Crystal Lab › Prototype structures › Tetragonal
TlCo₂S₂
Tetragonal · space group I4/mmm (No. 139) · Pearson tI10
Symmetry elements and Wyckoff positions (interactive)
TlCo₂S₂ in I4/mmm
SettingUnit cell
- Lattice constants
- a = 3.741 Å, b = 3.741 Å, c = 12.956 Å; α = 90.00°, β = 90.00°, γ = 90.00°
- Cell volume
- 181.3 ų
- Atoms in the conventional cell
- 10 (Tl 2, Co 4, S 4)
- Formula units Z
- 2
- Pearson symbol
- tI10 — tetragonal, body-centred lattice, 10 atoms per conventional cell
- Symmetry operations
- 32 per cell
Crystallographic sites
| Site | Element | Wyckoff | Multiplicity | x | y | z |
|---|---|---|---|---|---|---|
| Tl3 | Tl | 2a | 2 | 0.0000 | 0.0000 | 0.0000 |
| Co1 | Co | 4d | 4 | 0.0000 | 0.5000 | 0.2500 |
| S2 | S | 4e | 4 | 0.0000 | 0.0000 | 0.3474 |
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 10 atoms drawn above are these sites multiplied by all 32 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
A2B2C_tI10_139_d_e_a-002: the stoichiometry comes first (A, B, C… are the elements in alphabetical order of their site labels), then the Pearson symbol tI10, then the space-group number 139, then the Wyckoff letters occupied by each element in turn (Tl: 2a; Co: 4d; S: 4e). Two structures with the same label are the same arrangement with different cell parameters or coordinates.
Other compounds with this structure
BaCr₂As₂, BaFe₂As₂, BaMn₂Bi₂, BaP₂Zn₂, BaSr₂As₂, BaCo₂As₂, BiCe₂O₂, BiTh₂N₂, BiU₂N₂, CaCo₂As₂, SrCo₂As₂, EuCo₂As₂, EuFe4₂As₂, CsCo₂Se₂, KCo₂As₂, KCo₂P₂, KCo₂Se₂, KFe₂As₂, KFe₂P₂, KRh₂As₂, KRh₂P₂, RbCo₂Se₂, RbFe₂As₂, RbNi₂Se₂, SbTh₂N₂, SbU₂N₂, SeBi₂O₂, SeBi₂O₂, TeBi₂O₂, TeCe₂O₂, TeDy₂O₂, TeEr₂O₂, TeLu₂O₂, TeTb₂O₂, TeY₂O₂, TeTh₂N₂, TeU₂N₂, TlCo₂Se₂, TlCu₂S₂, TlCu₂Se₂, TlCu₂Te₂, TlFe₂S₂, TlFe₂Se₂, TlNi₂S₂, TlNi₂Se₂, Cl(Li_{0.25}Be_{0.75})₂O₂, Cl(Na_{0.25}Be_{0.75})₂O₂, EuFe₂(As_{0.8}P_{0.2})₂ <!--beginning with an
Source
Coordinates and cell from the AFLOW Encyclopedia of Crystallographic Prototypes, entry A2B2C_tI10_139_d_e_a-002 (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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