Crystal Lab › Prototype structures › Monoclinic
K₃SnTe₃ (K₆Sn₂Te₆)
Monoclinic · space group P121/c1 (No. 14) · Pearson mP28
Symmetry elements and Wyckoff positions (interactive)
K₃SnTe₃ (K₆Sn₂Te₆) in P121/c1
SettingUnit cell
- Lattice constants
- a = 9.590 Å, b = 13.654 Å, c = 9.606 Å; α = 90.00°, β = 116.84°, γ = 90.00°
- Cell volume
- 1122.3 ų
- Atoms in the conventional cell
- 28 (K 12, Sn 4, Te 12)
- Formula units Z
- 4
- Pearson symbol
- mP28 — monoclinic, primitive lattice, 28 atoms per conventional cell
- Symmetry operations
- 4 per cell
Crystallographic sites
| Site | Element | Wyckoff | Multiplicity | x | y | z |
|---|---|---|---|---|---|---|
| K1 | K | 4e | 4 | 0.9452 | 0.2819 | 0.7967 |
| K2 | K | 4e | 4 | 0.7238 | 0.9346 | 0.2071 |
| K3 | K | 4e | 4 | 0.4982 | 0.3431 | 0.0109 |
| Sn4 | Sn | 4e | 4 | 0.1526 | 0.0080 | 0.1222 |
| Te5 | Te | 4e | 4 | 0.1447 | 0.9752 | 0.3988 |
| Te6 | Te | 4e | 4 | 0.2603 | 0.1921 | 0.1177 |
| Te7 | Te | 4e | 4 | 0.3283 | 0.8671 | 0.0748 |
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 28 atoms drawn above are these sites multiplied by all 4 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
A3BC3_mP28_14_3e_e_3e-001: the stoichiometry comes first (A, B, C… are the elements in alphabetical order of their site labels), then the Pearson symbol mP28, then the space-group number 14, then the Wyckoff letters occupied by each element in turn (K: 4e; K: 4e; K: 4e; Sn: 4e; Te: 4e; Te: 4e; Te: 4e). Two structures with the same label are the same arrangement with different cell parameters or coordinates.
Other compounds with this structure
Ba₃SnP₃, K₃SnSe₃, Na₃GeSn₃, Na₃SiTe₃ <!--beginning with an
Source
Coordinates and cell from the AFLOW Encyclopedia of Crystallographic Prototypes, entry A3BC3_mP28_14_3e_e_3e-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.
← β-Tl₂TeO₃ — O₃TeTl₂ · Space group P121/c1 (98 prototypes) · All prototypes · Sanguite (KCuCl₃) →