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Information card for entry 2108613
Preview
| Coordinates | 2108613.cif |
|---|---|
| Structure factors | 2108613.hkl |
| Original paper (by DOI) | HTML |
| Formula | Mg0.026 Mo0.974 O5.94 Pr2 |
|---|---|
| Calculated formula | Mg0.026 Mo0.974 O5.94 Pr2 |
| Title of publication | Synthesis, structure and properties of layered Pr~2~MoO~6~-based oxymolybdates doped with Mg |
| Authors of publication | Voronkova, Valentina I.; Antipin, Alexander M.; Sorokin, Timofei A.; Novikova, Nataliya E.; Kharitonova, Elena P.; Orlova, Ekaterina I.; Kvartalov, Vladimir B.; Presniakov, Mikhail Yu.; Bondarenko, Vladimir I.; Vasiliev, Alexander L.; Sorokina, Nataliya I. |
| Journal of publication | Acta Crystallographica Section B |
| Year of publication | 2020 |
| Journal volume | 76 |
| Journal issue | 3 |
| a | 5.6979 ± 0.0001 Å |
| b | 5.6979 ± 0.0001 Å |
| c | 31.7012 ± 0.0002 Å |
| α | 90° |
| β | 90° |
| γ | 90° |
| Cell volume | 1029.21 ± 0.03 Å3 |
| Cell temperature | 295 ± 0.1 K |
| Ambient diffraction temperature | 295 K |
| Number of distinct elements | 4 |
| Space group number | 120 |
| Hermann-Mauguin space group symbol | I -4 c 2 |
| Hall space group symbol | I -4 -2c |
| Residual factor for all reflections | 0.0361 |
| Residual factor for significantly intense reflections | 0.0114 |
| Weighted residual factors for significantly intense reflections | 0.0136 |
| Weighted residual factors for all reflections included in the refinement | 0.016 |
| Goodness-of-fit parameter for significantly intense reflections | 1.17 |
| Goodness-of-fit parameter for all reflections included in the refinement | 1 |
| Diffraction radiation probe | x-ray |
| Diffraction radiation wavelength | 0.71073 Å |
| Diffraction radiation type | MoKα |
| Has coordinates | Yes |
| Has disorder | No |
| Has Fobs | Yes |
| Revision | Date | Message | Files |
|---|---|---|---|
| 252309 (current) | 2020-05-23 | cif/ hkl/ Adding structures of 2108612, 2108613 via cif-deposit CGI script. |
2108613.cif 2108613.hkl |
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Users of the data should acknowledge the original authors of the
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