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Information card for entry 4004058
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Jmol._Canvas2D (Jmol) "jmolApplet0"[x]
Coordinates | 4004058.cif |
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Original paper (by DOI) | HTML |
Formula | Ag0.58 Ca2 Mn0.71 Sb2 |
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Calculated formula | Ag0.58 Ca2 Mn0.71 Sb2 |
Title of publication | Phase Transitions, Structure Evolution, and Thermoelectric Properties Based on A2MnSb2 (A = Ca, Yb) |
Authors of publication | Liu, Kefeng; Liu, Jian; Liu, Qian; Wang, Qiqi; Yu, Fang; Liu, Xiao-Cun; Xia, Sheng-Qing |
Journal of publication | Chemistry of Materials |
Year of publication | 2021 |
Journal volume | 33 |
Journal issue | 24 |
Pages of publication | 9732 - 9740 |
a | 4.6848 ± 0.0006 Å |
b | 4.6848 ± 0.0006 Å |
c | 7.7443 ± 0.0018 Å |
α | 90° |
β | 90° |
γ | 120° |
Cell volume | 147.2 ± 0.04 Å3 |
Cell temperature | 296 ± 2 K |
Ambient diffraction temperature | 296 ± 2 K |
Number of distinct elements | 4 |
Space group number | 186 |
Hermann-Mauguin space group symbol | P 63 m c |
Hall space group symbol | P 6c -2c |
Residual factor for all reflections | 0.035 |
Residual factor for significantly intense reflections | 0.0319 |
Weighted residual factors for significantly intense reflections | 0.0746 |
Weighted residual factors for all reflections included in the refinement | 0.0785 |
Goodness-of-fit parameter for all reflections included in the refinement | 1.34 |
Diffraction radiation wavelength | 0.71073 Å |
Diffraction radiation type | MoKα |
Has coordinates | Yes |
Has disorder | No |
Has Fobs | No |
For the version history of this entry, please navigate to main COD server.
The link is: https://www.crystallography.net/4004058.html
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Users of the data should acknowledge the original authors of the
structural data.