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

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Gd2BaCuO5 (#1.443)

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Magnetic structure with all atoms

Magnetic structure with only magnetic atoms


Reference: P. Yanda, I. V. Golosovsky, I. Mirebeau, N. V. Ter-Oganessian, J. Rodriguez-Carvajal, A. Sundaresan et al., PHYSICAL REVIEW RESEARCH (2020) 2 023271
DOI: 10.1103/PhysRevResearch.2.023271
Atomic positions from: same reference

Parent space group (paramagnetic phase): Pnma (#62)
Propagation vector: k1 (0, 0, 1/2)

Transition Temperature: 6 K
Experiment Temperature: 1.3 K

Lattice parameters of the magnetic unit cell:
12.2185 5.67790 14.3290 90.0000 90.0000 90.0000
Transformation from parent structure: (a,b,2c;0,0,0)
    [View matrix form]

BNS Magnetic Space Group: Paca21 (#29.104) (non-standard)
    [View symmetry operations]
Transformation to a standard setting: (c,b,-a;0,1/4,1/8)
    [View matrix form]
Systematic absences for this Magnetic Space Group via

Magnetic Point Group: mm2.1' (7.2.21)
    [View symmetry operations]
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:
     [Show all the atoms]
                                        

LabelAtom typexyzMultiplicitySymmetry constraints on MMxMyMz|M|
Gd1_1Gd0.288600.250000.057804mx,0,mz-6.75(8)0.0-1.295(16)6.87
Gd1_2Gd0.211400.750000.307804mx,0,mz-0.347(4)0.06.86(8)6.87
Gd2_1Gd0.073800.250000.190774mx,0,mz6.17(9)0.02.38(3)6.61
Gd2_2Gd0.426200.750000.440774mx,0,mz-2.56(4)0.0-6.10(9)6.62
Cu_1Cu0.659500.250000.356454mx,0,mz0.272(3)0.0-0.969(10)1.01
Cu_2Cu0.840480.750000.606454mx,0,mz-0.330(4)0.0-0.950(10)1.01

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



Active Irreps:                                           
Irrep decomposition via


labeldim. full irrepdim. small irrepdirectionactionnumber of modes
mZ2 2 2 special primary 12


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