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Giant spin splitting and in-plane multiferroicity in wurtzite monolayer hidden phases
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作者 Pu Huang Songyu Chen +4 位作者 Jie Yang Yuxiang Xiao Yongle Zhong Ping Wang Xinqiang Wang 《npj Computational Materials》 2025年第1期4084-4093,共10页
Achieving polarization switching in wurtzite(wz)crystals has long been hindered by substantial energy barriers and high coercive electric fields.Here,we demonstrate that an in-plane ferroelectric(FE)switch can be trig... Achieving polarization switching in wurtzite(wz)crystals has long been hindered by substantial energy barriers and high coercive electric fields.Here,we demonstrate that an in-plane ferroelectric(FE)switch can be triggered within the(0001)crystallographic plane,through the discovery of hiddenAbm2 and Pmc2_(1)monolayer phases.The structural self-reconstruction,induced by lattice expansion,converts interfacial covalent bonds into van der Waals interactions,enabling facile exfoliation of wz monolayers.These monolayers exhibit multiferroic order and diverse electronic functionalities,including giant spin splittings(~540 meV),transition between half-metal and semiconductor,and wide band gaps(0–4.57 eV).Importantly,the FE transition can be finely tuned via a transient state,leading to significant reductions in the barrier energy(<~3 meV/atom)and coercive field(~0.6–1.0 MV/cm),and yielding fully electric control of 100%spin polarization.Our study provides in-depth insights into the inplane FE mechanism in wz systems,opening new avenues for the design and discovery of wz-based FE devices,as well as the rich physics in tetrahedral semiconductors. 展开更多
关键词 giant spin splitting facile exfoliation lattice expansionconverts interfacial covalent bonds energy barriers van der waals interactionsenabling plane multiferroicity polarization switching
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