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Information card for entry 1562955
Preview
| Coordinates | 1562955.cif |
|---|---|
| Original paper (by DOI) | HTML |
| Formula | Ba4 Cu In Se6 |
|---|---|
| Calculated formula | Ba4 Cu In Se6 |
| Title of publication | Syntheses, structures, and optical properties of Ba4MInSe6 (M=Cu, Ag) |
| Authors of publication | Yin, Wenlong; Feng, Kai; Hao, Wenyu; Yao, Jiyong; Wu, Yicheng |
| Journal of publication | Journal of Solid State Chemistry |
| Year of publication | 2012 |
| Journal volume | 192 |
| Pages of publication | 168 - 171 |
| a | 9.1181 ± 0.0018 Å |
| b | 4.472 ± 0.0009 Å |
| c | 17.681 ± 0.003 Å |
| α | 90° |
| β | 90° |
| γ | 90° |
| Cell volume | 721 ± 0.2 Å3 |
| Cell temperature | 153 ± 2 K |
| Ambient diffraction temperature | 153 ± 2 K |
| Number of distinct elements | 4 |
| Space group number | 62 |
| Hermann-Mauguin space group symbol | P n m a |
| Hall space group symbol | -P 2ac 2n |
| Residual factor for all reflections | 0.0506 |
| Residual factor for significantly intense reflections | 0.0408 |
| Weighted residual factors for significantly intense reflections | 0.0858 |
| Weighted residual factors for all reflections included in the refinement | 0.09 |
| Goodness-of-fit parameter for all reflections included in the refinement | 1.122 |
| Diffraction radiation wavelength | 0.71073 Å |
| Diffraction radiation type | MoKα |
| Has coordinates | Yes |
| Has disorder | No |
| Has Fobs | No |
| Revision | Date | Message | Files |
|---|---|---|---|
| 265582 (current) | 2021-05-28 | cif/ Adding structures of 1562954, 1562955 via cif-deposit CGI script. |
1562955.cif |
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