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Several magnetic semiconductors based on the quaternary Heusler compounds

机译:几种基于四元Heusler化合物的磁性半导体

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The successful injection of spin-polarized current into a semiconductor has been expected for a long time in spintronics. The most promising way to achieve it is the use of spin filter materials(SFMs),which are magnetic semiconductors. The diluted magnetic semiconductors (DMSs) such as Ga1-xMnxAs can keep both semiconducting and magnetic behavior. However, this strategy is limited by the low Curie temperatures T, which is lower than the room temperature. It is reported that Heusler compounds usually have high Tc . If we can find magnetic semiconductors in Heusler compounds, we may get the high Tc SFMs . The quaternary Heusler compounds have the most complexest ingredient in the Heusler compounds, which means that they may have more possibilities . Employing ab-initio electronic structure calculations within density functional theory, we show that the quaternary Heusler compounds FeNbVAl, FeNbVGa are magnetic semiconductors . We find a rule of searching for magnetic semiconductors by contrasting the band structure of V2FeAl, FeNbVAl, Nb2FeAl, and FeVNbAl . FeNbVGa can also meet this rule . Under this rule we find FeTiCrAl is also magnetic semiconductor . Though we have not found more evidence by now, we hope our finding help researchers find more magnetic semiconductors .
机译:自旋电子学一直以来都期望将自旋极化电流成功注入半导体。实现这一目标的最有前途的方法是使用自旋滤波器材料(SFM),它们是磁性半导体。诸如Ga1-xMnxAs之类的稀磁半导体(DMS)既可以保持半导体性能,又可以保持磁性能。然而,该策略受到居里温度T的限制,居里温度T低于室温。据报道,Heusler化合物通常具有较高的Tc。如果我们可以在Heusler化合物中找到磁性半导体,那么我们可能会获得高Tc的SFM。四元Heusler化合物在Heusler化合物中具有最复杂的成分,这意味着它们可能具有更多的可能性。利用密度泛函理论中的从头算电子结构计算,我们证明了四元Heusler化合物FeNbVAl,FeNbVGa是磁性半导体。通过对比V2FeAl,FeNbVAl,Nb2FeAl和FeVNbAl的能带结构,我们找到了寻找磁性半导体的规则。 FeNbVGa也可以满足此规则。在此规则下,我们发现FeTiCrAl也是磁性半导体。尽管到目前为止我们还没有找到更多的证据,但是我们希望我们的发现能够帮助研究人员找到更多的磁性半导体。

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