MAGNDATA arrow Collection of Magnetic Structures

MAGNDATA: A Collection of magnetic structures with portable cif-type files

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Ca2YZr2Fe3O12 (#0.752)

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Magnetic structure with all atoms

Magnetic structure with only magnetic atoms

Reference: J. Milam-Guerrero, M. Zheng, N. R. Spence, M. Falsaperna, S. Calder, S. Lapidus, P. J. Saines, B. C. Melot, Inorg. Chem. (2021) 60 8500 - 8506
DOI: 10.1021/acs.inorgchem.1c00113
Atomic positions from: same reference

Parent space group (paramagnetic phase): Ia-3d (#230)
Propagation vector: k1 (0, 0, 0)

Transition Temperature: 18 K
Experiment Temperature: 12 K

Lattice parameters of the magnetic unit cell:
17.8928(6) 17.8928(6) 10.9793(8) 90.00 90.00 120.00
Transformation from parent structure: (a-c,-a+b,1/2a+1/2b+1/2c;0,0,0)
    [View matrix form]

BNS Magnetic Space Group: R-3'c (#167.105) (standard setting)
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Transformation to a standard setting: (a,b,c;0,0,0)
    [View matrix form]
Systematic absences for this Magnetic Space Group via

Magnetic Point Group: -3'm (20.3.73)
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Symmetry-adapted form of material tensors via
Symmetry-adapted form of material tensors for domain-related equivalent structures via

Positions and magnetic moments of symmetry independent atoms:
From now on, magnetic atoms are in boldface and colored in red. Magnetic moments are expressed in units of μB

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LabelAtom typexyzMultiplicitySymmetry constraints on MMxMyMz|M|

    [Show all magnetic atoms in unit cell and their moment relations]

Active Irreps:                                           
Irrep decomposition via

labeldim. full irrepdim. small irrepdirectionactionnumber of modespresence
mGM4- 3 3 special primary 2
mGM2- 1 1 secondary 1 yes

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