Crystal Lab › Prototype structures › Orthorhombic
SrCuYSe₃ (Eu₂CuS₃)
Orthorhombic · space group Pnma (No. 62) · Pearson oP24
Symmetry elements and Wyckoff positions (interactive)
SrCuYSe₃ (Eu₂CuS₃) in Pnma
SettingUnit cell
- Lattice constants
- a = 10.620 Å, b = 4.100 Å, c = 13.540 Å; α = 90.00°, β = 90.00°, γ = 90.00°
- Cell volume
- 589.6 ų
- Atoms in the conventional cell
- 24 (Cu 4, Se 12, Sr 4, Y 4)
- Formula units Z
- 4
- Pearson symbol
- oP24 — orthorhombic, primitive lattice, 24 atoms per conventional cell
- Symmetry operations
- 8 per cell
Crystallographic sites
| Site | Element | Wyckoff | Multiplicity | x | y | z |
|---|---|---|---|---|---|---|
| Cu1 | Cu | 4c | 4 | 0.2428 | 0.2500 | 0.7214 |
| Se2 | Se | 4c | 4 | 0.0555 | 0.2500 | 0.6128 |
| Se3 | Se | 4c | 4 | 0.2574 | 0.2500 | 0.3288 |
| Se4 | Se | 4c | 4 | 0.4245 | 0.2500 | 0.6082 |
| Sr5 | Sr | 4c | 4 | 0.2625 | 0.2500 | 0.0008 |
| Y6 | Y | 4c | 4 | 0.0092 | 0.2500 | 0.2464 |
The multiplicity and the Wyckoff letter say how many copies of the site the group makes in one cell and on which kind of symmetry element the site sits; the 24 atoms drawn above are these sites multiplied by all 8 operations. Press Wyckoff under Colour to see the sites, and tick a symmetry element on the left to see which atoms lie on it.
How to read the label
AB3CD_oP24_62_c_3c_c_c-001: the stoichiometry comes first (A, B, C… are the elements in alphabetical order of their site labels), then the Pearson symbol oP24, then the space-group number 62, then the Wyckoff letters occupied by each element in turn (Cu: 4c; Se: 4c; Se: 4c; Se: 4c; Sr: 4c; Y: 4c). Two structures with the same label are the same arrangement with different cell parameters or coordinates.
Other compounds with this structure
Ba₂MnS₃, Ba₂MnSe₃, Ba₂MnTe₃, Eu₂CuS₃, Rb₂AgBr₃, Rb₂AgCl₃, Rb₂AgI₃, BaCuYS₃, EuLaCuS₃, EuNdCuS₃, EuSmCuS₃, SrCuGdSe₃, SrGdCuS₃, SrLaCuS₃, SrLuCuS₃, SrPrCuS₃ <!--beginning with an
Source
Coordinates and cell from the AFLOW Encyclopedia of Crystallographic Prototypes, entry AB3CD_oP24_62_c_3c_c_c-001 (M. J. Mehl et al., Comput. Mater. Sci. 136, S1 (2017); D. Hicks et al., ibid. 161, S1 (2019) and 199, 110450 (2021); S. Eckert et al., ibid. 240, 112988 (2024)). Symmetry elements, Wyckoff assignment and the diagram are computed on this page from the group operations.
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