Information card for entry 2312939

Structure parameters

• Chemical name: Dicalcium sodium dimanganese trivanadate
• Formula: Ca2 Mn2 Na O12 V3
• Calculated formula: Ca2.0001 Mn2 Na0.9999 O12 V3
• Title of publication: Peculiarity of atomic displacements in garnets discovered through a single-crystal X-ray diffraction study of the Na-bearing vanadate garnet series.
• Authors of publication: Nakatsuka, Akihiko; Miyake, Yuya; Shimokawa, Mami; Iishi, Kazuake; Tokuda, Makoto; Yoshiasa, Akira
• Journal of publication: Acta crystallographica. Section C, Structural chemistry
• Year of publication: 2026
• Journal volume: 82
• Journal issue: 9
• Pages of publication: 576 - 587
• a: 12.5679 ± 0.0008 Å
• b: 12.5679 ± 0.0008 Å
• c: 12.5679 ± 0.0008 Å
• α: 90°
• β: 90°
• γ: 90°
• Cell volume: 1985.1 ± 0.2 ų
• Cell temperature: 296 K
• Ambient diffraction temperature: 296 K
• Number of distinct elements: 5
• Space group number: 230
• Hermann-Mauguin space group symbol: I a -3 d
• Hall space group symbol: -I 4bd 2c 3
• Residual factor for significantly intense reflections: 0.0155
• Weighted residual factors for all reflections included in the refinement: 0.0151
• Goodness-of-fit parameter for all reflections included in the refinement: 1.2149
• Diffraction radiation wavelength: 0.71069 Å
• Diffraction radiation type: MoKα
• Has coordinates: Yes
• Has disorder: No
• Has Fobs: Yes