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Information card for entry 7039847
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Coordinates | 7039847.cif |
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Original paper (by DOI) | HTML |
Common name | barium neodymium indium sulfide (1/2/2/7) |
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Chemical name | barium neodymium indium sulfide (1/2/2/7) |
Formula | Ba In2 Nd2 S7 |
Calculated formula | Ba In2 Nd2 S7 |
Title of publication | Quaternary chalcogenides BaRE2In2Ch7 (RE = La-Nd; Ch = S, Se) containing InCh5 trigonal bipyramids. |
Authors of publication | Yin, Wenlong; Iyer, Abishek K.; Lin, Xinsong; Li, Chao; Yao, Jiyong; Mar, Arthur |
Journal of publication | Dalton transactions (Cambridge, England : 2003) |
Year of publication | 2016 |
Journal volume | 45 |
Journal issue | 31 |
Pages of publication | 12329 - 12337 |
a | 11.5895 ± 0.0007 Å |
b | 12.3001 ± 0.0008 Å |
c | 4.0028 ± 0.0002 Å |
α | 90° |
β | 90° |
γ | 90° |
Cell volume | 570.61 ± 0.06 Å3 |
Cell temperature | 296 ± 2 K |
Ambient diffraction temperature | 296 ± 2 K |
Number of distinct elements | 4 |
Space group number | 55 |
Hermann-Mauguin space group symbol | P b a m |
Hall space group symbol | -P 2 2ab |
Residual factor for all reflections | 0.0339 |
Residual factor for significantly intense reflections | 0.0276 |
Weighted residual factors for significantly intense reflections | 0.0598 |
Weighted residual factors for all reflections included in the refinement | 0.0621 |
Goodness-of-fit parameter for all reflections included in the refinement | 1.186 |
Diffraction radiation wavelength | 0.71073 Å |
Diffraction radiation type | MoKα |
Has coordinates | Yes |
Has disorder | No |
Has Fobs | No |
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