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高压合成法制备的双有序钙钛矿NaYbZnWO中自旋阻挫的表征

Characterization of the Spin-Frustration in Doubly Ordered Perovskite NaYbZnWO Obtained by High-Pressure Synthesis.

作者信息

Kumar Rahul, Bhat Shrikant, Koo Hyun-Joo, Nam Kiwan, Kim Seong-Hoon, Kim Kee Hoon, Whangbo Myung-Hwan, Sundaresan A

机构信息

School of Advanced Materials, and Chemistry and Physics of Materials Unit, Jawaharlal Nehru Centre for Advanced Scientific Research, Bangalore 560064, India.

Deutsches Elektronen-Synchrotron (DESY), Hamburg 22607, Germany.

出版信息

Inorg Chem. 2025 Mar 3;64(8):3677-3685. doi: 10.1021/acs.inorgchem.4c04122. Epub 2025 Feb 13.

Abstract

We present the high-pressure synthesis of a novel doubly ordered perovskite NaYbZnWO composed of the rare earth magnetic Yb ions and its comprehensive magnetic characterization. The structure consists of alternating layers of Yb and Na ions along the -axis, with Yb ions forming slightly distorted two-dimensional (2D) square lattices of kite-shape (Yb) units. Low-temperature magnetic susceptibility measurements indicate that the ground state of Yb can be described by an effective = 1/2 Kramers doublet. Further, specific heat analysis reveals an internal magnetic field of the order of 1.48 K; however, magnetization data do not exhibit magnetic ordering down to 0.4 K. The spin exchanges of NaYbZnWO evaluated by density functional theory (DFT) calculations unveil spin frustration in the compound. These findings suggest that NaYbZnWO is a promising candidate for realizing a magnetically disordered quantum state.

摘要

我们展示了一种由稀土磁性镱离子组成的新型双有序钙钛矿NaYbZnWO的高压合成及其综合磁性表征。该结构由沿z轴交替排列的镱离子层和钠离子层组成,镱离子形成略微扭曲的二维(2D)风筝形(Yb)单元的方形晶格。低温磁化率测量表明,镱的基态可以用有效自旋S = 1/2的克莱默斯双重态来描述。此外,比热分析揭示了约1.48 K的内磁场;然而,磁化数据在低至0.4 K时未表现出磁有序。通过密度泛函理论(DFT)计算评估的NaYbZnWO的自旋交换揭示了该化合物中的自旋阻挫。这些发现表明,NaYbZnWO是实现磁无序量子态的有前途的候选材料。

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