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Electronic structures and magnetic properties of a ferromagnetic insulator: La_2MnNiO_6

机译:铁磁绝缘体的电子结构和磁性:La_2mnnio_6

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We have investigated the electronic structures and magnetic properties of La_2MnNiO_6 that is a typical ferromagnetic insulator with the double perovskite structure. We have examined the valence states of Mn and Ni ions using the full-potential linearized augmented plane wave band method. The density of states as well as the charge density plot are in good agreement with the reported experimental and theoretical results. We have examined the ferromagnetic mechanism in terms of the superexchange interaction. We have calculated the x-ray absorption spectrum based on the band structure results and compared it with the experiment.
机译:我们研究了LA_2MNNIO_6的电子结构和磁性,是具有双钙钛矿结构的典型铁磁绝缘体。我们使用全电位线性化增强平面波段方法检查了Mn和Ni离子的价态。州的密度以及电荷密度图与报告的实验和理论结果吻合良好。我们在超越互动方面检查了铁磁机制。我们已经根据带结构结果计算X射线吸收光谱,并将其与实验相比。

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