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Information card for entry 2002080
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| Coordinates | 2002080.cif |
|---|---|
| Original IUCr paper | HTML |
| Chemical name | potassium zirconium indium sulfide |
|---|---|
| Formula | In0.5 K0.5 S2 Zr0.5 |
| Calculated formula | K0.5 S2 Zr0.5 |
| Title of publication | Synthesis and structures of the quaternary sulfides K~0.5~Zr~0.5~In~0.5~S~2~ and K~0.5~Cr~0.5~Sn~0.5~S~2~ |
| Authors of publication | Wu, P.; Ibers, J. A. |
| Journal of publication | Acta Crystallographica Section C |
| Year of publication | 1993 |
| Journal volume | 49 |
| Journal issue | 1 |
| Pages of publication | 126 - 129 |
| a | 3.721 ± 0.001 Å |
| b | 3.721 Å |
| c | 16.639 ± 0.007 Å |
| α | 90° |
| β | 90° |
| γ | 120° |
| Cell volume | 199.5 ± 0.1 Å3 |
| Cell temperature | 115 K |
| Ambient diffraction temperature | 115 K |
| Number of distinct elements | 4 |
| Space group number | 194 |
| Hermann-Mauguin space group symbol | P 63/m m c |
| Hall space group symbol | -P 6c 2c |
| Weighted residual factors for all reflections | 0.111 |
| Weighted residual factors for significantly intense reflections | 0.111 |
| Goodness-of-fit parameter for all reflections | 2.3 |
| Goodness-of-fit parameter for significantly intense reflections | 2.3 |
| Diffraction radiation wavelength | 0.7093 Å |
| Diffraction radiation type | MoKα |
| Has coordinates | Yes |
| Has disorder | Yes |
| Has Fobs | No |
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