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Information card for entry 2104965
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| Coordinates | 2104965.cif |
|---|---|
| Structure factors | 2104965.hkl |
| Original IUCr paper | HTML |
| Common name | mayenite |
|---|---|
| Formula | Al14 Ca12 O33 |
| Calculated formula | Al14 Ca12 O33 |
| Title of publication | Determination of the local structure of a cage with an oxygen ion in Ca~12~Al~14~O~33~ |
| Authors of publication | Sakakura, Terutoshi; Tanaka, Kiyoaki; Takenaka, Yasuyuki; Matsuishi, Satoru; Hosono, Hideo; Kishimoto, Shunji |
| Journal of publication | Acta Crystallographica Section B |
| Year of publication | 2011 |
| Journal volume | 67 |
| Journal issue | 3 |
| Pages of publication | 193 - 204 |
| a | 11.989 ± 0.003 Å |
| b | 11.989 ± 0.003 Å |
| c | 11.989 ± 0.003 Å |
| α | 90° |
| β | 90° |
| γ | 90° |
| Cell volume | 1723.3 ± 0.7 Å3 |
| Cell temperature | 298 K |
| Ambient diffraction temperature | 298 K |
| Number of distinct elements | 3 |
| Space group number | 220 |
| Hermann-Mauguin space group symbol | I -4 3 d |
| Hall space group symbol | I -4bd 2c 3 |
| Residual factor for significantly intense reflections | 0.0161 |
| Weighted residual factors for all reflections included in the refinement | 0.024 |
| Goodness-of-fit parameter for all reflections included in the refinement | 1.089 |
| Diffraction radiation wavelength | 0.67954 Å |
| Diffraction radiation type | synchrotron |
| Has coordinates | Yes |
| Has disorder | No |
| Has Fobs | Yes |
Version history
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Users of the data should acknowledge the original authors of the
structural data.