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Information card for entry 1562044
Preview
| Coordinates | 1562044.cif |
|---|---|
| Original paper (by DOI) | HTML |
| Formula | B2 Ba Hf O6 |
|---|---|
| Calculated formula | B2 Ba Hf O6 |
| Title of publication | Growth and characterization of acentric BaHf(BO3)2 and BaZr(BO3)2 |
| Authors of publication | Mączka, Mirosław; Szymborska-Małek, Katarzyna; Gągor, Anna; Majchrowski, Andrzej |
| Journal of publication | Journal of Solid State Chemistry |
| Year of publication | 2015 |
| Journal volume | 225 |
| Pages of publication | 330 - 334 |
| a | 5.154 ± 0.0004 Å |
| b | 5.154 ± 0.0004 Å |
| c | 33.901 ± 0.003 Å |
| α | 90° |
| β | 90° |
| γ | 120° |
| Cell volume | 779.89 ± 0.11 Å3 |
| Cell temperature | 295 ± 2 K |
| Ambient diffraction temperature | 295 ± 2 K |
| Number of distinct elements | 4 |
| Space group number | 161 |
| Hermann-Mauguin space group symbol | R 3 c :H |
| Hall space group symbol | R 3 -2"c |
| Residual factor for all reflections | 0.0214 |
| Residual factor for significantly intense reflections | 0.0101 |
| Weighted residual factors for significantly intense reflections | 0.0169 |
| Weighted residual factors for all reflections included in the refinement | 0.0178 |
| Goodness-of-fit parameter for all reflections included in the refinement | 0.869 |
| Diffraction radiation wavelength | 0.71073 Å |
| Diffraction radiation type | MoKα |
| Has coordinates | Yes |
| Has disorder | No |
| Has Fobs | No |
| Revision | Date | Message | Files |
|---|---|---|---|
| 264468 (current) | 2021-04-23 | cif/ Adding structures of 1562044 via cif-deposit CGI script. |
1562044.cif |
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Users of the data should acknowledge the original authors of the
structural data.