Information card for entry 2103044

Structure parameters

• Formula: Cs1.625 Lu0.625 O12 P3 Zr1.375
• Calculated formula: Cs1.6265 Lu0.6257 O12 P3 Zr1.3742
• Title of publication: Equilibrium langbeinite-related phosphates Cs~1+<i>x~</i>Ln~<i>x~</i>Zr~2{-~<i>x</i>}(PO~4~)~3~ (Ln = Sm‒Lu) in the melted systems Cs~2~O‒P~2~O~5~‒LnF~3~‒ZrF~4~
• Authors of publication: Ogorodnyk, Ivan V.; Baumer, Vyacheslav N.; Zatovsky, Igor V.; Slobodyanik, Nikolay S.; Shishkin, Oleg V.; Domasevitch, Konstantin V.
• Journal of publication: Acta Crystallographica Section B
• Year of publication: 2007
• Journal volume: 63
• Journal issue: 6
• Pages of publication: 819 - 827
• a: 10.38651 ± 0.00017 Å
• b: 10.38651 ± 0.00017 Å
• c: 10.38651 ± 0.00017 Å
• α: 90°
• β: 90°
• γ: 90°
• Cell volume: 1120.49 ± 0.03 ų
• Cell temperature: 293 ± 2 K
• Ambient diffraction temperature: 293 ± 2 K
• Number of distinct elements: 5
• Space group number: 198
• Hermann-Mauguin space group symbol: P 21 3
• Hall space group symbol: P 2ac 2ab 3
• Residual factor for all reflections: 0.018
• Residual factor for significantly intense reflections: 0.0161
• Weighted residual factors for significantly intense reflections: 0.0327
• Weighted residual factors for all reflections included in the refinement: 0.033
• Goodness-of-fit parameter for all reflections included in the refinement: 1.088
• Diffraction radiation wavelength: 0.71073 Å
• Diffraction radiation type: MoKα
• Has coordinates: Yes
• Has disorder: No
• Has Fobs: Yes