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Information card for entry 2020909
Preview
| Coordinates | 2020909.cif |
|---|---|
| Structure factors | 2020909.hkl |
| Original paper (by DOI) | HTML |
| Chemical name | Lithium boron tricarbide |
|---|---|
| Formula | C3 B Li0.96 |
| Calculated formula | C3 B Li0.98 |
| Title of publication | LiBC~3~: a new borocarbide based on graphene and heterographene networks |
| Authors of publication | Milashius, Viktoria; Pavlyuk, Volodymyr; Kluziak, Karolina; Dmytriv, Grygoriy; Ehrenberg, Helmut |
| Journal of publication | Acta Crystallographica Section C |
| Year of publication | 2017 |
| Journal volume | 73 |
| Journal issue | 11 |
| Pages of publication | 984 - 989 |
| a | 2.5408 ± 0.0003 Å |
| b | 2.5408 ± 0.0003 Å |
| c | 7.5989 ± 0.0009 Å |
| α | 90° |
| β | 90° |
| γ | 120° |
| Cell volume | 42.484 ± 0.009 Å3 |
| Cell temperature | 293 ± 2 K |
| Ambient diffraction temperature | 293 ± 2 K |
| Number of distinct elements | 3 |
| Space group number | 187 |
| Hermann-Mauguin space group symbol | P -6 m 2 |
| Hall space group symbol | P -6 2 |
| Residual factor for all reflections | 0.0348 |
| Residual factor for significantly intense reflections | 0.0323 |
| Weighted residual factors for significantly intense reflections | 0.0959 |
| Weighted residual factors for all reflections included in the refinement | 0.0984 |
| Goodness-of-fit parameter for all reflections included in the refinement | 1.231 |
| Diffraction radiation wavelength | 0.71073 Å |
| Diffraction radiation type | MoKα |
| Has coordinates | Yes |
| Has disorder | No |
| Has Fobs | Yes |
| Revision | Date | Message | Files |
|---|---|---|---|
| 205309 (current) | 2018-01-17 | cif/ hkl/ Adding structures of 2020909 via cif-deposit CGI script. |
2020909.cif 2020909.hkl |
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