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Crystal Lab › Prototype structures › Orthorhombic

Sm₅Ge₄

Orthorhombic · space group Pnma (No. 62) · Pearson oP36

Symmetry elements and Wyckoff positions (interactive)

Sm₅Ge₄ in Pnma

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

Unit cell

Lattice constants
a = 7.750 Å, b = 14.942 Å, c = 7.840 Å; α = 90.00°, β = 90.00°, γ = 90.00°
Cell volume
907.9 ų
Atoms in the conventional cell
36 (Ge 16, Sm 20)
Formula units Z
4
Pearson symbol
oP36 — orthorhombic, primitive lattice, 36 atoms per conventional cell
Symmetry operations
8 per cell

Crystallographic sites

SiteElementWyckoffMultiplicityxyz
Ge1Ge4c40.91320.25000.1115
Ge2Ge4c40.17610.25000.6333
Sm3Sm4c40.28800.25000.0024
Ge4Ge8d80.22060.95510.5312
Sm5Sm8d80.12050.11570.3388
Sm6Sm8d80.97470.10040.8219

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 36 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

A4B5_oP36_62_2cd_c2d-001: the stoichiometry comes first (A, B, C… are the elements in alphabetical order of their site labels), then the Pearson symbol oP36, then the space-group number 62, then the Wyckoff letters occupied by each element in turn (Ge: 4c; Ge: 4c; Sm: 4c; Ge: 8d; Sm: 8d; Sm: 8d). Two structures with the same label are the same arrangement with different cell parameters or coordinates.

Other compounds with this structure

Ba₅P₄, Ba₅Sb₄, Ce₅Ge₄, Ce₅Ir₄, Ce₅Pb₄, Ce₅Rh₄, Ce₅Sn₄, Dy₅Ge₄, Dy₅Pb₄, Dy₅Pt₄, Dy₅Si₄, Dy₅Sn₄, Er₅Ge₄, Er₅Ge₄, Er₅Pb₄, Er₅Pt₄, Er₅Si₄, Eu₅Pt₄, Gd₅Ge₄, Gd₅Pb₄, Gd₅Rh₄, Gd₅Si₄, Gd₅Sn₄, Ho₅Fe₄, Ho₅Ge₄, Ho₅Pb₄, Ho₅Pt₄, Ho₅Si₄, Ho₅Pu₄, La₅Ge₄, La₅Pb₄, La₅Rh₄, Lu₅Ge₄, Lu₅Pt₄, Nd₅Ge₄, Nd₅Pb₄, Nd₅Rh₄, Nd₅Si₄, Nd₅Sn₄, Pr₅Ge₄, Pr₅Pb₄, Pr₅Sn₄, Pr₅Rh₄, Pu₅Ir₄, Sc₅Ge₄, Sm₅Ge₄, Sm₅Pb₄, Sm₅Rh₄, Sm₅Si₄, Sm₅Sn₄, Sr₅Pb₄, Sr₅Pt₄, Tb₅Ge₄, Tb₅Pb₄, Tb₅Pt₄, Tb₅Si₄, Tb₅Sn₄, Tm₅Ge₄, Tm₅Pb₄, Tm₅Pt₄, Y₅Ge₄, Y₅Pt₄, Y₅Si₄, Y₅Sn₄, Yb₅Au₄, Yb₅Ge₄, Yb₅Pt₄, Yb₅Si₄, Yb₅Sn₄ <!--beginning with an

Source

Coordinates and cell from the AFLOW Encyclopedia of Crystallographic Prototypes, entry A4B5_oP36_62_2cd_c2d-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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