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arXiv 1204.0102cond-mat.str-el
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PdAs2O6的磁性:一个具有异常高Néel温度的稀自旋系统

Magnetic properties of PdAs2O6: a dilute spin system with an unusually high Néel temperature

M. Reehuis, T. Saha-Dasgupta, D. Orosel, J. Nuss, B. Rahaman, B. Keimer, O. K. Andersen, M. Jansen

摘要:

用中子粉末衍射研究了PdAs2O6的晶体结构和磁有序模式。虽然PdAs2O6的磁结构与其同构3d同系物NiAs2O6的磁结构相同,但其Néel温度(140 K)远高于NiAs2O6的Néel温度(30 K)。鉴于磁性Pd $^{2+}$离子之间的长距离和间接交换路径,这是令人惊讶的。密度泛函计算产生洞察的电子结构和几何的交换键网络的PdAs2O6和NiAs2O6,并提供了一个半定量的解释大幅度的差异,他们的主要交换相互作用参数。

英文摘要:

The crystal structure and magnetic ordering pattern of PdAs2O6 were investigated by neutron powder diffraction. While the magnetic structure of PdAs2O6 is identical to the one of its isostructural 3d-homologue NiAs2O6, its Néel temperature (140 K) is much higher than the one of NiAs2O6 (30 K). This is surprising in view of the long distance and indirect exchange path between the magnetic Pd$^{2+}$ ions. Density functional calculations yield insight into the electronic structure and the geometry of the exchange-bond network of both PdAs2O6 and NiAs2O6, and provide a semi-quantitative explanation of the large amplitude difference between their primary exchange interaction parameters.

机构、总结、中文摘要均由AI分析而来,可能存在错误,请以论文正文为准。

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