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Information card for entry 1561740
Preview
| Coordinates | 1561740.cif |
|---|---|
| Original paper (by DOI) | HTML |
| Formula | Ba2 Cu2 O13 P2 Te2 |
|---|---|
| Calculated formula | Ba2 Cu2 O13 P2 Te2 |
| Title of publication | Ba2Cu2Te2P2O13: A new telluro-phosphate with S=1/2 Heisenberg chain |
| Authors of publication | Xia, Mingjun; Shen, Shipeng; Lu, Jun; Sun, Young; Li, R.K. |
| Journal of publication | Journal of Solid State Chemistry |
| Year of publication | 2015 |
| Journal volume | 230 |
| Pages of publication | 75 - 79 |
| a | 17.647 ± 0.003 Å |
| b | 7.255 ± 0.0015 Å |
| c | 9.1913 ± 0.0018 Å |
| α | 90° |
| β | 100.16 ± 0.03° |
| γ | 90° |
| Cell volume | 1158.3 ± 0.4 Å3 |
| Cell temperature | 293 ± 2 K |
| Ambient diffraction temperature | 293 ± 2 K |
| Number of distinct elements | 5 |
| Space group number | 15 |
| Hermann-Mauguin space group symbol | C 1 2/c 1 |
| Hall space group symbol | -C 2yc |
| Residual factor for all reflections | 0.0306 |
| Residual factor for significantly intense reflections | 0.0253 |
| Weighted residual factors for significantly intense reflections | 0.0609 |
| Weighted residual factors for all reflections included in the refinement | 0.0867 |
| Goodness-of-fit parameter for all reflections included in the refinement | 1.189 |
| Diffraction radiation wavelength | 0.71073 Å |
| Diffraction radiation type | MoKα |
| Has coordinates | Yes |
| Has disorder | No |
| Has Fobs | No |
| Revision | Date | Message | Files |
|---|---|---|---|
| 264138 (current) | 2021-04-14 | cif/ Adding structures of 1561740 via cif-deposit CGI script. |
1561740.cif |
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Users of the data should acknowledge the original authors of the
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