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首页> 外文期刊>Physica, B. Condensed Matter >Crystal structure of the quaternary compound CuTa2InTe4 from X-ray powder diffraction
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Crystal structure of the quaternary compound CuTa2InTe4 from X-ray powder diffraction

机译:X射线粉末衍射研究四元化合物CuTa2InTe4的晶体结构

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The crystal structure of the new quaternary compound CuTa2InTe4 was studied using X-ray powder diffraction data. The powder pattern refined by the Rietveld method indicates that this material crystallizes in the tetragonal system with space group I-4ˉ2m (No. 121), Z=2, and unit cell parameters a=6.1963(2), c=12.4164(4), c/a=2.00 and V=476.72(3) ?3. The structural and instrumental refinement of 28 parameters led to Rp=10.4%, Rwp=11.1%, Rexp=6.8% and χ2=2.7 for 96 independent reflections.
机译:使用X射线粉末衍射数据研究了新型四元化合物CuTa2InTe4的晶体结构。通过Rietveld方法精制的粉末图案表明,该材料在空间群I-4ˉ2m(No。121),Z = 2和晶胞参数a = 6.1963(2),c = 12.4164(4)的四方体系中结晶。 ,c / a = 2.00且V = 476.72(3)≤3。 28个参数的结构和仪器细化导致96个独立反射的Rp = 10.4%,Rwp = 11.1%,Rexp = 6.8%和χ2= 2.7。

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