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Information card for entry 2312688
Preview
| Coordinates | 2312688.cif |
|---|---|
| Structure factors | 2312688.hkl |
| Original IUCr paper | HTML |
| Common name | barium yttrium aluminum oxide |
|---|---|
| Formula | Al4 Ba6 O15 Y2 |
| Calculated formula | Al4 Ba6 O15 Y2 |
| Title of publication | Perovskite-related structures of Ba<sub>2</sub>YAlO<sub>5</sub> and the β and α phases of Ba<sub>6</sub>Y<sub>2</sub>Al<sub>4</sub>O<sub>15</sub> containing AlO<sub>4</sub> tetrahedra. |
| Authors of publication | Simura, Rayko; Suzuki, Yamato; Yamane, Hisanori |
| Journal of publication | Acta crystallographica. Section C, Structural chemistry |
| Year of publication | 2023 |
| Journal volume | 79 |
| Journal issue | Pt 11 |
| Pages of publication | 464 - 471 |
| a | 7.831 ± 0.0002 Å |
| b | 5.899 ± 0.0002 Å |
| c | 18.3344 ± 0.0006 Å |
| α | 90° |
| β | 91.6065 ± 0.0011° |
| γ | 90° |
| Cell volume | 846.63 ± 0.05 Å3 |
| Cell temperature | 300 ± 2 K |
| Ambient diffraction temperature | 300 ± 2 K |
| Number of distinct elements | 4 |
| Space group number | 13 |
| Hermann-Mauguin space group symbol | P 1 2/c 1 |
| Hall space group symbol | -P 2yc |
| Residual factor for all reflections | 0.0404 |
| Residual factor for significantly intense reflections | 0.0352 |
| Weighted residual factors for significantly intense reflections | 0.0779 |
| Weighted residual factors for all reflections included in the refinement | 0.0803 |
| Goodness-of-fit parameter for all reflections included in the refinement | 1.135 |
| Diffraction radiation wavelength | 0.71073 Å |
| Diffraction radiation type | MoKα |
| Has coordinates | Yes |
| Has disorder | No |
| Has Fobs | Yes |
| Revision | Date | Message | Files |
|---|---|---|---|
| 295819 (current) | 2024-11-07 | cif/ hkl/ Adding structures of 2312686, 2312687, 2312688 via cif-deposit CGI script. |
2312688.cif 2312688.hkl |
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