论文标题
实时3D纳米级相干成像通过物理意识到的深度学习
Real-time 3D Nanoscale Coherent Imaging via Physics-aware Deep Learning
论文作者
论文摘要
相位检索是仅从测得的强度中恢复丢失的相信息的问题,是一个反问题,在从天文学到纳米级成像的各种成像方式中广泛面临。当前的相恢复过程本质上是迭代的。结果,图像形成是耗时且计算昂贵的,排除了实时成像。在这里,我们使用3D纳米级X射线成像作为代表性的示例,以开发一个深度学习模型来解决此阶段检索问题。我们介绍了3D-CDI-NN,这是一个深度卷积神经网络和差异编程框架,该框架训练了,可预测3D结构并仅从输入3D X射线相干散射数据中进行压力。我们的网络旨在在多个方面被“物理意识”。因为在网络的训练中明确执行了X射线散射过程的物理学,并且训练数据是从代表材料物理学的原子模拟中得出的。我们通过基于物理的优化程序进一步完善神经网络预测,以最低的计算成本以最大程度的准确性。 3D-CDI-NN可以将3D连贯的衍射模式转化为实际空间结构,并比传统迭代相检索方法快数百倍,而精度的损失可忽略不计。我们集成的机器学习和对阶段检索问题的差异编程解决方案广泛适用于其他应用领域的反问题。
Phase retrieval, the problem of recovering lost phase information from measured intensity alone, is an inverse problem that is widely faced in various imaging modalities ranging from astronomy to nanoscale imaging. The current process of phase recovery is iterative in nature. As a result, the image formation is time-consuming and computationally expensive, precluding real-time imaging. Here, we use 3D nanoscale X-ray imaging as a representative example to develop a deep learning model to address this phase retrieval problem. We introduce 3D-CDI-NN, a deep convolutional neural network and differential programming framework trained to predict 3D structure and strain solely from input 3D X-ray coherent scattering data. Our networks are designed to be "physics-aware" in multiple aspects; in that the physics of x-ray scattering process is explicitly enforced in the training of the network, and the training data are drawn from atomistic simulations that are representative of the physics of the material. We further refine the neural network prediction through a physics-based optimization procedure to enable maximum accuracy at lowest computational cost. 3D-CDI-NN can invert a 3D coherent diffraction pattern to real-space structure and strain hundreds of times faster than traditional iterative phase retrieval methods, with negligible loss in accuracy. Our integrated machine learning and differential programming solution to the phase retrieval problem is broadly applicable across inverse problems in other application areas.