Crystal Lab › Prototype structures › Orthorhombic
Galenobismutite (PbBi₂S₄)
Orthorhombic · space group Pnma (No. 62) · Pearson oP28 · mineral: galenobismutite
Symmetry elements and Wyckoff positions (interactive)
Galenobismutite (PbBi₂S₄) in Pnma
SettingUnit cell
- Lattice constants
- a = 11.802 Å, b = 4.076 Å, c = 14.569 Å; α = 90.00°, β = 90.00°, γ = 90.00°
- Cell volume
- 700.8 ų
- Atoms in the conventional cell
- 28 (Bi 8, Pb 4, S 16)
- Formula units Z
- 4
- Pearson symbol
- oP28 — orthorhombic, primitive lattice, 28 atoms per conventional cell
- Symmetry operations
- 8 per cell
Crystallographic sites
| Site | Element | Wyckoff | Multiplicity | x | y | z |
|---|---|---|---|---|---|---|
| Bi1 | Bi | 4c | 4 | 0.0681 | 0.2500 | 0.6094 |
| Bi2 | Bi | 4c | 4 | 0.1019 | 0.2500 | 0.0947 |
| Pb3 | Pb | 4c | 4 | 0.2467 | 0.2500 | 0.3474 |
| S4 | S | 4c | 4 | 0.3356 | 0.2500 | 0.9839 |
| S5 | S | 4c | 4 | 0.2587 | 0.2500 | 0.7028 |
| S6 | S | 4c | 4 | 0.0532 | 0.2500 | 0.9069 |
| S7 | S | 4c | 4 | 0.0174 | 0.2500 | 0.2883 |
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 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
A2BC4_oP28_62_2c_c_4c-001: the stoichiometry comes first (A, B, C… are the elements in alphabetical order of their site labels), then the Pearson symbol oP28, then the space-group number 62, then the Wyckoff letters occupied by each element in turn (Bi: 4c; Bi: 4c; Pb: 4c; S: 4c; S: 4c; S: 4c; S: 4c). Two structures with the same label are the same arrangement with different cell parameters or coordinates.
Other compounds with this structure
(Cd_{x}Na_{1-x})Rh₂O₄, Li(Fe, Ti)₂O₄, Na(Al, Ge)₂O₄, Na(Al, Si)₂O₄, Na(Fe_{0.75}, Sb_{0.25})₂O₄, Na(Fe, Ru)₂O₄, Na(Fe, Sn)₂O₄, Na(Fe, Ti)₂O₄, Na(Sc, Hf)₂O₄, Na(Sc, Sn)₂O₄, Na(Sc, Ti)₂O₄, Na(Sc, Zr)₂O₄, Na(Sn, V)₂O₄, Sr(In, Yb)₂O₄, (Ba, Sr)Dy₂O₄, (Ba, Sr)Er₂O₄, (Ba, Sr)Eu₂O₄, (Ba, Sr)Gd₂O₄, (Ba, Sr)Ho₂O₄, (Ba, Sr)La₂O₄, (Ba, Sr)Lu₂O₄, (Ba, Sr)Nd₂O₄, (Ba, Sr)Sm₂O₄, (Ba, Sr)Tm₂O₄, (Ba, Sr)Y₂O₄, (Ba, Sr)Yb₂O₄, BaCe₂O₄, BaDy₂S₄, BaDy₂Se₄, BaDy₂Te₄, BaEr₂O₄, BaEr₂S₄, BaEr₂Se₄, BaEr₂Te₄, BaEu₂O₄, BaGd₂O₄, BaGd₂S₄, BaGd₂Se₄, BaGd₂Te₄, BaHo₂O₄, BaHo₂S₄, BaHo₂Te₄, BaLa₂O₄, BaLu₂O₄, BaLu₂S₄, BaLu₂Se₄, Ba
Note: Galenobismutite.
Source
Coordinates and cell from the AFLOW Encyclopedia of Crystallographic Prototypes, entry A2BC4_oP28_62_2c_c_4c-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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