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Information card for entry 2300448
Preview
Coordinates | 2300448.cif |
---|---|
Structure factors | 2300448.hkl |
Original paper (by DOI) | HTML |
Chemical name | aluminium oxide |
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Mineral name | corundum |
Formula | Al2 O3 |
Calculated formula | Al2 O3 |
Title of publication | Simultaneous determination of several crystal structures from powder mixtures: the combination of powder X-ray diffraction, band-target entropy minimization and Rietveld methods |
Authors of publication | Schreyer, Martin; Guo, Liangfeng; Thirunahari, Satyanarayana; Gao, Feng; Garland, Marc |
Journal of publication | Journal of Applied Crystallography |
Year of publication | 2014 |
Journal volume | 47 |
Journal issue | 2 |
Pages of publication | 659 - 667 |
a | 4.758152 ± 0.000042 Å |
b | 4.758152 ± 0.000042 Å |
c | 12.9897 ± 0.00018 Å |
α | 90° |
β | 90° |
γ | 120° |
Cell volume | 254.687 ± 0.005 Å3 |
Cell temperature | 298 K |
Ambient diffraction temperature | 298 K |
Number of distinct elements | 2 |
Space group number | 167 |
Hermann-Mauguin space group symbol | R -3 c :H |
Hall space group symbol | -R 3 2"c |
Residual factor R(I) for significantly intense reflections | 0.018 |
Goodness-of-fit parameter for all reflections | 0.095 |
Method of determination | powder diffraction |
Diffraction radiation probe | x-ray |
Diffraction radiation wavelength | 1.5418 Å |
Diffraction radiation type | CuKα |
Has coordinates | Yes |
Has disorder | No |
Has Fobs | Yes |
Revision | Date | Message | Files |
---|---|---|---|
201211 (current) | 2017-09-25 | cif/ Moving the _chemical_name_systematic data item out of the looped context in entries 2015347, 2203896, 2204946, 2208886, 2211649, 2220833, 2300298, 2300448, 4301914, 4301915, 4301916, 4311114, 7004590. |
2300448.cif 2300448.hkl |
181918 | 2016-04-06 | hkl/2/30/ (antanas@echidna) Adding IUCr specific svn headers to multiple entries in subrange 2/30/04 |
2300448.cif 2300448.hkl |
181326 | 2016-04-03 | hkl/2/ (antanas@echidna.ibt.lt) Replacing _[local]_cod_* tags with their equivalents from the COD CIF dictionary in multiple entries in subrange 2/30. |
2300448.cif 2300448.hkl |
176809 | 2016-02-21 | cif/ (antanas@kurmis) Replacing _[local]_cod_* tags with their equivalents from the COD CIF dictionary in multiple entries in range 2. |
2300448.cif 2300448.hkl |
108860 | 2014-04-03 | cif/ hkl/ Adding structures of 2300448, 2300449, 2300450, 2300451, 2300452, 2300453, 2300454, 2300455, 2300456 via cif-deposit CGI script. |
2300448.cif 2300448.hkl |
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Users of the data should acknowledge the original authors of the
structural data.