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Structure, physical and 27Al NMR-spectroscopic properties of the equiatomic compounds of the type REAlRh (RE = Sm, Tb, Dy, Er, and Lu)
Zeitschrift für Naturforschung B ( IF 0.8 ) Pub Date : 2024-08-13 , DOI: 10.1515/znb-2024-0053
Mathis Radzieowski 1 , Elias C. J. Gießelmann 2 , Stefan Engel 2 , Oliver Janka 2
Affiliation  

Within the series of the equiatomic REAlRh compounds, the representatives with RE = Y, La–Nd, Gd, Ho, Tm and Yb have been synthesized. The members with RE = Sm, Tb, Dy, Er and Lu, however, had not yet been reported. They have now been synthesized and structurally as well as magnetically and NMR-spectroscopically characterized. All members crystallize isostructurally in the orthorhombic TiNiSi type, similar to most of the known analogues. The evolution of their unit cell volumes exhibits the expected decrease due to the lanthanide contraction. While LuAlRh shows Pauli-paramagnetic behavior, SmAlRh, TbAlRh, DyAlRh, ErAlRh, and TmAlRh exhibit antiferromagnetic ground states with Néel temperatures between T N = 45 and 4 K. 27Al MAS-NMR investigations have been conducted on YAlRh and LuAlRh. The results of quantum-chemical calculations support the conclusions drawn from the NMR-spectroscopic study and give information on the charge distribution in these intermetallic aluminum metallides.

中文翻译:


REAlRh 型等原子化合物的结构、物理和 27Al NMR 光谱性质(RE = Sm、Tb、Dy、Er 和 Lu)



在等原子系列中关于AlRh化合物,其代表为关于= Y、La-Nd、Gd、Ho、Tm 和 Yb 已合成。成员们与关于= Sm、Tb、Dy、Er 和 Lu,但尚未报道。它们现已被合成并进行了结构、磁性和核磁共振波谱表征。所有成员均以正交 TiNiSi 型同构结晶,类似于大多数已知的类似物。由于镧系元素收缩,它们的晶胞体积的演变表现出预期的减少。 LuAlRh 表现出泡利顺磁行为,而 SmAlRh、TbAlRh、DyAlRh、ErAlRh 和 TmAlRh 表现出反铁磁基态,尼尔温度介于时间氮= 45 和 4 K。 27 Al MAS-NMR 研究已对 YAlRh 和 LuAlRh 进行。量子化学计算的结果支持了核磁共振波谱研究得出的结论,并提供了有关这些金属间铝金属化物中电荷分布的信息。
更新日期:2024-08-13
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