Research/Sitter/MAGNDATA / 0.1147_CrSbS3.mcif

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Spin lattice of Cr1Sb1S3Spin lattice of Cr1Sb1S3

Cr1Sb1S3

MAGNDATA entry 0.1147 · 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 ¹m¹m¹m × ²1: each symmetry marked ¹ keeps every spin, ² swaps up and down.
ordered ≤ 80 K (−193 °C)Colour: where that sits relative to 25 °C. Saturation: how much margin it has.
Structure · 11 properties
Magnetic groupP n m′ a BNS 62.444
Point groupm′mm
Parent space groupP n m a No. 62
Spinscollinear · net moment 0 μB per cell
Propagation[0 0 0] 1k
Cella 8.6652 · b 3.6188 · c 12.872 Å · α 90° · β 90° · γ 90°
Transition80 K (−193 °C)
Measured at5 K
Magnetic ionsCr
Largest moment component2.37 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 n m′ a →
Atom sites · 5 sites · CSV
siteelementxyzmambmc|m| (μB)
Cr1Cr0.15390.250.04522.37002.37
Sb1Sb0.52620.250.8392
S1S0.50360.250.6077
S2S0.78710.250.2887
S3S0.67150.250.0105

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

Chen Li et al. J. Am. Chem. Soc. (2025) · doi:10.1021/jacs.4c17892

Cite the original paper and MAGNDATA, not this mirror.

Original file

⬇ 0.1147_CrSbS3.mcif from MAGNDATA · entry page

sha256 of this copy: cfc7c81b5130a2632027ea9e63e8c7149c0a57256a01fdc7ac2201a530aea307
The mirror keeps the bytes Bilbao served, so the original should hash the same unless MAGNDATA has revised the entry since: shasum -a 256 0.1147_CrSbS3.mcif.