Magnesium-rich intermetallic compounds Gd5Cu5Mg13 and Tb5Cu5Mg13 – intergrowth variants with CsCl and AlB2 related slabs

IF 0.9 4区 材料科学 Q3 CRYSTALLOGRAPHY Zeitschrift Fur Kristallographie-Crystalline Materials Pub Date : 2023-01-13 DOI:10.1515/zkri-2022-0064
M. Reimann, R. Pöttgen
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Abstract

Abstract The magnesium-rich intermetallic compounds Gd5Cu5Mg13 and Tb5Cu5Mg13 were obtained from direct reactions of the elements (induction melting) in sealed tantalum ampoules. Both compounds crystallize with the orthorhombic Y5Cu5Mg13 type structure, space group Cmcm and Z = 4. The polycrystalline samples were characterized by powder X-ray diffraction. The structure of the gadolinium compound was refined from single crystal X-ray diffraction data: a = 414.78(2), b = 1921.87(12), c = 2573.89(16) pm, wR2 = 0.0492, 1611 F2 values and 77 variables. Refinement of the occupancy parameters revealed a small degree of Gd/Mg mixing for the Gd3 site, leading to the composition Gd4.93(1)Cu5Mg13.07(1) for the studied crystal. The Gd5Cu5Mg13 structure contains slabs of equiatomic GdCuMg, which are embedded in a magnesium matrix. From a geometrical point of view, one can describe the Gd5Cu5Mg13 and Tb5Cu5Mg13 structures as intergrowth variants of distorted W/CsCl and AlB2 related slabs. The most remarkable crystal chemical feature concerns the bcc like magnesium slabs with short Mg–Mg distances ranging from 300 to 342 pm. Temperature dependent magnetic susceptibility measurements show Curie-Weiss paramagnetism for Tb5Cu5Mg13 (10.5(1) μ B Tb atom−1 and Θ P = −11.6(1) K). Antiferromagnetic ordering was detected below the Néel temperatures of T N = 30.5(3) K.
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富镁金属间化合物Gd5Cu5Mg13和Tb5Cu5Mg13 -与CsCl和AlB2相关板的共生变体
摘要在密封钽安瓿中,通过元素的直接反应(感应熔炼)获得了富镁金属间化合物Gd5Cu5Mg13和Tb5Cu5Mg13。两种化合物都结晶为斜方晶系Y5Cu5Mg13型结构,空间群Cmcm,Z=4。用粉末X射线衍射对多晶样品进行了表征。从单晶X射线衍射数据中提炼出钆化合物的结构:a=414.78(2),b=1921.87(12),c=2573.89(16)pm,wR2=0.0492,1611 F2值和77个变量。对占有参数的细化显示,Gd3位点的Gd/Mg混合程度很小,导致所研究晶体的组成为Gd4.93(1)Cu5Mg13.07(1)。Gd5Cu5Mg13结构包含嵌入镁基体中的等原子GdCuMg板。从几何角度来看,可以将Gd5Cu5Mg13和Tb5Cu5Mg13结构描述为畸变W/CsCl和AlB2相关板的共生变体。最显著的晶体化学特征涉及具有短Mg–Mg距离(300至342 pm)的类bcc镁片。温度相关的磁化率测量显示Tb5Cu5Mg13的居里-维斯顺磁性(10.5(1)μB Tb原子−1和θP=−11.6(1)K)。在T N=30.5(3)K的Néel温度以下检测到反铁磁有序。
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来源期刊
CiteScore
2.00
自引率
16.70%
发文量
55
期刊介绍: Zeitschrift für Kristallographie – Crystalline Materials was founded in 1877 by Paul von Groth and is today one of the world’s oldest scientific journals. It offers a place for researchers to present results of their theoretical experimental crystallographic studies. The journal presents significant results on structures and on properties of organic/inorganic substances with crystalline character, periodically ordered, modulated or quasicrystalline on static and dynamic phenomena applying the various methods of diffraction, spectroscopy and microscopy.
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