Research/Sitter/MAGNDATA / 0.920_ThMnPN.mcif

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Spin lattice of Th1Mn1P1N1Spin lattice of Th1Mn1P1N1

Th1Mn1P1N1

MAGNDATA entry 0.920 · source
antiferromagnet
No net magnetisation, and up and down sublattices are related by a shift or by inversion, so the bands stay spin-degenerate: a conventional antiferromagnet.
Spin group ¹4/¹m¹m¹m × ²1: each symmetry marked ¹ keeps every spin, ² swaps up and down.
Structure · 10 properties
Magnetic groupP 4′/n′ m′ m BNS 129.416
Point group4′/m′m′m
Parent space groupP 4/n m m No. 129
Spinscollinear · net moment 0 μB per cell
Propagation[0 0 0] 1k
Cella 4.0318 · b 4.0318 · c 8.6878 Å · α 90° · β 90° · γ 90°
Measured at300 K
Magnetic ionsMn
Largest moment component2.69 μB
MethodNPD

Symmetry

Stereogram of the magnetic point group: each operation applied to one direction. Filled = upper hemisphere, ring = lower; red operations include time reversal. Lines are mirrors; polygons are 2/3/4/6-fold axes; the centre ring is inversion.

Every structure in P 4′/n′ m′ m →
Atom sites · 4 sites · CSV
siteelementxyzmambmc|m| (μB)
N1N0.750.250
P1P0.250.250.6621
Mn1Mn0.750.250.5002.692.69
Th1Th0.250.250.1358

Moment components are along the crystal axes a, b, c (μB), as magCIF writes them. Symmetry generates the rest of the cell from these sites.

Source

F. Zhang et al. Inorg. Chem. (2020) · doi:10.1021/acs.inorgchem.9b03294

Cite the original paper and MAGNDATA, not this mirror.

Original file

⬇ 0.920_ThMnPN.mcif from MAGNDATA · entry page

sha256 of this copy: 9fb6a7fd1f0abb719292ab900261e8fa851b3a6639525c2684e944f961f87541
The mirror keeps the bytes Bilbao served, so the original should hash the same unless MAGNDATA has revised the entry since: shasum -a 256 0.920_ThMnPN.mcif.