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Atomic Super-Resolution Tomography

机译:原子超高分辨率断层扫描

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摘要

We consider the problem of reconstructing a nanocrystal at atomic resolution from electron microscopy images taken at a few tilt angles. A popular reconstruction approach called discrete tomography confines the atom locations to a coarse spatial grid, which is inspired by the physical a priori knowledge that atoms in a crystalline solid tend to form regular lattices. Although this constraint has proven to be powerful for solving this very under-determined inverse problem in many cases, its key limitation is that, in practice, defects may occur that cause atoms to deviate from regular lattice positions. Here we propose a grid-free discrete tomography algorithm that allows for continuous deviations of the atom locations similar to super-resolution approaches for microscopy. The new formulation allows us to define atomic interaction potentials explicitly, which results in a both meaningful and powerful incorporation of the available physical a priori knowledge about the crystal's properties. In computational experiments, we compare the proposed grid-free method to established grid-based approaches and show that our approach can indeed recover the atom positions more accurately for common lattice defects.
机译:我们考虑了从几个倾斜角拍摄的电子显微镜图像以原子分辨率重建纳米晶体的问题。一种流行的称为离散层析成像的重建方法将原子的位置限制在一个粗糙的空间网格中,这是受物理先验知识启发的,即晶体固体中的原子倾向于形成规则的晶格。尽管已证明该约束在许多情况下对于解决此不确定性很强的逆问题非常有效,但其关键限制在于,实际上,可能会出现导致原子偏离规则晶格位置的缺陷。在这里,我们提出了一种无网格离散层析成像算法,该算法允许原子位置的连续偏差,类似于显微镜的超分辨率方法。新的公式使我们能够明确定义原子相互作用的势能,从而有效而有效地结合了有关晶体特性的现有物理先验知识。在计算实验中,我们将提出的无网格方法与已建立的基于网格的方法进行了比较,结果表明我们的方法确实可以更准确地恢复常见晶格缺陷的原子位置。

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