Crystal Lab › Prototype structures › Tetragonal
Sr₅Si₃ Structure ( Obsolete ): A3B5_tI32_108_ac_a2c-001
Tetragonal · space group I4cm (No. 108) · Pearson tI32
Symmetry elements and Wyckoff positions (interactive)
Sr₅Si₃ Structure ( Obsolete ): A3B5_tI32_108_ac_a2c-001 in I4cm
SettingUnit cell
- Lattice constants
- a = 8.055 Å, b = 8.055 Å, c = 15.688 Å; α = 90.00°, β = 90.00°, γ = 90.00°
- Cell volume
- 1017.9 ų
- Atoms in the conventional cell
- 32 (Si 12, Sr 20)
- Formula units Z
- 4
- Pearson symbol
- tI32 — tetragonal, body-centred lattice, 32 atoms per conventional cell
- Symmetry operations
- 16 per cell
Crystallographic sites
| Site | Element | Wyckoff | Multiplicity | x | y | z |
|---|---|---|---|---|---|---|
| Si1 | Si | 4a | 4 | 0.0000 | 0.0000 | 0.0070 |
| Sr3 | Sr | 4a | 4 | 0.0000 | 0.0000 | 0.7500 |
| Si2 | Si | 8c | 8 | 0.1090 | 0.6090 | 0.2570 |
| Sr4 | Sr | 8c | 8 | 0.6760 | 0.1760 | 0.1140 |
| Sr5 | Sr | 8c | 8 | 0.6760 | 0.1760 | 0.4000 |
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 32 atoms drawn above are these sites multiplied by all 16 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
A3B5_tI32_108_ac_a2c-001: the stoichiometry comes first (A, B, C… are the elements in alphabetical order of their site labels), then the Pearson symbol tI32, then the space-group number 108, then the Wyckoff letters occupied by each element in turn (Si: 4a; Sr: 4a; Si: 8c; Sr: 8c; Sr: 8c). Two structures with the same label are the same arrangement with different cell parameters or coordinates.
Note: (Obsolete).
Source
Coordinates and cell from the AFLOW Encyclopedia of Crystallographic Prototypes, entry A3B5_tI32_108_ac_a2c-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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