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- W2031197774 abstract "The spin Hamiltonian parameters (g factors and the hyperfine structure constants) and the local structure for the tetragonal Pt 3 + center in BaTiO 3 are theoretically investigated from the improved perturbation formulas of these parameters for a 5d 7 ion in a tetragonally elongated octahedron. The Jahn-Teller effect yields 0.05Å longer Pt 3 + − O 2 − bonds along the C 4 axis. Under the uniaxial [001] stress of 0.17GPa, the impurity center shows a moderate decrease of 12% for the tetragonal elongation and a slight increase of 3% for the core polarization constant, leading to the decline of the anisotropy Δg (= g ⊥ − g //) and the increase of ΔA (= A ⊥ − A //), respectively. The calculated spin Hamiltonian parameters show good agreement with the observed values." @default.
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- W2031197774 date "2012-07-06" @default.
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- W2031197774 title "Theoretical Investigations on the Spin Hamiltonian Parameters and Local Structure for the Tetragonal Pt 3 + Center in BaTiO 3" @default.
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- W2031197774 doi "https://doi.org/10.1007/s13538-012-0089-7" @default.
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