首页> 外文期刊>International Journal of Quantum Chemistry >Equiatomic rare earth (Ln) transition metal antimonides LnTSb (T=Rh, Ir) and bismuthides LnTBi (T=Rh, Ni, Pd, Pt)
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Equiatomic rare earth (Ln) transition metal antimonides LnTSb (T=Rh, Ir) and bismuthides LnTBi (T=Rh, Ni, Pd, Pt)

机译:等原子稀土(Ln)过渡金属锑化物LnTSb(T = Rh,Ir)和铋化物LnTBi(T = Rh,Ni,Pd,Pt)

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Thirty-eight new ternary equiatomic antimonides and hismuthides were prepared by reaction of the elemental components at high temperatures, and the structures of four compounds were refined from single-crystal X-ray data. The antimonides LnRhSb (Ln = Sm, Gd-Tm) and LnIrSb (Ln = La-Nd, Sm, Gd-Tm) crystallize with the orthorhombic TiNiSi-type structure, which was refined for TbRhSb (a = 713.3(2) pm, b = 452.0(1) pm, c = 778.8(2) pm, R = 0.016 for 306 structure factors and 20 variable parameters) and SmIrSb (a 722.4(2) pm, b = 452.9(1) pm, c = 786.1(2) pm, R = 0.023 for 559 F values and 20 variables). The bismuthides LnRhBi (Ln = Pr-Sm) also crystallize with TiNiSi-type structure which was refined for SmRhBi (a = 728.0(2) pm, b 467.9(1) pm, c = 795.7(2) pm, R = 0.037 for 481 F values and 20 variables). The hexagonal ZrNiAl-type structure was established for the compounds LnRhBi (Ln = Gd-Er) through a structure refinement of DyRhBi (a = 757.9(2) pm, c = 392.6(1) pm, R = 0.026 for 423 F values and 14 variables). The bismuthides LnNiBi (Ln = Pr, Nd, Sm, Tb, Ho, Er), ScPdBi, LnPdBi (Ln = La, Er, Tin, Lu), and LaPtBi are isotypic with cubic MgAgAs. The atomic order for these equiatomic ternary bismuthides was determined for PrNiBi and LaPtBi from X-ray powder data. The structural chemistry of these compounds is briefly discussed. (C) 2002 Elsevier Science (USA). [References: 60]
机译:通过高温条件下元素组分的反应制备了38种新的三元等原子锑化物和组氨酸化物,并从单晶X射线数据中精炼了四种化合物的结构。锑化物LnRhSb(Ln = Sm,Gd-Tm)和LnIrSb(Ln = La-Nd,Sm,Gd-Tm)结晶为斜方晶TiNiSi型结构,并对其精制为TbRhSb(a = 713.3(2)pm, b = 452.0(1)pm,c = 778.8(2)pm,对于306个结构因子和20个可变参数,R = 0.016)和SmIrSb(a 722.4(2)pm,b = 452.9(1)pm,c = 786.1( 2)pm,对于559 F值和20个变量,R = 0.023)。铋化物LnRhBi(Ln = Pr-Sm)也以TiNiSi型结构结晶,该结构经精制为SmRhBi(a = 728.0(2)pm,b 467.9(1)pm,c = 795.7(2)pm,R = 0.037 481 F值和20个变量)。通过DyRhBi(a = 757.9(2)pm,c = 392.6(1)pm,R = 0.026的423 F值)的结构精制,为化合物LnRhBi(Ln = Gd-Er)建立了六方ZrNiAl型结构。 14个变量)。铋化物LnNiBi(Ln = Pr,Nd,Sm,Tb,Ho,Er),ScPdBi,LnPdBi(Ln = La,Er,锡,Lu)和LaPtBi与立方MgAgAs同型。从X射线粉末数据确定PrNiBi和LaPtBi的这些等原子三价铋的原子序。简要讨论了这些化合物的结构化学。 (C)2002 Elsevier Science(美国)。 [参考:60]

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