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Reveals the atomistic mechanism behind enhanced conductivity at grain boundaries, suggesting improved electrical properties of Fe3O4.
GBs arises from a half-metallic-to-metallic transition, which is attributed to the spin-up conduction channel provided by tetrahedrally coordinated Fe sublattice. This study reveals the atomistic mechanism of GB-enhanced conductivity, thereby deepening the understanding of GB electrical property.
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Yao et al. (2026) studied this question.
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