PID3Net:用于动态现象的单次相干x射线衍射成像的深度学习方法

IF 9.4 1区 材料科学 Q1 CHEMISTRY, PHYSICAL
Tien-Sinh Vu, Minh-Quyet Ha, Adam Mukharil Bachtiar, Duc-Anh Dao, Truyen Tran, Hiori Kino, Shuntaro Takazawa, Nozomu Ishiguro, Yuhei Sasaki, Masaki Abe, Hideshi Uematsu, Naru Okawa, Kyosuke Ozaki, Kazuo Kobayashi, Yoshiaki Honjo, Haruki Nishino, Yasumasa Joti, Takaki Hatsui, Yukio Takahashi, Hieu-Chi Dam
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引用次数: 0

摘要

本文介绍了一种基于深度学习(DL)的相位检索方法,该方法适用于单镜头、多帧相干x射线衍射成像(CXDI),专为在更大样本中可视化局部纳米结构动力学而设计。当前的相位检索方法往往难以实现高时空分辨率、处理动态成像和管理计算成本,这限制了它们在观察纳米结构动力学方面的适用性。本研究通过开发一种新的方法来解决这些差距,该方法利用前馈架构和利用测量设置的物理信息策略,能够从照明区域的随时间变化的衍射图像中重建动态“电影”。该方法结合了关键的增强功能,如时间卷积块来捕获时空相关性,以及应用于重建对象的统一电视正则化,从而提高了降噪和空间平滑性。采用扩展的评价框架,包括多个指标和系统敏感性分析,对方法的性能和鲁棒性进行综合评价。概念验证实验,包括移动Ta测试图和胶体金颗粒(分散在聚乙烯醇水溶液中)的同步加速器硬x射线的数值模拟和成像实验,验证了该方法的高成像性能。实验结果表明,该方法在较短的曝光时间内成功地重建了样品中的结构,显著优于传统方法和目前基于dl的方法。该方法提供了高效可靠的动态图像重建和低计算成本,使其适用于探索需要高时空分辨率的基于同步加速器或自由电子激光的快速发展现象。
本文章由计算机程序翻译,如有差异,请以英文原文为准。

PID3Net: a deep learning approach for single-shot coherent X-ray diffraction imaging of dynamic phenomena

PID3Net: a deep learning approach for single-shot coherent X-ray diffraction imaging of dynamic phenomena

This paper introduces a deep learning (DL)-based method for phase retrieval tailored to single-shot, multiple-frame coherent X-ray diffraction imaging (CXDI), designed specifically for visualizing local nanostructural dynamics within a larger sample. Current phase retrieval methods often struggle with achieving high spatiotemporal resolutions, handling dynamic imaging, and managing computational costs, which limits their applicability in observing nanostructural dynamics. This study addresses these gaps by developing a novel method that leverages a feedforward architecture with a physics-informed strategy utilizing measurement settings, enabling the reconstruction of dynamic “movies" from time-evolving diffraction images of the illuminated area. The method incorporates key enhancements, such as temporal convolution blocks to capture spatiotemporal correlations and a unified TV regularization applied to the reconstructed object, resulting in improved noise reduction and spatial smoothness. An expanded evaluation framework, including multiple metrics and systematic sensitivity analysis, is employed to comprehensively assess the method’s performance and robustness. Proof-of-concept experiments, including numerical simulations and imaging experiments of a moving Ta test chart and colloidal gold particles (dispersed in aqueous polyvinyl alcohol solutions) with synchrotron hard X-rays, validate the high imaging performance of this method. Experimental results demonstrate that structures in the sample have been successfully reconstructed at short exposure times, significantly outperforming both traditional methods and current DL-based methods. The proposed method provides efficient and reliable reconstruction of dynamic images with low computational costs, making it suitable for exploring fast-evolving phenomena in synchrotron- or free-electron laser-based applications requiring high spatiotemporal resolutions.

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来源期刊
npj Computational Materials
npj Computational Materials Mathematics-Modeling and Simulation
CiteScore
15.30
自引率
5.20%
发文量
229
审稿时长
6 weeks
期刊介绍: npj Computational Materials is a high-quality open access journal from Nature Research that publishes research papers applying computational approaches for the design of new materials and enhancing our understanding of existing ones. The journal also welcomes papers on new computational techniques and the refinement of current approaches that support these aims, as well as experimental papers that complement computational findings. Some key features of npj Computational Materials include a 2-year impact factor of 12.241 (2021), article downloads of 1,138,590 (2021), and a fast turnaround time of 11 days from submission to the first editorial decision. The journal is indexed in various databases and services, including Chemical Abstracts Service (ACS), Astrophysics Data System (ADS), Current Contents/Physical, Chemical and Earth Sciences, Journal Citation Reports/Science Edition, SCOPUS, EI Compendex, INSPEC, Google Scholar, SCImago, DOAJ, CNKI, and Science Citation Index Expanded (SCIE), among others.
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