Nd₂Fe₁₄B

Unit cell

Lattice constants

a = 8.792 Å, b = 8.792 Å, c = 12.190 Å; α = 90.00°, β = 90.00°, γ = 90.00°

Cell volume

942.3 ų

Atoms in the conventional cell

68 (Fe 56, B 4, Nd 8)

Formula units Z

4

Pearson symbol

tP68 — tetragonal, primitive lattice, 68 atoms per conventional cell

Symmetry operations

16 per cell

Crystallographic sites

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 68 atoms drawn above are these sites multiplied by all 16 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

AB14C2_tP68_136_f_ce2j2k_fg-001: the stoichiometry comes first (A, B, C… are the elements in alphabetical order of their site labels), then the Pearson symbol tP68, then the space-group number 136, then the Wyckoff letters occupied by each element in turn (Fe: 4c; Fe: 4e; B: 4f; Nd: 4f; Nd: 4g; Fe: 8j; Fe: 8j; Fe: 16k; Fe: 16k). Two structures with the same label are the same arrangement with different cell parameters or coordinates.

Other compounds with this structure

Gd₂Co₁₄B, Gd₂Co₁₄C, Gd₂Fe₁₄B, Gd₂Fe₁₄C, Ho₂Fe₁₄B, Ho₂Fe₁₄C, La₂Fe₁₄B, La₂Fe₁₄C, Lu₂Fe₁₄B, Lu₂Fe₁₄C, Nd₂Co₁₄B, Pr₂Co₁₄B, Pr₂Fe₁₄B, Pr₂Fe₁₄C, Sm₂Co₁₄B, Sm₂Fe₁₄B, Sm₂Fe₁₄C, Tb₂Co₁₄B, Tb₂Fe₁₄B, Tb₂Fe₁₄C, Th₂Fe₁₄B, Tm₂Fe₁₄B, Tm₂Fe₁₄C, Y₂Co₁₄B, Y₂Fe₁₄B, Gd₂(Co₁₀Mn₄)B, Gd₂(Co₇Fe₇)B, La₂(Co₇Fe₇)B, Nd₂(Co₇Fe₇)B, Pr₂(Co₇Fe₇)B, Tm₂(Fe₁₀Mn₄)B, Y₂(Fe₁₀Mn₄)B, (GdNd)Fe₁₄B, (HoNd)Fe₁₄B, (NdPr)Fe₁₄B, (NdTb)Co₁₄B, (NdTb)Fe₁₄B, (NdY)Co₁₄B, (NdY)Fe₁₄B, (ThY)Fe₁₄B <!--beginning with an

Source

Coordinates and cell from the AFLOW Encyclopedia of Crystallographic Prototypes, entry AB14C2_tP68_136_f_ce2j2k_fg-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.