Laser-induced breakdown spectroscopy combined with multi-task convolutional neural network for analyzing Sm, Nd, and Gd elements in uranium polymetallic ore

IF 3.8 2区 化学 Q1 SPECTROSCOPY
Zhuo Wu , Jian Wu , Xinyu Guo , Huihui Zhu , Yubo Zhang , Xiaohui Su , Fuli Chen , Minghui Li , Runhui Wang , Keyi Xu , Tao Lü
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Abstract

When analyzing rare earth elements in uranium polymetallic ores using laser-induced breakdown spectroscopy (LIBS), issues such as spectral interference and overlap significantly reduce the accuracy of elemental analysis. A multi-task convolutional neural network (CNN) model based on an uncertainty-weighted loss function is developed, with raw LIBS spectral data as the input. Conduct experiments using pure oxides under the same experimental conditions to identify the characteristic spectral lines. The results show that, compared to normalized and feature-extracted data processed with partial least squares (PLS), random forests (RF), and single-task CNN models, multi-task CNN model with uncertainty loss achieves the best quantitative results for Sm and Nd elements (Sm: R2 = 0.9939, RMSE = 0.6373; Nd: R2 = 0.9987, RMSE = 0.3040), and also demonstrates excellent performance in quantifying Gd (R2 = 0.9949, RMSE = 0.6106). The multi-task CNN model based on an uncertainty-weighted loss function indicates great potential applications for end-to-end processing of LIBS spectra from uranium polymetallic ore. © 2001 Elsevier Science. All rights reserved.

Abstract Image

激光诱导击穿光谱结合多任务卷积神经网络分析铀多金属矿中的Sm、Nd和Gd元素
在使用激光诱导击穿光谱(LIBS)分析铀多金属矿中的稀土元素时,光谱干扰和重叠等问题严重降低了元素分析的准确性。以原始LIBS光谱数据为输入,建立了基于不确定性加权损失函数的多任务卷积神经网络(CNN)模型。在相同的实验条件下,用纯氧化物进行实验,确定特征谱线。结果表明,与偏最小二乘(PLS)、随机森林(RF)和单任务CNN模型处理的归一化和特征提取数据相比,具有不确定性损失的多任务CNN模型对Sm和Nd元素的定量结果最好(Sm: R2 = 0.9939, RMSE = 0.6373;Nd: R2 = 0.9987, RMSE = 0.3040),并且在量化Gd方面也表现出色(R2 = 0.9949, RMSE = 0.6106)。基于不确定性加权损失函数的多任务CNN模型显示了铀多金属矿LIBS光谱端到端处理的巨大潜在应用。©2001 Elsevier Science。版权所有。
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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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