【2h】

Crystal structure of the ternary silicide Gd2Re3Si5

机译:三元硅化物Gd2Re3Si5的晶体结构

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摘要

A single crystal of the title compound, the ternary silicide digadolinium trirhenium penta­silicide, Gd2Re3Si5, was isolated from an alloy of nominal composition Gd20Re30Si50 synthesized by arc melting and investigated by X-ray single-crystal diffraction. Its crystal structure belongs to the U2Mn3Si5 structure type. All atoms in the asymmetric lie on special positions. The Gd site has site symmetry m..; the two Mn atoms have site symmetries m.. and 2.22; the three Si atoms have site symmetries m.., ..2 and 4.. . The coordination polyhedra of the Gd atoms have 21 vertices, while those of the Re atoms are cubo­octa­hedra and 13-vertex polyhedra. The Si atoms are arranged as tricapped trigonal prisms, bicapped square anti­prisms, or 11-vertex polyhedra. The crystal structure of the title compound is also related to the structure types CaBe2Ge2 and W5Si3. It can be represented as a stacking of Gd-centred polyhedra of composition [GdSi9]. The Re atoms form infinite chains with an Re—Re distance of 2.78163 (5) Å and isolated squares with an Re—Re distance of 2.9683 (6) Å.
机译:从电弧熔化合成的标称组成为Gd20Re30Si50的合金中分离出标题化合物的单晶三元硅化的三dig硅化三tri五硅化物Gd2Re3Si5,并通过X射线单晶衍射进行了研究。其晶体结构属于U2Mn3Si5结构类型。非对称中的所有原子都位于特殊位置。 Gd部位具有部位对称性m ..;两个Mn原子的位置对称性分别为m ..和2.22;三个硅原子的位置对称性分别为m ..,.. 2和4..。 Gd原子的配位多面体有21个顶点,而Re原子的配位多面体有立方八面体和13个顶点多面体。 Si原子排列为三棱柱三角棱柱,三棱柱方形反棱镜或11顶点多面体。标题化合物的晶体结构还与结构类型CaBe2Ge2和W5Si3有关。它可以表示为组成为[GdSi9]的以Gd为中心的多面体的堆叠。 Re原子形成Re-Re距离为2.78163(5)Å的无限链和Re-Re距离为2.9683(6)Å的孤立方阵。

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