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首页> 外文期刊>International Journal of Quantum Chemistry >The ternary rare earth ruthenium gallides R3Ru4Ga15 (R = Y, Tb-Er) with a new structure type, a further example of a recently recognized large family of structures
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The ternary rare earth ruthenium gallides R3Ru4Ga15 (R = Y, Tb-Er) with a new structure type, a further example of a recently recognized large family of structures

机译:具有新结构类型的三元稀土镓镓化物R3Ru4Ga15(R = Y,Tb-Er),是最近公认的大型结构族的另一个例子

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The title compounds were prepared by reaction of the elemental components at high temperature. They crystallize with a new orthorhombic structure type which was determined from single-crystal diffractometer data of Ho3Ru4Ga15: Pnma, a = 871.7(1) pm, b = 956.4(1) pm, c - 1765.9(3) pm, Z = 4, R = 0.040 for 1039 structure factors and 114 variable parameters. The structure may be viewed as consisting of two kinds of atomic layers, although atomic bonding within and between the layers is comparable strength, as can be judged from the near-neighbor environments, where all of the 15 atomic sites have high coordination numbers. One kind of atomic layers (A) contains all of the holmium and additional gallium atoms in the ratio Ho:Ga = 3:5 with a unit mesh content of 2Ho(3)Ga(5); these layers are flat. The other layers (B) consist of sheets of corner- and edge-sharing condensed RuGa6 octahedra, which are extremely compressed resulting in a hexagonal close-packed, puckered net with a Ru:Ga ratio of 2:5 and a unit mesh content of 4Ru(2)Ga(5). These nets alternate in the sequence ABAB, ABAB, thus yielding the formula 4Ho(3)Ga(5).8Ru(2)Ga(5)=4Ho(3)Ru(4)Ga(15). Similar layers are observed in the structures of Y2Co3Ga9, Gd3Ru4Al12, Er4Pt9Al24, CeOsGa4, CaCr2Al10, and the four stacking variants with the compositions TbRe2Al10, DyRe2Al10, YbFe2Al10, Lind LuRe2Al10. (C) 2003 Elsevier Science (USA). All rights reserved. [References: 26]
机译:通过在高温下使元素组分反应来制备标题化合物。它们通过Ho3Ru4Ga15的单晶衍射仪数据确定了一种新的正交晶体结构类型:Pnma,a = 871.7(1)pm,b = 956.4(1)pm,c-1765.9(3)pm,Z = 4,对于1039个结构因子和114个可变参数,R = 0.040。可以将结构视为由两种原子层组成,尽管从层内和层之间的原子键合具有相当的强度,这可以从15个原子位点均具有高配位数的近邻环境中判断出来。一种原子层(A)以Ho:Ga = 3:5的比例包含所有的and原子和其他镓原子,单位网孔含量为2Ho(3)Ga(5);这些层是平坦的。其他层(B)由角和边缘共享的浓缩RuGa6八面体薄片组成,这些薄片经过高度压缩,形成了六方密实的皱褶网,其Ru:Ga比为2:5,单位网格含量为4Ru(2)Ga(5)。这些网络按顺序ABAB,ABAB交替排列,从而得出公式4Ho(3)Ga(5).8Ru(2)Ga(5)= 4Ho(3)Ru(4)Ga(15)。在Y2Co3Ga9,Gd3Ru4Al12,Er4Pt9Al24,CeOsGa4,CaCr2Al10以及具有TbRe2Al10,DyRe2Al10,YbFe2Al10,Lind LuRe2Al10的四个堆叠变体的结构中观察到相似的层。 (C)2003 Elsevier Science(美国)。版权所有。 [参考:26]

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