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Information card for entry 4001596
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| Coordinates | 4001596.cif |
|---|---|
| Original paper (by DOI) | HTML |
| Common name | Chevrel phase |
|---|---|
| Chemical name | zinc dihydroxide divanadate dihydrate |
| Formula | Mg Mo6 S8 |
| Calculated formula | Mg0.99996 Mo6 S8 |
| Title of publication | Phase Diagram of Mg Insertion into Chevrel Phases, MgxMo6T8(T = S, Se). 1. Crystal Structure of the Sulfides |
| Authors of publication | Levi, E.; Lancry, E.; Mitelman, A.; Aurbach, D.; Ceder, G.; Morgan, D.; Isnard, O. |
| Journal of publication | Chemistry of Materials |
| Year of publication | 2006 |
| Journal volume | 18 |
| Journal issue | 23 |
| Pages of publication | 5492 |
| a | 9.4592714 ± 0.0000006 Å |
| b | 9.4592714 ± 0.0000006 Å |
| c | 10.5588446 ± 0.0000005 Å |
| α | 90° |
| β | 90° |
| γ | 120° |
| Cell volume | 818.206 ± 0.00008 Å3 |
| Cell temperature | 300 K |
| Ambient diffraction temperature | 300 K |
| Number of distinct elements | 3 |
| Space group number | 148 |
| Hermann-Mauguin space group symbol | R -3 |
| Hall space group symbol | -R 3 |
| Residual factor R(I) for significantly intense reflections | 5.6199 |
| Goodness-of-fit parameter for all reflections | 1.59 |
| Method of determination | powder diffraction |
| Diffraction radiation probe | neutron |
| Diffraction radiation wavelength | 1.9106 Å |
| Diffraction radiation type | neutron |
| Has coordinates | Yes |
| Has disorder | No |
| Has Fobs | No |
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