Electronic structure and bond competition in the polar magnet PbVO3
作者： D. J. Singh
DOI: 10.1103/PHYSREVB.73.094102
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摘要: Density functional electronic structure studies of tetragonal PbVO{sub 3} are reported. The results show an important role for both Pb 6p-O 2p and V d-O p bonding, with interplay between these. This is discussed in relation to the possibility obtaining magnetoelectric behavior.
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