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Information card for entry 4341901
Preview
| Coordinates | 4341901.cif |
|---|---|
| Original paper (by DOI) | HTML |
| Formula | Au4.39 Ba Ga2.61 |
|---|---|
| Calculated formula | Au4.393 Ba Ga2.607 |
| Title of publication | Crystal Structure and Bonding in BaAu5Ga2 and AeAu4+xGa3-x (Ae = Ba and Eu): Hexagonal Diamond-Type Au Frameworks and Remarkable Cation/Anion Partitioning in the Ae-Au-Ga Systems. |
| Authors of publication | Smetana, Volodymyr; Steinberg, Simon; Card, Nathan; Mudring, Anja-Verena; Miller, Gordon J. |
| Journal of publication | Inorganic chemistry |
| Year of publication | 2015 |
| Journal volume | 54 |
| Journal issue | 3 |
| Pages of publication | 1010 - 1018 |
| a | 8.7758 ± 0.0004 Å |
| b | 8.7758 ± 0.0004 Å |
| c | 7.1905 ± 0.0008 Å |
| α | 90° |
| β | 90° |
| γ | 120° |
| Cell volume | 479.58 ± 0.06 Å3 |
| Cell temperature | 296 ± 2 K |
| Ambient diffraction temperature | 296 ± 2 K |
| Number of distinct elements | 3 |
| Space group number | 189 |
| Hermann-Mauguin space group symbol | P -6 2 m |
| Hall space group symbol | P -6 -2 |
| Residual factor for all reflections | 0.0357 |
| Residual factor for significantly intense reflections | 0.0312 |
| Weighted residual factors for significantly intense reflections | 0.054 |
| Weighted residual factors for all reflections included in the refinement | 0.055 |
| Goodness-of-fit parameter for all reflections included in the refinement | 1.105 |
| Diffraction radiation wavelength | 0.71073 Å |
| Diffraction radiation type | MoKα |
| Has coordinates | Yes |
| Has disorder | No |
| Has Fobs | No |
| Revision | Date | Message | Files |
|---|---|---|---|
| 179522 (current) | 2016-03-24 | cif/4/34/ (antanas@kurmis) Replacing _[local]_cod_* tags with their equivalents from the COD CIF dictionary in multiple entries in subrange 4/34/19. |
4341901.cif |
| 130549 | 2015-02-04 | cif/ Updating files of 4341895, 4341896, 4341897, 4341898, 4341899, 4341900, 4341901, 4341902, 4341903 Original log message: Adding full bibliography for 4341895--4341903.cif. |
4341901.cif |
| 128611 | 2014-12-13 | cif/ Adding structures of 4341895, 4341896, 4341897, 4341898, 4341899, 4341900, 4341901, 4341902, 4341903 via cif-deposit CGI script. |
4341901.cif |
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Users of the data should acknowledge the original authors of the
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