论文标题

在表面和界面结构上相干表面散射成像的多层正向建模

Multislice forward modeling of Coherent Surface Scattering Imaging on surface and interfacial structures

论文作者

Myint, Peco, Chu, Miaoqi, Tripathi, Ashish, Wojcik, Michael J., Zhou, Jian, Cherukara, Mathew J., Narayanan, Suresh, Wang, Jin, Jiang, Zhang

论文摘要

为了研究底物上的纳米结构,通常使用表面敏感的反射几何散射技术,例如放牧入射小角度X射线散射,以产生表面样品的平均统计结构信息。如果使用高度相干的光束,放牧的发生率几何形状可以探测样品的绝对三维结构形态。一致的表面散射成像(CSSI)是一种强大但无创的技术,类似于连贯的X射线衍射成像(CDI),但以小角度和放牧的渗透反射几何形状进行。 CSSI面临的挑战是,常规的CDI重建技术不能直接应用于CSSI,因为基于傅立叶变形的前向模型无法在基板支持的样品的总外部反射的临界角度附近重现动态散射现象。为了克服这一挑战,我们开发了一个多层前进模型,该模型可以成功模拟由表面结构和基础底物产生的动力或多光束散射。还证明,向前模型能够通过通过自动差异和自动分化的快速表现的CUDA辅助Pytorch优化来重建CSSI几何形状中的单个散射图像的细长3D图案。

To study nanostructures on substrates, surface-sensitive reflection-geometry scattering techniques such as grazing incident small angle x-ray scattering are commonly used to yield an averaged statistical structural information of the surface sample. Grazing incidence geometry can probe the absolute three-dimensional structural morphology of the sample if a highly coherent beam is used. Coherent Surface Scattering Imaging (CSSI) is a powerful yet non-invasive technique similar to Coherent X-ray Diffractive Imaging (CDI) but performed at small angles and grazing-incidence reflection geometry. A challenge with CSSI is that conventional CDI reconstruction techniques cannot be directly applied to CSSI because the Fourier-transform-based forward models cannot reproduce the dynamical scattering phenomenon near the critical angle of total external reflection of the substrate-supported samples. To overcome this challenge, we have developed a multislice forward model which can successfully simulate the dynamical or multi-beam scattering generated from surface structures and the underlying substrate. The forward model is also demonstrated to be able to reconstruct an elongated 3D pattern from a single shot scattering image in the CSSI geometry through fast-performing CUDA-assisted PyTorch optimization with automatic differentiation.

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