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Information card for entry 2300497
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| Coordinates | 2300497.cif |
|---|---|
| Structure factors | 2300497.hkl |
| Original paper (by DOI) | HTML |
| Common name | germanium bismuth telluride |
|---|---|
| Formula | Bi1.09 Ge2.37 Te4 |
| Calculated formula | Bi1.088 Ge2.368 Te4 |
| Title of publication | Real structure of Ge4Bi2Te7: refinement on diffuse scattering data with the 3D-ΔPDF method |
| Authors of publication | Urban, Philipp; Simonov, Arkadiy; Weber, Thomas; Oeckler, Oliver |
| Journal of publication | Journal of Applied Crystallography |
| Year of publication | 2015 |
| Journal volume | 48 |
| Journal issue | 1 |
| Pages of publication | 200 |
| a | 6.055 ± 0.002 Å |
| b | 6.055 ± 0.002 Å |
| c | 6.055 ± 0.002 Å |
| α | 90° |
| β | 90° |
| γ | 90° |
| Cell volume | 221.99 ± 0.13 Å3 |
| Cell temperature | 293 ± 2 K |
| Ambient diffraction temperature | 293 ± 2 K |
| Number of distinct elements | 3 |
| Space group number | 225 |
| Hermann-Mauguin space group symbol | F m -3 m |
| Hall space group symbol | -F 4 2 3 |
| Residual factor for all reflections | 0.0181 |
| Residual factor for significantly intense reflections | 0.0156 |
| Weighted residual factors for significantly intense reflections | 0.0183 |
| Weighted residual factors for all reflections included in the refinement | 0.0191 |
| Goodness-of-fit parameter for all reflections included in the refinement | 1.35 |
| Diffraction radiation probe | x-ray |
| Diffraction radiation wavelength | 0.47686 Å |
| Diffraction radiation type | synchrotron |
| Has coordinates | Yes |
| Has disorder | No |
| Has Fobs | Yes |
| Revision | Date | Message | Files |
|---|---|---|---|
| 211332 (current) | 2018-10-05 | cif/ Fixing enumeration values for CIF data items _atom_sites_solution_* using cif_fix_values. Data item relocations and exclusion of CIF comment lines might have occurred due to the usage of cif_filter. |
2300497.cif 2300497.hkl |
| 209426 | 2018-08-07 | cif/2/30/04/ Correcting the way multiline values are recorded in the _atom_type loop in entry 2300497. |
2300497.cif 2300497.hkl |
| 181918 | 2016-04-06 | hkl/2/30/ (antanas@echidna) Adding IUCr specific svn headers to multiple entries in subrange 2/30/04 |
2300497.cif 2300497.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. |
2300497.cif 2300497.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. |
2300497.cif 2300497.hkl |
| 130235 | 2015-01-31 | cif/ hkl/ Adding structures of 2300497 via cif-deposit CGI script. |
2300497.cif 2300497.hkl |
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Users of the data should acknowledge the original authors of the
structural data.