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Structure analysis of multiphase systems by anomalous small-angle X-ray scattering

机译:小角度X射线散射对多相系统的结构分析

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摘要

The theory of small-angle scattering is reviewed with special attention paid to the anomalous scattering and multiphase systems. A general equation is derived that describes the scattering of a multiphase system as a sum of scattering functions of each of the phases, as if it scattered alone in a two-phase system, and interphase interference scattering functions. These scattering functions depend only on the spatial distribution of the phase boundaries, but not on the scattering density. Contrast variation techniques are most rewarding when the scattering density of only one phase can be varied. For anomalous small-angle X-ray scattering (ASAXS), this means the most favourable is the case in which resonant atoms are contained in one phase only. The general equation involves n(p-1) unknown partial atomic number density differences, where p is the number of phases and n the number of the different atom types in the sample. These partial atomic number density differences can be found if a suitable structure model is applied to calculate the phase scattering functions. Then, the phase compositions and densities can be calculated by solving a system of linear equations incorporating the atom number conservation law. The partial structure factors formalism is also reviewed. Corresponding equations for a system of n types of atoms and p phases are derived. The number of independent partial structure factors is p(p-1)/2 and depends on the number of phases, but not on the number of the types of the atoms in the sample, as in the case of wide-angle scattering.
机译:回顾了小角度散射理论,特别注意了异常散射和多相系统。推导了一个通用方程,该方程将多相系统的散射描述为每个相的散射函数之和,就好像它在两相系统中单独散射一样,并描述了相间干扰散射函数。这些散射功能仅取决于相边界的空间分布,而不取决于散射密度。当只能改变一相的散射密度时,​​对比度变化技术是最有益的。对于异常小角度X射线散射(ASAXS),这意味着最有利的情况是谐振原子仅包含在一个相中。通用方程式涉及n(p-1)个未知的部分原子序数密度差,其中p是相数,n是样品中不同原子类型的数。如果应用合适的结构模型来计算相散射函数,则可以发现这些部分原子序数密度差。然后,可以通过求解结合了原子数守恒定律的线性方程组来计算相组成和密度。还回顾了部分结构因素形式主义。推导了n个原子和p相类型的系统的相应方程式。独立的局部结构因子的数量为p(p-1)/ 2,并且取决于相数,但与广角散射的情况一样,取决于样品中原子的类型数。

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