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Empressite (AgTe)

Orthorhombic · space group Pnma (No. 62) · Pearson oP32 · mineral: empressite

Symmetry elements and Wyckoff positions (interactive)

Empressite (AgTe) in Pnma

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

Unit cell

Lattice constants
a = 20.100 Å, b = 8.882 Å, c = 4.614 Å; α = 90.00°, β = 90.00°, γ = 90.00°
Cell volume
823.7 ų
Atoms in the conventional cell
32 (Ag 16, Te 16)
Formula units Z
16
Pearson symbol
oP32 — orthorhombic, primitive lattice, 32 atoms per conventional cell
Symmetry operations
8 per cell

Crystallographic sites

SiteElementWyckoffMultiplicityxyz
Ag1Ag4c40.55130.25000.6669
Ag2Ag4c40.34420.25000.7567
Te4Te4c40.23680.25000.1490
Te5Te4c40.46630.25000.1583
Ag3Ag8d80.56560.47990.1499
Te6Te8d80.65780.47720.5999

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 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

AB_oP32_62_2cd_2cd-001: the stoichiometry comes first (A, B, C… are the elements in alphabetical order of their site labels), then the Pearson symbol oP32, then the space-group number 62, then the Wyckoff letters occupied by each element in turn (Ag: 4c; Ag: 4c; Te: 4c; Te: 4c; Ag: 8d; Te: 8d). Two structures with the same label are the same arrangement with different cell parameters or coordinates.

Note: Empressite.

Source

Coordinates and cell from the AFLOW Encyclopedia of Crystallographic Prototypes, entry AB_oP32_62_2cd_2cd-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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