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Information card for entry 2206576
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| Coordinates | 2206576.cif |
|---|---|
| Original IUCr paper | HTML |
| External links | AMCSD |
| Chemical name | lanthanum aluminium trioxide |
|---|---|
| Formula | Al La O3 |
| Calculated formula | Al La O3 |
| Title of publication | Cubic phase of single-crystal LaAlO~3~ perovskite synthesized at 4.5 GPa and 1273 K |
| Authors of publication | Nakatsuka, Akihiko; Ohtaka, Osamu; Arima, Hiroshi; Nakayama, Noriaki; Mizota, Tadato |
| Journal of publication | Acta Crystallographica, Section E |
| Year of publication | 2005 |
| Journal volume | 61 |
| Journal issue | 8 |
| Pages of publication | i148 - i150 |
| a | 3.7913 ± 0.0002 Å |
| b | 3.7913 ± 0.0002 Å |
| c | 3.7913 ± 0.0002 Å |
| α | 90° |
| β | 90° |
| γ | 90° |
| Cell volume | 54.496 ± 0.005 Å3 |
| Cell temperature | 296 K |
| Sample thermal history | synthesized at 4.5 GPa and 1273 K |
| Sample pressure history | synthesized at 4.5 GPa |
| Number of distinct elements | 3 |
| Space group number | 221 |
| Hermann-Mauguin space group symbol | P m -3 m |
| Hall space group symbol | -P 4 2 3 |
| Residual factor for significantly intense reflections | 0.0081 |
| Weighted residual factors for all reflections included in the refinement | 0.0101 |
| Goodness-of-fit parameter for all reflections included in the refinement | 1.07 |
| Diffraction radiation wavelength | 0.71069 Å |
| Diffraction radiation type | MoKα |
| Has coordinates | Yes |
| Has disorder | No |
| Has Fobs | No |
| Revision | Date | Message | Files |
|---|---|---|---|
| 282068 (current) | 2023-03-26 | cod/ (saulius@tasmanijos-velnias) Adding the '_cod_related_entry_...' loop to those COD AMCSD entries that lacked it, and adding the related AMCSD database ID to this loop. |
2206576.cif |
| 282053 | 2023-03-24 | cod/ (saulius@tasmanijos-velnias) Updating the existing COD records from the recent AMCSD downloads: - Adding AMCSD IDs to those COD records that exacly matched the AMCSD structures (comparing unit cells, space groups, coordinates and measurement conditions) but did not yet have the AMCSD ID; - Adding new mineral names, compound sources, measurement conditions (when those were missing) and other informations from the AMCSD CIFs. |
2206576.cif |
| 277836 | 2022-09-14 | cif/ Added space group information derived from the space group operation list using the 'cif_filter' program. |
2206576.cif |
| 277835 | 2022-09-14 | cif/ Reordered data items using the 'cif_filter' program to ensure that future changes to the file result in a minimal number of modified lines. |
2206576.cif |
| 176774 | 2016-02-20 | cif/2/ (antanas@kurmis) Replacing _[local]_cod_* tags with their equivalents from the COD CIF dictionary in multiple entries in subrange 2/20. |
2206576.cif |
| 91933 | 2013-12-28 | cif/ (saulius@koala.ibt.lt) Adding DOIs that could be assigned unambiguously to the range 2x CIFs. |
2206576.cif |
| 26848 | 2011-09-28 | cif/2/, hkl/2/, html/ Reorganising CIFs of the range 2* into the "prefix-directory" tree. |
2206576.cif |
| 966 | 2010-01-30 | cif/ Adding _cod_database_code tags to all COD entries. Adding tag description to the cif_cod.dic dictionary so that COD entries can be validated. |
2206576.cif |
| 950 | 2010-01-20 | cif/ Generating sample thermal history and and pressure history descriptions from titles or material preparation reports; to be used for distinguishing similar structures measured after different treatment. |
2206576.cif |
| 326 | 2008-04-03 | Adding all Acta Cryst. B, C, and E missing retrospective CIF files up to 2008 February, generated from the files that were automatically downloaded from the IUCr site. |
2206576.cif |
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Users of the data should acknowledge the original authors of the
structural data.