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 Spectrochimica Acta Part B: Atomic Spectroscopy Pub Date : 2024-08-26 DOI:10.1016/j.sab.2024.107031
Xiaoyong He , Bingyan Zhou , Yufeng Yuan , Lingan Kong
{"title":"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","authors":"Xiaoyong He ,&nbsp;Bingyan Zhou ,&nbsp;Yufeng Yuan ,&nbsp;Lingan Kong","doi":"10.1016/j.sab.2024.107031","DOIUrl":null,"url":null,"abstract":"<div><p>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.</p></div>","PeriodicalId":21890,"journal":{"name":"Spectrochimica Acta Part B: Atomic Spectroscopy","volume":"220 ","pages":"Article 107031"},"PeriodicalIF":3.2000,"publicationDate":"2024-08-26","publicationTypes":"Journal Article","fieldsOfStudy":null,"isOpenAccess":false,"openAccessPdf":"","citationCount":"0","resultStr":"{\"title\":\"Rapid and accurate identification of steel alloys by femtosecond laser-ablation spark-induced breakdown spectroscopy and machine learning\",\"authors\":\"Xiaoyong He ,&nbsp;Bingyan Zhou ,&nbsp;Yufeng Yuan ,&nbsp;Lingan Kong\",\"doi\":\"10.1016/j.sab.2024.107031\",\"DOIUrl\":null,\"url\":null,\"abstract\":\"<div><p>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.</p></div>\",\"PeriodicalId\":21890,\"journal\":{\"name\":\"Spectrochimica Acta Part B: Atomic Spectroscopy\",\"volume\":\"220 \",\"pages\":\"Article 107031\"},\"PeriodicalIF\":3.2000,\"publicationDate\":\"2024-08-26\",\"publicationTypes\":\"Journal Article\",\"fieldsOfStudy\":null,\"isOpenAccess\":false,\"openAccessPdf\":\"\",\"citationCount\":\"0\",\"resultStr\":null,\"platform\":\"Semanticscholar\",\"paperid\":null,\"PeriodicalName\":\"Spectrochimica Acta Part B: Atomic Spectroscopy\",\"FirstCategoryId\":\"92\",\"ListUrlMain\":\"https://www.sciencedirect.com/science/article/pii/S0584854724001757\",\"RegionNum\":2,\"RegionCategory\":\"化学\",\"ArticlePicture\":[],\"TitleCN\":null,\"AbstractTextCN\":null,\"PMCID\":null,\"EPubDate\":\"\",\"PubModel\":\"\",\"JCR\":\"Q1\",\"JCRName\":\"SPECTROSCOPY\",\"Score\":null,\"Total\":0}","platform":"Semanticscholar","paperid":null,"PeriodicalName":"Spectrochimica Acta Part B: Atomic Spectroscopy","FirstCategoryId":"92","ListUrlMain":"https://www.sciencedirect.com/science/article/pii/S0584854724001757","RegionNum":2,"RegionCategory":"化学","ArticlePicture":[],"TitleCN":null,"AbstractTextCN":null,"PMCID":null,"EPubDate":"","PubModel":"","JCR":"Q1","JCRName":"SPECTROSCOPY","Score":null,"Total":0}
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。

摘要图片

查看原文
分享 分享
微信好友 朋友圈 QQ好友 复制链接
本刊更多论文
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.

求助全文
通过发布文献求助,成功后即可免费获取论文全文。 去求助
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.
期刊最新文献
Assessment of acupuncture's effectiveness in treating gulf war illness using laser induced breakdown spectroscopy and inductively coupled plasma mass spectrometry Characterization of the distribution of mineral elements in chromium-stressed rice (Oryza sativa L.) leaves based on laser-induced breakdown spectroscopy and data augmentation Rapid determination of 90Sr in seawater using a novel porous crown-based resin and tandem quadrupole ICP-MS/MS in cool plasma and O2-He mode Consideration of spectral interference in total reflection X-ray fluorescence analysis using a limited number of calibration samples: Case study of ocean polymetallic nodules Signal enhancement with double-pulse LIBS on biological samples and better discrimination of tissues through machine learning algorithms
×
引用
GB/T 7714-2015
复制
MLA
复制
APA
复制
导出至
BibTeX EndNote RefMan NoteFirst NoteExpress
×
×
提示
您的信息不完整,为了账户安全,请先补充。
现在去补充
×
提示
您因"违规操作"
具体请查看互助需知
我知道了
×
提示
现在去查看 取消
×
提示
确定
0
微信
客服QQ
Book学术公众号 扫码关注我们
反馈
×
意见反馈
请填写您的意见或建议
请填写您的手机或邮箱
已复制链接
已复制链接
快去分享给好友吧!
我知道了
×
扫码分享
扫码分享
Book学术官方微信
Book学术文献互助
Book学术文献互助群
群 号:481959085
Book学术
文献互助 智能选刊 最新文献 互助须知 联系我们:info@booksci.cn
Book学术提供免费学术资源搜索服务,方便国内外学者检索中英文文献。致力于提供最便捷和优质的服务体验。
Copyright © 2023 Book学术 All rights reserved.
ghs 京公网安备 11010802042870号 京ICP备2023020795号-1