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Information card for entry 4003577
Preview
Coordinates | 4003577.cif |
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Original paper (by DOI) | HTML |
Formula | Fe0.13 Ga0.87 Na S2 |
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Calculated formula | Fe0.135 Ga0.865 Na S2 |
Title of publication | Unusual Atmospheric Water Trapping and Water Induced Reversible Restacking of 2D Gallium Sulfide Layers in NaGaS2 Formed by Supertetrahedral Building Unit |
Authors of publication | Adhikary, Amit; Yaghoobnejad Asl, Hooman; Sandineni, Prashanth; Balijapelly, Srikanth; Mohapatra, Sudip; Khatua, Sajal; Konar, Sanjit; Gerasimchuk, Nikolay; Chernatynskiy, Aleksandr V.; Choudhury, Amitava |
Journal of publication | Chemistry of Materials |
Year of publication | 2020 |
a | 10.3 ± 0.02 Å |
b | 10.29 ± 0.02 Å |
c | 13.73 ± 0.03 Å |
α | 90° |
β | 101.16 ± 0.02° |
γ | 90° |
Cell volume | 1428 ± 5 Å3 |
Cell temperature | 220 ± 2 K |
Ambient diffraction temperature | 220 ± 2 K |
Number of distinct elements | 4 |
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 | 0.0659 |
Residual factor for significantly intense reflections | 0.0541 |
Weighted residual factors for significantly intense reflections | 0.1323 |
Weighted residual factors for all reflections included in the refinement | 0.1382 |
Goodness-of-fit parameter for all reflections included in the refinement | 1.174 |
Diffraction radiation wavelength | 0.71073 Å |
Diffraction radiation type | MoKα |
Has coordinates | Yes |
Has disorder | No |
Has Fobs | No |
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