通过飞秒激光烧蚀火花诱导击穿光谱和机器学习快速准确地识别钢合金

IF 3.2 2区 化学 Q1 SPECTROSCOPY
Xiaoyong He , Bingyan Zhou , Yufeng Yuan , Lingan Kong
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引用次数: 0

摘要

本研究探讨了飞秒激光烧蚀火花诱导击穿光谱法(fs-LA-SIBS)与机器学习算法相结合在快速准确识别钢合金方面的应用。对随机森林(RF)、支持向量机(SVM)和偏最小二乘识别分析(PLS-DA)这三种算法进行了比较和评估。结果表明,在 100 次独立分类中,RF 模型的平均准确率为 0.9337,大大超过 SVM 模型的 0.8281 和 PLS-DA 模型的 0.8646。此外,在 5 倍交叉验证和预测集的评估中,RF 模型的微平均曲线下面积(AUC)达到了近乎完美的 0.9996,超过了 SVM 模型的 0.9761 和 PLS-DA 模型的 0.9847。PCA 结果提供了对分类准确性贡献最大的光谱特征的宝贵见解,进一步证实了 RF 模型的鲁棒性和有效性。这种综合方法为快速分类和准确识别工业应用中的钢合金提供了强有力的工具。
本文章由计算机程序翻译,如有差异,请以英文原文为准。

Rapid and accurate identification of steel alloys by femtosecond laser-ablation spark-induced breakdown spectroscopy and machine learning

Rapid and accurate identification of steel alloys by femtosecond laser-ablation spark-induced breakdown spectroscopy and machine learning

This work investigates the application of femtosecond laser-ablation spark-induced breakdown spectroscopy (fs-LA-SIBS) combined with machine learning algorithms for the rapid and accurate identification of steel alloys. Three algorithms, namely random forest (RF), support vector machine (SVM), and partial least squares identification analysis (PLS-DA), were compared and evaluated. The results indicate that, in 100 independent classifications, the RF model demonstrated an average accuracy of 0.9337, significantly surpassing the accuracies of the SVM model at 0.8281 and the PLS-DA model at 0.8646. In addition, in the evaluation of 5-fold cross-validation and the prediction set, the RF model achieved a near-perfect micro-average area under curve (AUC) of 0.9996, surpassing the AUCs of the SVM model at 0.9761 and the PLS-DA model at 0.9847. The PCA results provided valuable insights into the spectral features that most significantly contributed to the classification accuracy, further confirming the RF model's robustness and effectiveness. This integrated approach offers a powerful tool for the rapid classification and accurate identification of steel alloys in industrial applications.

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来源期刊
CiteScore
6.10
自引率
12.10%
发文量
173
审稿时长
81 days
期刊介绍: Spectrochimica Acta Part B: Atomic Spectroscopy, is intended for the rapid publication of both original work and reviews in the following fields: Atomic Emission (AES), Atomic Absorption (AAS) and Atomic Fluorescence (AFS) spectroscopy; Mass Spectrometry (MS) for inorganic analysis covering Spark Source (SS-MS), Inductively Coupled Plasma (ICP-MS), Glow Discharge (GD-MS), and Secondary Ion Mass Spectrometry (SIMS). Laser induced atomic spectroscopy for inorganic analysis, including non-linear optical laser spectroscopy, covering Laser Enhanced Ionization (LEI), Laser Induced Fluorescence (LIF), Resonance Ionization Spectroscopy (RIS) and Resonance Ionization Mass Spectrometry (RIMS); Laser Induced Breakdown Spectroscopy (LIBS); Cavity Ringdown Spectroscopy (CRDS), Laser Ablation Inductively Coupled Plasma Atomic Emission Spectroscopy (LA-ICP-AES) and Laser Ablation Inductively Coupled Plasma Mass Spectrometry (LA-ICP-MS). X-ray spectrometry, X-ray Optics and Microanalysis, including X-ray fluorescence spectrometry (XRF) and related techniques, in particular Total-reflection X-ray Fluorescence Spectrometry (TXRF), and Synchrotron Radiation-excited Total reflection XRF (SR-TXRF). Manuscripts dealing with (i) fundamentals, (ii) methodology development, (iii)instrumentation, and (iv) applications, can be submitted for publication.
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