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Diffraction analysis of layer disorder

机译:层紊乱的衍射分析

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摘要

Defects in the regular sequence of atomic planes can be frequently met in crystalline materials. Not rare is the case where type, quantity and sequence of this kind of defects influence the properties and behaviour of the material. As a matter of fact, planar defects modify the distribution of intensity in reciprocal space, introducing peculiar features in the observed diffraction patterns. Throughout the years, methods have been independently proposed in several scientific fields for extracting the stacking information from the diffraction patterns. An historical review of those studies will be given, starting with simple probabilistic approaches and passing through the matrix method, simulations and Monte Carlo analysis, to end with the OD theory and with the extraction and refinement of stacking probabilities directly from a powder pattern. The most relevant finding of the past and possible perspective for the future will be shown and commented.
机译:晶体材料经常会遇到原子平面规则序列中的缺陷。这种缺陷的类型,数量和顺序会影响材料的特性和性能的情况并不罕见。实际上,平面缺陷改变了相互空间中强度的分布,在观察到的衍射图中引入了特殊的特征。多年来,已经在几个科学领域中独立地提出了用于从衍射图案提取堆叠信息的方法。将对这些研究进行历史回顾,从简单的概率方法开始,通过矩阵方法,模拟和蒙特卡洛分析,再到OD理论以及直接从粉末模式中提取和改进堆积概率的结局。将显示和评论过去最相关的发现以及对未来可能的展望。

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