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arxiv: 1610.07113 · v1 · pith:JC3KJVHOnew · submitted 2016-10-23 · ❄️ cond-mat.mtrl-sci · cond-mat.str-el

Unusual UUDD magnetic chain structure of the spin-1/2 tetragonally distorted spinel GeCu2O4

classification ❄️ cond-mat.mtrl-sci cond-mat.str-el
keywords spinstructureuuddcalculationschaincouplinggecu2o4ions
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GeCu2O4 exhibits a tetragonal spinel structure due to the strong Jahn-Teller distortion associated with Cu2+ ions. We show that its magnetic structure can be described as slabs composed of a pair of layers with orthogonally oriented spin 1/2 Cu chains in the basal ab plane. The spins between the two layers within a slab are collinearly aligned while the spin directions of neighboring slabs are perpendicular to each other. Interestingly, we find that spins along each chain form an unusual up-up-down-down (UUDD) pattern, suggesting a non-negligible nearest-neighbor biquadratic exchange interaction in the effective classical spin Hamiltonian. We hypothesize that spin-orbit coupling and orbital mixing of Cu2+ ions in this system is non-negligible, which calls for future calculations using perturbation theory with extended Hilbert (spin and orbital) space and calculations based on density functional theory including spin-orbit coupling and looking at the global stability of the UUDD state.

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