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Information card for entry 4002590
Preview
| Coordinates | 4002590.cif |
|---|---|
| Original paper (by DOI) | HTML |
| Formula | Mn Na O2 |
|---|---|
| Calculated formula | Mn Na O |
| Title of publication | Multiple Twinning As a Structure Directing Mechanism in Layered Rock-Salt-Type Oxides: NaMnO2Polymorphism, Redox Potentials, and Magnetism |
| Authors of publication | Abakumov, Artem M.; Tsirlin, Alexander A.; Bakaimi, Ioanna; Van Tendeloo, Gustaaf; Lappas, Alexandros |
| Journal of publication | Chemistry of Materials |
| Year of publication | 2014 |
| Pages of publication | 140509152558002 |
| a | 3.15603 ± 0.00009 Å |
| b | 2.85523 ± 0.0001 Å |
| c | 4.7799 ± 0.0002 Å |
| α | 90° |
| β | 91.4521° |
| γ | 90° |
| Cell volume | 43.059 ± 0.003 Å3 |
| Cell temperature | 293 K |
| Ambient diffraction temperature | 293 K |
| Number of distinct elements | 3 |
| Space group number | 12 |
| Hermann-Mauguin space group symbol | I 1 2/m 1 |
| Hall space group symbol | -I 2y |
| Residual factor for all reflections | 0.0228 |
| Residual factor for significantly intense reflections | 0.0214 |
| Weighted residual factors for all reflections | 0.0222 |
| Weighted residual factors for significantly intense reflections | 0.0221 |
| Goodness-of-fit parameter for all reflections | 1.38 |
| Method of determination | powder diffraction |
| Diffraction radiation probe | neutron |
| Diffraction radiation wavelength | 2.0787 Å |
| Has coordinates | Yes |
| Has disorder | No |
| Has Fobs | No |
| Revision | Date | Message | Files |
|---|---|---|---|
| 288070 (current) | 2023-12-06 | cif/ Corrected misspelt data names in multiple entries using the 'cif_correct_tags' program and a data names replacement file from cod-tools revision 9818. This change affected only the misspelt variants of the '_atom_site_site_symmetry_multiplicity' and '_atom_site_refinement_flag' data names. |
4002590.cif |
| 209177 | 2018-07-21 | cif/ Updating space group information in entries 1534361, 1536345, 1536349, 1536353, 1536800, 1537570, 2020150, 2020151, 2107011, 2107129, 2107130, 2107227, 2107229, 2310780, 2310781, 2310782, 2310783, 2310784, 2310849, 4002590, 4344308. |
4002590.cif |
| 176429 | 2016-02-13 | cif/ (antanas@kurmis) Replacing _cod_chemical_formula_sum_orig tag with _cod_original_formula_sum tag in multiple entries since the replaced tag is deprecated according to the COD CIF dictionary. |
4002590.cif |
| 160946 | 2015-10-07 | cif/ Adding structures of 4002590 via cif-deposit CGI script. |
4002590.cif |
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Users of the data should acknowledge the original authors of the
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