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Information card for entry 1563384
Preview
| Coordinates | 1563384.cif |
|---|---|
| Original paper (by DOI) | HTML |
| Formula | Al3 B4 Bi Cd3 O15 |
|---|---|
| Calculated formula | Al3 B4 Bi Cd3 O15 |
| Title of publication | Synthesis, crystal structure, spectrum properties, and electronic structure of a novel non-centrosymmetric borate, BiCd3(AlO)3(BO3)4 |
| Authors of publication | Chen, Xuean; Yin, Hui; Chang, Xinan; Zang, Hegui; Xiao, Weiqiang |
| Journal of publication | Journal of Solid State Chemistry |
| Year of publication | 2010 |
| Journal volume | 183 |
| Journal issue | 12 |
| Pages of publication | 2910 - 2916 |
| a | 10.3919 ± 0.0015 Å |
| b | 10.3919 ± 0.0015 Å |
| c | 5.7215 ± 0.0011 Å |
| α | 90° |
| β | 90° |
| γ | 120° |
| Cell volume | 535.09 ± 0.15 Å3 |
| Cell temperature | 290 K |
| Ambient diffraction temperature | 290 K |
| Number of distinct elements | 5 |
| Space group number | 173 |
| Hermann-Mauguin space group symbol | P 63 |
| Hall space group symbol | P 6c |
| Residual factor for all reflections | 0.0319 |
| Residual factor for significantly intense reflections | 0.026 |
| Weighted residual factors for significantly intense reflections | 0.064 |
| Weighted residual factors for all reflections included in the refinement | 0.0667 |
| Goodness-of-fit parameter for all reflections included in the refinement | 1.064 |
| Diffraction radiation wavelength | 0.71073 Å |
| Diffraction radiation type | MoKα |
| Has coordinates | Yes |
| Has disorder | No |
| Has Fobs | No |
| Revision | Date | Message | Files |
|---|---|---|---|
| 266426 (current) | 2021-06-14 | cif/ Adding structures of 1563384 via cif-deposit CGI script. |
1563384.cif |
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Users of the data should acknowledge the original authors of the
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