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Synthesis of hydroxyapatite and structural refinement by x-ray diffraction

机译:羟基磷灰石的合成及X射线衍射的结构改进

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A sample of hydroxyapatite was synthesized and its crystalline structure was analyzed by X-ray diffraction by means of the Rietveld method. Two functions were used to fit the peak profiles, modified Voigt (TCHZ) and Pearson VII. The occupational factors and lattice parameters obtained by both models show that the sample does not contain relevant cationic substitutions. The interatomic distances from Ca1 to oxygens O1, O2 and O3 were adequate for a pure hydroxyapatite without defect at site Ca1. Besides, the use of multiple lines in planes (300) and (002) associated with the model Pearson VII resulted in good agreement with the TCHZ model with respect to the size-strain effectswith an ellipsoidal shape of crystallites. In conclusion, the procedures adopted in the synthesis of hydroxyapatite produced a pure and crystalline material. The experimental results of transmission electron microscopy confirmed the predicted shape of crystals.
机译:合成了羟基磷灰石样品,并通过Rietveld方法通过X射线衍射分析了其晶体结构。使用两个函数来拟合峰轮廓,即改进的Voigt(TCHZ)和Pearson VII。通过两个模型获得的职业因子和晶格参数表明该样品不包含相关的阳离子取代。从Ca1到氧O1,O2和O3的原子间距离足以形成纯羟基磷灰石,而Ca1处没有缺陷。此外,在与模型Pearson VII相关联的平面(300)和(002)中使用多条线,在微晶的椭圆形形状尺寸效应方面,与TCHZ模型具有很好的一致性。总之,在合成羟基磷灰石中所采用的程序产生了纯净且结晶的材料。透射电子显微镜的实验结果证实了预测的晶体形状。

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