Crystal Lab › Prototype structures › Orthorhombic
Selenous Acid (H₂SeO₃)
Orthorhombic · space group P212121 (No. 19) · Pearson oP24
Symmetry elements and Wyckoff positions (interactive)
Selenous Acid (H₂SeO₃) in P212121
SettingUnit cell
- Lattice constants
- a = 9.132 Å, b = 5.988 Å, c = 5.091 Å; α = 90.00°, β = 90.00°, γ = 90.00°
- Cell volume
- 278.4 ų
- Atoms in the conventional cell
- 24 (H 8, O 12, Se 4)
- Formula units Z
- 4
- Pearson symbol
- oP24 — orthorhombic, primitive lattice, 24 atoms per conventional cell
- Symmetry operations
- 4 per cell
Crystallographic sites
| Site | Element | Wyckoff | Multiplicity | x | y | z |
|---|---|---|---|---|---|---|
| H1 | H | 4a | 4 | 0.8830 | 0.8021 | 0.8091 |
| H2 | H | 4a | 4 | 0.9522 | 0.4398 | 0.3423 |
| O3 | O | 4a | 4 | 0.8765 | 0.8695 | 0.1431 |
| O4 | O | 4a | 4 | 0.9200 | 0.8200 | 0.6283 |
| O5 | O | 4a | 4 | 0.8431 | 0.4635 | 0.3552 |
| Se6 | Se | 4a | 4 | 0.7943 | 0.7434 | 0.3890 |
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 24 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
A2B3C_oP24_19_2a_3a_a-001: the stoichiometry comes first (A, B, C… are the elements in alphabetical order of their site labels), then the Pearson symbol oP24, then the space-group number 19, then the Wyckoff letters occupied by each element in turn (H: 4a; H: 4a; O: 4a; O: 4a; O: 4a; Se: 4a). Two structures with the same label are the same arrangement with different cell parameters or coordinates.
Source
Coordinates and cell from the AFLOW Encyclopedia of Crystallographic Prototypes, entry A2B3C_oP24_19_2a_3a_a-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.
← Wülfingite (ε-Zn(OH)₂, C31) · Space group P212121 (19 prototypes) · All prototypes · Selenic Acid (H₂SeO₃) →