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Ab initio spin Hamiltonians and magnetism of Ce and Yb triangular-lattice compounds

Leonid Pourovskii et al.
HAL (France) · Papers
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We calculate the crystal-field splitting, ground-state Kramers doublet and intersite exchange interactions within the ground-state doublet manifold using an ab initio Hubbard-I based approach for a representative set of Ce and Yb triangular-lattice compounds. These include the putative quantum spin
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