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- W1985452531 abstract "We have been developing an understanding of the role of correlation (configuration fluctuation) effects on the giant magneto-optic properties of a class of unusual highly anisotropic, magnetically ordered, highly correlated f-electron materials. While orbital polarization in the band calculations improved the ordered moment agreement with experiments for the less correlated materials, the magneto-optic of calculation and experiment remained distinctly different. Moreover, the more highly correlated the material, the worse the agreement of the two quantities. We have now done similar calculations within local-density approximation with gradient (nonlocal) corrections included. While the nonlocal effects introduced by the generalized gradient approximation significantly modify the calculated equilibrium moment and magneto-optic behavior, comparison with experiment reinforces our earlier conclusion that band theory, which treats fluctuations in a time-averaged sense, is inadequate for capturing key effects of interconfigurational fluctuations in correlated-electron systems. Explicit treatment of correlation effects analogous to those we have already reported for the magnetically ordered moments and ordering temperature is necessary for the magneto-optic behavior." @default.
- W1985452531 created "2016-06-24" @default.
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- W1985452531 date "1993-05-15" @default.
- W1985452531 modified "2023-10-17" @default.
- W1985452531 title "Generalized gradient approximation and its effects on the magnetic moments and magneto‐optics off‐electron systems" @default.
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- W1985452531 doi "https://doi.org/10.1063/1.353706" @default.
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