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Information card for entry 2102192
Preview
| Coordinates | 2102192.cif |
|---|---|
| Original IUCr paper | HTML |
| Formula | Cu7 P Se6 |
|---|---|
| Calculated formula | Cu7 P Se6 |
| Title of publication | Structures and phase transitions of the <i>A</i>~7~PSe~6~ (<i>A</i> = Ag, Cu) argyrodite-type ionic conductors. III. α-Cu~7~PSe~6~ |
| Authors of publication | Gaudin, E.; Petricek, V.; Boucher, F.; Taulelle, F.; Evain, M. |
| Journal of publication | Acta Crystallographica Section B |
| Year of publication | 2000 |
| Journal volume | 56 |
| Journal issue | 6 |
| Pages of publication | 972 - 979 |
| a | 14.3179 ± 0.0004 Å |
| b | 7.1112 ± 0.0002 Å |
| c | 10.1023 ± 0.0003 Å |
| α | 90° |
| β | 90° |
| γ | 90° |
| Cell volume | 1028.59 ± 0.05 Å3 |
| Number of distinct elements | 3 |
| Space group number | 33 |
| Hermann-Mauguin space group symbol | P n a 21 |
| Hall space group symbol | P 2c -2n |
| Residual factor for all reflections | 0.2954 |
| Residual factor for significantly intense reflections | 0.0466 |
| Weighted residual factors for significantly intense reflections | 0.0486 |
| Weighted residual factors for all reflections included in the refinement | 0.0804 |
| Goodness-of-fit parameter for significantly intense reflections | 0.62 |
| Goodness-of-fit parameter for all reflections included in the refinement | 1.06 |
| Diffraction radiation probe | x-ray |
| Diffraction radiation wavelength | 0.71073 Å |
| Diffraction radiation type | MoKα |
| Has coordinates | Yes |
| Has disorder | No |
| Has Fobs | No |
Version history
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Users of the data should acknowledge the original authors of the
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