论文标题

在基于双钙钛矿的沮丧三角形晶格抗Fiferromagnet Ba2mnteo6中的短期和远程磁顺序的发展

Development of short and long-range magnetic order in the double perovskite based frustrated triangular lattice antiferromagnet Ba2MnTeO6

论文作者

Khatua, J., Arh, T., Mishra, Shashi B., Luetkens, H., Zorko, A., Sana, B., Rao, M. S. Ramachandra, Nanda, B. R. K., Khuntia, P.

论文摘要

氧化双钙质,其中3D元素和基于SP的重元素形成的八面体会导致非常规磁有序以及相关的量子现象对于未来派应用至关重要。在这里,通过进行实验和第一原理研究,我们介绍了BA2MNTEO6的电子结构和磁相,其中Mn^2+离子具有S = 5/2旋转,构成了完美的三角晶格。磁敏感性揭示了较大的质地温度-152 k,表明在自旋晶格中Mn^2+矩之间存在强烈的抗铁磁相互作用。通过磁化率和比热的特异性热揭示了在20 K处的相变,这归因于存在较大的平面间相互作用。在过渡温度以下,比热数据显示抗铁磁磁化激发,缝隙为1.4 k。此外,muon旋转 - 延伸延伸揭示了在有序状态下存在静态内部场,并提供了t> tn的短距离自旋相关的有力证据。 DFT+U计算和自旋二聚体分析推断,海森堡相互作用控制着该钙钛矿中的间和内旋转旋转施法。间和层内交换相互作用具有可比的强度(J1 = 4.6 K,J2 = 0.92 J1)。然而,由于通过线性路径MN-O-TE-O-MN的双交换相互作用,存在一个弱的第三邻邻磁铁间相互作用(J3 = -0.04 J1)。 J2和J3相互作用的组合效应稳定了这款沮丧的磁体中的三维远程磁顺序。

Oxide double perovskites wherein octahedra formed by both 3d elements and sp-based heavy elements give rise to unconventional magnetic ordering and correlated quantum phenomena crucial for futuristic applications. Here, by carrying out experimental and first principles investigations, we present the electronic structure and magnetic phases of Ba2MnTeO6, where Mn^2+ ions with S = 5/2 spins constitute a perfect triangular lattice. The magnetic susceptibility reveals a large Curie- Weiss temperature -152 K suggesting the presence of strong antiferromagnetic interactions between Mn^2+ moments in the spin lattice. A phase transition at 20 K is revealed by magnetic susceptibility and specific heat which is attributed to the presence of a sizeable inter-plane interactions. Below the transition temperature, the specific heat data show antiferromagnetic magnon excitations with a gap of 1.4 K. Furthermore, muon spin-relaxation reveals the presence of static internal fields in the ordered state and provides strong evidence of short-range spin correlations for T > TN. The DFT+U calculations and spin-dimer analysis infer that Heisenberg interactions govern the inter and intra-layer spin-frustrations in this perovskite. The inter and intra-layer exchange interactions are of comparable strengths (J1 = 4.6 K, J2 = 0.92 J1). However, a weak third nearest-neighbor ferromagnetic inter-layer interaction exists (J3=-0.04 J1) due to double-exchange interaction via the linear path Mn-O-Te-O-Mn. The combined effect of J2 and J3 interactions stabilizes a three dimensional long-range magnetic ordering in this frustrated magnet.

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