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Information card for entry 4335733
Preview
| Coordinates | 4335733.cif |
|---|---|
| Original paper (by DOI) | HTML |
| Formula | Co2.5 Zn2.5 |
|---|---|
| Calculated formula | Co2.51 Zn2.49 |
| Title of publication | β-Mn-Type Co8+xZn12-x as a Defect Cubic Laves Phase: Site Preferences, Magnetism, and Electronic Structure |
| Authors of publication | Weiwei Xie; Srinivasa Thimmaiah; Jagat Lamsal; Jing Liu; Thomas W. Heitmann; Dante Quirinale; Alan I. Goldman; Vitalij Pecharsky; Gordon J. Miller |
| Journal of publication | Inorganic Chemistry |
| Year of publication | 2013 |
| Journal volume | 52 |
| Pages of publication | 9399 - 9408 |
| a | 6.3358 ± 0.0014 Å |
| b | 6.3358 ± 0.0014 Å |
| c | 6.3358 ± 0.0014 Å |
| α | 90° |
| β | 90° |
| γ | 90° |
| Cell volume | 254.33 ± 0.1 Å3 |
| Cell temperature | 293 ± 2 K |
| Ambient diffraction temperature | 293 ± 2 K |
| Number of distinct elements | 2 |
| Space group number | 213 |
| Hermann-Mauguin space group symbol | P 41 3 2 |
| Hall space group symbol | P 4bd 2ab 3 |
| Residual factor for all reflections | 0.0167 |
| Residual factor for significantly intense reflections | 0.0163 |
| Weighted residual factors for significantly intense reflections | 0.028 |
| Weighted residual factors for all reflections included in the refinement | 0.028 |
| Goodness-of-fit parameter for all reflections included in the refinement | 1.18 |
| Diffraction radiation wavelength | 0.71073 Å |
| Diffraction radiation type | MoKα |
| Has coordinates | Yes |
| Has disorder | No |
| Has Fobs | No |
| Revision | Date | Message | Files |
|---|---|---|---|
| 176467 (current) | 2016-02-16 | cif/ (antanas@kurmis) Replacing _[local]_cod_* tags with their equivalents from the COD CIF dictionary in multiple entries in range 4. |
4335733.cif |
| 130086 | 2015-01-23 | cod/ (robertas@burundukas) The 'cif_fix_values' program was applied to CIFs that have generated the validation messages containing tag '_exptl_crystal_density_meas'. 16946 CIFs had a values that were perceived as 'not measured' and they were changed to '?'. The total of 17089 CIFs was changed. Those that were not corrected by 'cif_fix_values' were reformatted by the parser (e.g. a doi tag was moved to another place). The processing command was: mysql -u cod_reader -h www.crystallography.net cod -e \ 'select distinct codid from validation \ where message like \ "%tag%_exptl_crystal_density_meas'\''%"' -NB \ | xargs -i sh -c 'cif_fix_values {} \ | cif_filter --add-cif-header {} \ | sponge {}' |
4335733.cif |
| 101685 | 2014-02-18 | cif/ Adding structures of 4335733 via cif-deposit CGI script. |
4335733.cif |
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Users of the data should acknowledge the original authors of the
structural data.