Superexchange interactions between spin-orbit-coupled j≈1/2 ions in oxides with face-sharing ligand octahedra
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DOI: 10.1103/physrevb.99.115119
Abstract: Using ab initio wave-function-based calculations, we provide valuable insights with regard to the magnetic exchange in $5d$ and $4d$ oxides with face-sharing ligand octahedra, ${\mathrm{BaIrO}}_{3}$ and ${\mathrm{BaRhO}}_{3}$. Surprisingly strong antiferromagnetic Heisenberg interactions as large as… read more here.
Keywords: oxides face; ligand octahedra; face sharing; sharing ligand ... See more keywords