基于多阶段聚类算法的角分辨光谱学精细结构信息自动提取

IF 5.4 1区 物理与天体物理 Q1 PHYSICS, MULTIDISCIPLINARY Communications Physics Pub Date : 2024-12-06 DOI:10.1038/s42005-024-01878-1
Lingzhu Bian, Chen Liu, Zhen Zhang, Yingke Huang, Xinyu Pan, Yi Zhang, Jiaou Wang, Pavel Dudin, Jose Avila, Zhesheng Chen, Yuhui Dong
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引用次数: 0

摘要

无监督聚类方法在ARPES(角分辨光谱学)空间制图数据的自动分类中显示出强大的能力。然而,在区分不同层和基材引起的细微差异方面仍有改进的余地。在这里,我们提出了一种称为多阶段聚类算法(MSCA)的方法。使用不同能量-动量窗口的真实空间K-means聚类结果/指标作为第二轮动量空间K-means聚类的输入,将突出真实空间中表现出微妙非均匀性的能量-动量窗口。在空间分辨的ARPES数据集中,它可以识别实空间和动量空间中不同类型的电子结构。该方法可用于捕获感兴趣的区域,特别适用于具有复杂波段色散的样品,并且可以成为任何高维科学数据分析的实用工具。角分辨光谱学(ARPES)产生的数据分析的瓶颈是与空间分辨率相关的数据的大小。在早期工作的基础上,作者提出了一种数据处理方法,该方法采用基于无监督机器学习的工具,以提高分析纳米arpes测量产生的数据时的准确性和效率。
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Automatic extraction of fine structural information in angle-resolved photoemission spectroscopy by multi-stage clustering algorithm
Unsupervised clustering method has shown strong capabilities in automatically categorizing the ARPES (ARPES: angle-resolved photoemission spectroscopy) spatial mapping dataset. However, there is still room for improvement in distinguishing subtle differences caused by different layers and substrates. Here, we propose a method called Multi-Stage Clustering Algorithm (MSCA). Using the K-means clustering results/metrics for real space in different energy-momentum windows as the input of the second round K-means clustering for momentum space, the energy-momentum windows that exhibit subtle inhomogeneity in real space will be highlighted. It recognizes different types of electronic structures both in real space and momentum space in spatially resolved ARPES dataset. This method can be used to capture the areas of interest, and is especially suitable for samples with complex band dispersions, and can be a practical tool to any high dimensional scientific data analysis. A bottleneck for the analysis of data produced by angle-resolved photoemission spectroscopy (ARPES) is the size of the data related to spatial resolution. Building on earlier work, the authors present a data processing method that adopts unsupervised machine learning-based tools to improve the accuracy and efficiency when analysing data produced by nano-ARPES measurements.
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来源期刊
Communications Physics
Communications Physics Physics and Astronomy-General Physics and Astronomy
CiteScore
8.40
自引率
3.60%
发文量
276
审稿时长
13 weeks
期刊介绍: Communications Physics is an open access journal from Nature Research publishing high-quality research, reviews and commentary in all areas of the physical sciences. Research papers published by the journal represent significant advances bringing new insight to a specialized area of research in physics. We also aim to provide a community forum for issues of importance to all physicists, regardless of sub-discipline. The scope of the journal covers all areas of experimental, applied, fundamental, and interdisciplinary physical sciences. Primary research published in Communications Physics includes novel experimental results, new techniques or computational methods that may influence the work of others in the sub-discipline. We also consider submissions from adjacent research fields where the central advance of the study is of interest to physicists, for example material sciences, physical chemistry and technologies.
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