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Information card for entry 7250317
Preview
| Coordinates | 7250317.cif |
|---|---|
| Original paper (by DOI) | HTML |
| Formula | Al3.43 Na8.72 Ni2.58 O32 P8 |
|---|---|
| Calculated formula | Al3.42 Na8.72 Ni2.58 O32 P8 |
| Title of publication | Na4.3Ni1.3Al1.7(PO4)3 structure transformation from stuffed α-CrPO4 type, driven by the incorporation of Na; magnetism and ionic migration. |
| Authors of publication | Yakubovich, Olga Vsevolodovna; Kiriukhina, Galina; Manokhina, Elizaveta; Volkov, Anatoly; Dimitrova, Olga; Shvanskaya, Larisa Victorovna; Vasiliev, Alexander |
| Journal of publication | CrystEngComm |
| Year of publication | 2025 |
| a | 6.3892 ± 0.0004 Å |
| b | 19.6003 ± 0.0015 Å |
| c | 10.357 ± 0.0006 Å |
| α | 90° |
| β | 90° |
| γ | 90° |
| Cell volume | 1297.01 ± 0.15 Å3 |
| Cell temperature | 293 ± 2 K |
| Ambient diffraction temperature | 293 ± 2 K |
| Number of distinct elements | 5 |
| Space group number | 66 |
| Hermann-Mauguin space group symbol | C c c m |
| Hall space group symbol | -C 2 2c |
| Residual factor for all reflections | 0.0632 |
| Residual factor for significantly intense reflections | 0.0551 |
| Weighted residual factors for significantly intense reflections | 0.1182 |
| Weighted residual factors for all reflections included in the refinement | 0.121 |
| Goodness-of-fit parameter for all reflections included in the refinement | 1.23 |
| Diffraction radiation wavelength | 0.71073 Å |
| Diffraction radiation type | MoKα |
| Has coordinates | Yes |
| Has disorder | No |
| Has Fobs | No |
| Revision | Date | Message | Files |
|---|---|---|---|
| 299376 (current) | 2025-04-24 | cif/ Adding structures of 7250317 via cif-deposit CGI script. |
7250317.cif |
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Users of the data should acknowledge the original authors of the
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