped single-crystal samples.
• Authors of publication: Ballirano, Paolo; Celata, Beatrice; Pacella, Alessandro; Bloise, Andrea; Bosi, Ferdinando
• Journal of publication: Acta crystallographica Section B, Structural science, crystal engineering and materials
• Year of publication: 2025
• Journal volume: 81
• Journal issue: 1
• a: 18.1718 ± 0.0004 Å
• b: 8.7706 ± 0.0002 Å
• c: 5.1992 ± 0.0001 Å
• α: 90°
• β: 90°
• γ: 90°
• Cell volume: 828.64 ± 0.03 ų
• Cell temperature: 293 ± 2 K
• Ambient diffraction temperature: 293 ± 2 K
• Number of distinct elements: 5
• Space group number: 61
• Hermann-Mauguin space group symbol: P b c a
• Hall space group symbol: -P 2ac 2ab
• Residual factor for all reflections: 0.0212
• Residual factor for significantly intense reflections: 0.0188
• Weighted residual factors for significantly intense reflections: 0.0399
• Weighted residual factors for all reflections included in the refinement: 0.0406
• Goodness-of-fit parameter for all reflections included in the refinement: 1.168
• Diffraction radiation wavelength: 0.71073 Å
• Diffraction radiation type: MoKα
• Has coordinates: Yes
• Has disorder: No
• Has Fobs: No