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Volumn 83, Issue 14, 2011, Pages

CaCu2(SeO3)2Cl2: Spin-12 Heisenberg chain compound with complex frustrated interchain couplings

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EID: 79961061784     PISSN: 10980121     EISSN: 1550235X     Source Type: Journal    
DOI: 10.1103/PhysRevB.83.144423     Document Type: Article
Times cited : (19)

References (42)
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    • Details of the crystal structure investigation may be obtained from Fachinformationszentrum Karlsruhe, D-76344 Eggenstein-Leopoldshafen, Germany (ICSD reference number 422179).
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    • 6 octahedra are squeezed. Consequently, the z axis runs toward O 3 atoms.
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    • 0 from Eq.
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    • Detailed description of the measurement technique can be found in Ref. 39.
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    • ij is a resulting hopping that contains many individual hopping processes, including hopping to and between the ligand orbitals.
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    • This condition makes the chains effectively infinite since the number of possible states for each chain amounts to two: a certain spin can be up or down, which governs the arrangement of all other spins in the chain, independent of the chain length
    • This condition makes the chains effectively infinite since the number of possible states for each chain amounts to two: a certain spin can be up or down, which governs the arrangement of all other spins in the chain, independent of the chain length.
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    • The simulations are done for a finite lattice of 48 × 48 × 24 spins with periodic boundary conditions. We use 20000 sweeps for thermalization and 200000 sweeps after thermalization.
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