关于漆性 La0.9-0.1 MnO2.9 化合物的磁性、磁致性和热电性能的实验和 DFT 研究

IF 1.1 3区 物理与天体物理 Q4 PHYSICS, APPLIED Journal of Low Temperature Physics Pub Date : 2024-10-14 DOI:10.1007/s10909-024-03221-y
Chadha Henchiri, Ala Mabrouki, Haishan Zhou, Fatma Argoubi, Shouxi Gu, Qiang Qi, E. Dhahri, M. A. Valente
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引用次数: 0

摘要

采用溶胶-凝胶法制备了La0.9-0.1MnO2.9化合物,旨在获得一种具有有趣的磁致性和热电性能的材料。制备的材料呈斜方晶系,具有 R-3c 空间群。在磁化率与温度关系图中,可以观察到顺磁(PM)-铁磁(FM)转变,居里温度 TC 为 209 K。根据等温磁化曲线计算,样品的磁熵变化峰值以 TC 为中心。总电子密度态(TDOS)显示,自旋上升态具有金属特性,而自旋下降态则具有 Eg = 1.3 eV 的半导体特性。热电性能分析表明,ZT(评估化合物在热电场中的效率)在 420 K 时达到 1.1,表现良好。
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Experimental and DFT Study of the Magnetic, Magnetocaloric and Thermoelectrical Properties of the Lacunar La0.9·0.1 MnO2.9 Compound

The La0.9·0.1MnO2.9 compound were prepared by sol–gel method with the aim of obtaining a material with interesting magnetocaloric and thermoelectric properties. The prepared material crystallized in rhombohedric system with R-3c space group. In the magnetization vs. temperature graph, it is observed a paramagnetic (PM)-ferromagnetic (FM) transition with a Curie temperature TC of 209 K. From the fit of hysteresis cycle at 5 K, it is observed that the dominant contribution is ferromagnetic. A magnetic entropy change, calculated from the isothermal magnetization curves, was observed for the sample with a peak centered on TC. The total electronic density states (TDOS) show the coexistence of metallic behavior for spin-up states and semiconductor characteristic, with a Eg = 1.3 eV, for spin-down states. Thermoelectric properties analysis revealed promising behavior with ZT that assesses the efficacy of a compound in a thermoelectric field, reaching 1.1 at 420 K.

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来源期刊
Journal of Low Temperature Physics
Journal of Low Temperature Physics 物理-物理:凝聚态物理
CiteScore
3.30
自引率
25.00%
发文量
245
审稿时长
1 months
期刊介绍: The Journal of Low Temperature Physics publishes original papers and review articles on all areas of low temperature physics and cryogenics, including theoretical and experimental contributions. Subject areas include: Quantum solids, liquids and gases; Superfluidity; Superconductivity; Condensed matter physics; Experimental techniques; The Journal encourages the submission of Rapid Communications and Special Issues.
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