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- W2159246459 abstract "Abstract We review our investigations of electronic properties of strongly correlated materials using the combination of first principles electronic band structures and the dynamical mean‐field theory, so called LDA+DMFT method. Our investigations focus on two phenomena, the spin state transitions and their relationship to the metal‐insulator transition, and the effect of hybridization between correlated and ligand orbitals in charge‐transfer type materials. The pressure driven spin transitions are studied for a group of materials containing MnO, FeO and Fe 2 O 3 . To investigate the hybridization effects we focus on NiO and NiS(Se) 2 . We identify various mechanisms of the metal‐insulator transition, which can take place in multi‐band systems, in addition to the band‐width control known from the single band Hubbard model." @default.
- W2159246459 created "2016-06-24" @default.
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- W2159246459 date "2011-08-26" @default.
- W2159246459 modified "2023-10-16" @default.
- W2159246459 title "Various scenarios of metal-insulator transition in strongly correlated materials" @default.
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- W2159246459 doi "https://doi.org/10.1002/andp.201100027" @default.
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