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Information card for entry 7707644
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Coordinates | 7707644.cif |
---|---|
Original paper (by DOI) | HTML |
Formula | As2 Ca In2 |
---|---|
Calculated formula | As2 Ca In2 |
Title of publication | The Zintl phases <i>A</i>In<sub>2</sub>As<sub>2</sub> (A = Ca, Sr, Ba): new topological insulators and thermoelectric material candidates. |
Authors of publication | Ogunbunmi, Michael O.; Baranets, Sviatoslav; Childs, Amanda B.; Bobev, Svilen |
Journal of publication | Dalton transactions (Cambridge, England : 2003) |
Year of publication | 2021 |
Journal volume | 50 |
Journal issue | 26 |
Pages of publication | 9173 - 9184 |
a | 4.1482 ± 0.0006 Å |
b | 4.1482 Å |
c | 17.726 ± 0.004 Å |
α | 90° |
β | 90° |
γ | 120° |
Cell volume | 264.16 ± 0.07 Å3 |
Cell temperature | 296.15 K |
Ambient diffraction temperature | 296.15 K |
Number of distinct elements | 3 |
Space group number | 194 |
Hermann-Mauguin space group symbol | P 63/m m c |
Hall space group symbol | -P 6c 2c |
Residual factor for all reflections | 0.0211 |
Residual factor for significantly intense reflections | 0.0132 |
Weighted residual factors for significantly intense reflections | 0.028 |
Weighted residual factors for all reflections included in the refinement | 0.0299 |
Goodness-of-fit parameter for all reflections included in the refinement | 1.007 |
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/7707644.html
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