Crystal Lab › Prototype structures › Tetragonal
G7₅ (PbCO₃cdotPbCl₂, Phosgenite) ( Obsolete )
Tetragonal · space group P4212 (No. 90) · Pearson tP16 · Strukturbericht G75 · mineral: phosgenite
Symmetry elements and Wyckoff positions (interactive)
G7₅ (PbCO₃cdotPbCl₂, Phosgenite) ( Obsolete ) in P4212
SettingUnit cell
- Lattice constants
- a = 8.120 Å, b = 8.120 Å, c = 4.400 Å; α = 90.00°, β = 90.00°, γ = 90.00°
- Cell volume
- 290.1 ų
- Atoms in the conventional cell
- 16 (C 2, O 6, Pb 4, Cl 4)
- Formula units Z
- 2
- Pearson symbol
- tP16 — tetragonal, primitive lattice, 16 atoms per conventional cell
- Symmetry operations
- 8 per cell
Crystallographic sites
| Site | Element | Wyckoff | Multiplicity | x | y | z |
|---|---|---|---|---|---|---|
| C1 | C | 2c | 2 | 0.0000 | 0.5000 | 0.5500 |
| O3 | O | 2c | 2 | 0.0000 | 0.5000 | 0.8400 |
| O4 | O | 4e | 4 | 0.1100 | 0.1100 | 0.0000 |
| Pb5 | Pb | 4e | 4 | 0.3400 | 0.3400 | 0.0000 |
| Cl2 | Cl | 4f | 4 | 0.2400 | 0.2400 | 0.5000 |
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 16 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
AB2C3D2_tP16_90_c_f_ce_e-001: the stoichiometry comes first (A, B, C… are the elements in alphabetical order of their site labels), then the Pearson symbol tP16, then the space-group number 90, then the Wyckoff letters occupied by each element in turn (C: 2c; O: 2c; O: 4e; Pb: 4e; Cl: 4f). Two structures with the same label are the same arrangement with different cell parameters or coordinates.
Note: G7₅, Phosgenite (Obsolete).
Source
Coordinates and cell from the AFLOW Encyclopedia of Crystallographic Prototypes, entry AB2C3D2_tP16_90_c_f_ce_e-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.
← Na₄Ti₂Si₈O₂₂(H₂O)₄ · Space group P4212 (4 prototypes) · All prototypes · BaCu₄[VO][PO₄]₄ — BaCu₄O₁₇P₄V →