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Information card for entry 4001691
Preview
| Coordinates | 4001691.cif |
|---|---|
| Original paper (by DOI) | HTML |
| Formula | As27.8 Cs6.36 Zn18.2 |
|---|---|
| Calculated formula | As27.8 Cs6.358 Zn18.2 |
| Title of publication | Synthesis, Structural Characterization, and Physical Properties of the Type-I ClathratesA8Zn18As28(A= K, Rb, Cs) and Cs8Cd18As28 |
| Authors of publication | He, Hua; Zevalkink, Alex; Gibbs, Zachary M.; Snyder, G. Jeffrey; Bobev, Svilen |
| Journal of publication | Chemistry of Materials |
| Year of publication | 2012 |
| Journal volume | 24 |
| Journal issue | 18 |
| Pages of publication | 3596 |
| a | 10.7731 ± 0.0008 Å |
| b | 10.7731 ± 0.0008 Å |
| c | 10.7731 ± 0.0008 Å |
| α | 90° |
| β | 90° |
| γ | 90° |
| Cell volume | 1250.32 ± 0.16 Å3 |
| Cell temperature | 200 ± 2 K |
| Ambient diffraction temperature | 200 ± 2 K |
| Number of distinct elements | 3 |
| Space group number | 223 |
| Hermann-Mauguin space group symbol | P m -3 n |
| Hall space group symbol | -P 4n 2 3 |
| Residual factor for all reflections | 0.0165 |
| Residual factor for significantly intense reflections | 0.0147 |
| Weighted residual factors for significantly intense reflections | 0.0336 |
| Weighted residual factors for all reflections included in the refinement | 0.0343 |
| Goodness-of-fit parameter for all reflections included in the refinement | 1.062 |
| Diffraction radiation wavelength | 0.71073 Å |
| Diffraction radiation type | MoKα |
| Has coordinates | Yes |
| Has disorder | No |
| Has Fobs | No |
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