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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

Setting
Loading the group…
x = 0.10, y = 0.17, z = 0.08

Unit 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

SiteElementWyckoffMultiplicityxyz
K1K4e40.94520.28190.7967
K2K4e40.72380.93460.2071
K3K4e40.49820.34310.0109
Sn4Sn4e40.15260.00800.1222
Te5Te4e40.14470.97520.3988
Te6Te4e40.26030.19210.1177
Te7Te4e40.32830.86710.0748

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.

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