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首页> 外文期刊>International Journal of Quantum Chemistry >Yb-Zn-Al ternary system: CaCu5-type derived compounds in the zinc-rich corner
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Yb-Zn-Al ternary system: CaCu5-type derived compounds in the zinc-rich corner

机译:Yb-Zn-Al三元体系:富含锌的角处CaCu5型衍生的化合物

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As part of a study of the Yb-Zn-Al system, this first article reports the synthesis and crystal structure of four compounds. The crystal structures were determined by single crystal diffractometer data for three of them: Yb3.36Zn30.94Al4.34, hexagonal, P6/mmm, a = 9.061(2) angstrom, c = 8.878(2) angstrom, Z = 1, wR(2) = 0.055, with a structure derived from the SmZn11 similar to type; (Yb6.4ZnAl3.4)-Al-46.8, hexagonal, P6/mmm, a = 9.096(3) angstrom, c = 13.178(5) angstrom, Z = 1, wR(2) = 0.060, with its own structure; Yb12.4Zn96.8Al4.4, hexagonal, P6(3)/mmc, a = 9.068(2) angstrom, c = 26.369(8) Z = 1, wR(2) = 0.088, with a structure derived from the U2Zn17 type. The structure of Yb3Zn17.7Al4.3, tetragonal, I4(1)/amd, a = 8.920(1) angstrom, c = 21.294(1) angstrom, Z = 4, related to the Ce3Zn22 type, was refined from powder data by the Rietveld method. The four structures belong to the same family, derived from the CaCu5 type by replacing totally or partially some Ca atoms with dumbbells of partner elements. All the structures show no order for the aluminium atoms, but they preferentially occupy the dumbbells sharing the sites with zinc. (C) 2006 Elsevier Inc. All rights reserved.
机译:作为Yb-Zn-Al系统研究的一部分,第一篇文章报道了四种化合物的合成和晶体结构。通过单晶衍射仪数据确定其中三个晶体的结构:Yb3.36Zn30.94Al4.34,六角形,P6 / mmm,a = 9.061(2)埃,c = 8.878(2)埃,Z = 1,wR (2)= 0.055,具有源自SmZn11的类似于类型的结构; (Yb6.4ZnAl3.4)-Al-46.8,六角形,P6 / mmm,a = 9.096(3)埃,c = 13.178(5)埃,Z = 1,wR(2)= 0.060,具有自己的结构; Yb12.4Zn96.8Al4.4,六角形,P6(3)/ mmc,a = 9.068(2)埃,c = 26.369(8)Z = 1,wR(2)= 0.088,结构源自U2Zn17类型。根据粉末数据精制了与Ce3Zn22型有关的Yb3Zn17.7Al4.3的正方形,I4(1)/ amd的四边形,a = 8.920(1)埃,c = 21.294(1)埃,Z = 4。 Rietveld方法。这四个结构属于同一族,它们由CaCu5类型衍生而来,该结构通过用伙伴元素的哑铃完全或部分取代一些Ca原子来实现。所有结构均未显示铝原子的顺序,但它们优先占据与锌共享位点的哑铃。 (C)2006 Elsevier Inc.保留所有权利。

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