首页> 外文期刊>International Journal of Quantum Chemistry >Structures and properties of the perovskite-type compounds Na1-xSrxNbO3 (0.1 <= x <= 0.9) - From insulating to metallic conductivity
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Structures and properties of the perovskite-type compounds Na1-xSrxNbO3 (0.1 <= x <= 0.9) - From insulating to metallic conductivity

机译:钙钛矿型化合物Na1-xSrxNbO3(0.1 <= x <= 0.9)的结构和性质-从绝缘到金属导电

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Reduced perovskite-type compounds with compositions Na1-xSrxNbO3 (0.1less than or equal toxless than or equal to0.9) have been synthesized. X-ray powder diffraction (XRD) studies for the 0.2less than or equal toxless than or equal to0.7 phases indicate a tetragonal structure (P4/mbm) with unit-cell parameters aapproximate toroot2 x a(per), capproximate toa(per) (the subscript 'per' refers to the cubic perovskite structure), and for x = 0.8 and 0.9, the space group P4/mmm was found with aapproximate toa(per), capproximate toa(per). Structure refinements based on XRD and neutron diffraction data using the Rietveld technique confirmed this for Na1-xSrxNbO3, 0.3less than or equal toxless than or equal to0.7 and x = 0.5, 0.6, respectively. Selected-area and convergent beam electron diffraction studies show that the crystallites of x = 0.2 and 0.3 phases in fact have the GdFeO3-type structure (space group Pnma and unit-cell parameters aapproximate toroot2 x a(per), bapproximate to2 x a(per), capproximate toroot2 x a(per),) while crystallites in the 0.4less than or equal toxless than or equal to0.9 samples consist of intergrown domains between this orthorhombic structure and the tetragonal structure (P4/mbm). The reason for the appearance of two phases is due to local variations in the Na/Sr content within the crystallites. Measurements of the magnetic susceptibilities show that the itinerant behavior in the samples Na1-xSrxNbO3 increases with the carrier concentration. The resistivity measurements indicate that an insulator-metal transition takes place between x = 0.5 and 0.6. The samples with x = 0.4 and 0.5 exhibit a complex temperature dependence of the resistivity with a maximum around 70 K. (C) 2002 Elsevier Science (USA). [References: 18]
机译:已经合成了具有Na1-xSrxNbO3(小于或等于等于0.1或小于等于0.9)组成的还原钙钛矿型化合物。 X射线粉末衍射(XRD)研究了小于等于0.2等于小于等于0.7的相,表明其四边形结构(P4 / mbm)的晶胞参数近似于root2 xa(per),近似于toa(per) (下标“ per”是指立方钙钛矿结构),并且对于x = 0.8和0.9,发现空间群P4 / mmm具有近似toa(per),上限为toa(per)。使用Rietveld技术基于XRD和中子衍射数据对结构进行的改进证实了Na1-xSrxNbO3的含量分别小于或等于0.3且等于或小于0.7,且x = 0.5、0.6。选定区域和会聚束电子衍射研究表明,x = 0.2和0.3相的微晶实际上具有GdFeO3-型结构(空间群Pnma和晶胞参数近似于root2 xa(per),近似于2 xa(per) ,接近于root2 xa(per),而0.4小于或等于0.9或小于等于0.9的样品中的微晶由正交晶体结构和四方结构之间的互生域组成(P4 / mbm)。出现两相的原因是由于微晶内Na / Sr含量的局部变化。磁化率的测量表明,样品Na1-xSrxNbO3中的巡回行为随载流子浓度的增加而增加。电阻率测量表明,绝缘体-金属的过渡发生在x = 0.5和0.6之间。 x = 0.4和0.5的样品表现出电阻率的复杂温度依赖性,最大值约为70K。(C)2002 Elsevier Science(美国)。 [参考:18]

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