MAGNDATA arrow Collection of Magnetic Structures


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

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Sr2Ru0.95Fe0.05O4 (#1.318)

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Magnetic structure with all atoms

Magnetic structure with only magnetic atoms


Reference: M. Zhu, K.V. Shanavas, Y. Wang, T. Zou, W.F. Sun, W. Tian, V.O. Garlea, A. Podlesnyak, M. Matsuda, M.B. Stone, D. Keavney, Z.Q. Mao, D.J. Singh and X. Ke, Physical Review B (2017) 95 054413.
DOI: 10.1103/physrevb.95.054413
Atomic positions from: ICSD #188554

Parent space group (paramagnetic phase): I4/mmm (#139)
Propagation vector: k1 (1/4, 1/4, 0)

Transition Temperature: 64 K
Experiment Temperature: 4 K

Lattice parameters of the magnetic unit cell:
15.50040 15.50040 12.72780 90.00 90.00 90.00
Transformation from parent structure: (4a,4b,c;0,0,0)
    [View matrix form]

BNS Magnetic Space Group: Ccmca (#64.478) (non-standard)
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Transformation to a standard setting: (c,1/4a-1/4b,1/2a+1/2b;1/8,0,0)
    [View matrix form]
Systematic absences for this Magnetic Space Group via

Magnetic Point Group: mmm.1' (8.2.25)
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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

     [Show only magnetic atoms]                                             Use MVISUALIZE to:
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LabelAtom typexyzMultiplicitySymmetry constraints on MMxMyMz|M|
Ru1Ru0.000000.000000.00000320,0,mz0.00.00.280.28

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



Active Irreps:                                           
Irrep decomposition via


labeldim. full irrepdim. small irrepdirectionactionnumber of modes
mDT2 4 1 special primary 1


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Comments (symmetry):

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