Information card for entry 4001846

Structure parameters

• Formula: Fe Li O4 P
• Calculated formula: Fe Li1.1 O4.126 P
• Title of publication: Reciprocal Salt Flux Growth of LiFePO4Single Crystals with Controlled Defect Concentrations
• Authors of publication: Janssen, Yuri; Santhanagopalan, Dhamodaran; Qian, Danna; Chi, Miaofang; Wang, Xiaoping; Hoffmann, Christina; Meng, Ying Shirley; Khalifah, Peter G.
• Journal of publication: Chemistry of Materials
• Year of publication: 2013
• Journal volume: 25
• Journal issue: 22
• Pages of publication: 4574
• a: 10.336 ± 0.0002 Å
• b: 6.006 ± 0.0003 Å
• c: 4.6932 ± 0.0005 Å
• α: 90°
• β: 90°
• γ: 90°
• Cell volume: 291.34 ± 0.03 ų
• Cell temperature: 293 K
• Ambient diffraction temperature: 293 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 for all reflections: 0.0189
• Residual factor for significantly intense reflections: 0.0179
• Weighted residual factors for significantly intense reflections: 0.0472
• Weighted residual factors for all reflections included in the refinement: 0.0476
• Goodness-of-fit parameter for significantly intense reflections: 1.7
• Goodness-of-fit parameter for all reflections included in the refinement: 1.68
• Diffraction radiation probe: x-ray
• Diffraction radiation wavelength: 0.7107 Å
• Diffraction radiation type: MoKα
• Has coordinates: Yes
• Has disorder: No
• Has Fobs: No