Deep learning assisted ATR-FTIR and Raman spectroscopy fusion technology for microplastic identification

IF 4.9 2区 化学 Q1 CHEMISTRY, ANALYTICAL Microchemical Journal Pub Date : 2025-03-04 DOI:10.1016/j.microc.2025.113224
Haoze Li , Shihan Xu , Jiahao Teng , Xiangheng Jiang , Han Zhang , Yazhou Qin , Yingsheng He , Li Fan
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Abstract

Microplastics, recognized as persistent environmental pollutants, have garnered significant global attention due to their widespread distribution and resistance to degradation. Accurate identification and classification of microplastics are crucial for monitoring pollution levels and assessing potential health risks. In this study, we employed Raman spectroscopy and Attenuated Total Reflection Fourier Transform Infrared Spectroscopy (ATR-FTIR) to analyze eight types of microplastics, establish a spectroscopic database. Additionally, we developed a one-dimensional convolutional neural network (1D-CNN) model that incorporates an embedded multi-head attention mechanism for the classification of eight kinds of microplastics. The recognition accuracy is 73% for ATR-FTIR and 75% for Raman. In order to overcome the shortcomings of single spectral data, a three-level data fusion classification and recognition algorithm were developed to leverage the complementary strengths of ATR-FTIR and Raman spectroscopy. The classification accuracies achieved by the low-level, mid-level, and high-level fusion models were 88%, 97%, and 99%, respectively. We further investigate the model’s applicability to real samples, by conduct spiked tests across three different media (milk, coke and tap water). The data obtained from these tests served as an external validation set to assess the model’s generalization ability. Notably, the recognition accuracy of the high-level fusion model exceeds 98% in all three spiked media. This study provides a more robust and effective method for the accurate classification and identification of microplastic.

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深度学习辅助ATR-FTIR和拉曼光谱融合技术用于微塑料识别
微塑料被认为是持久性环境污染物,由于其广泛分布和耐降解性,引起了全球的广泛关注。准确识别和分类微塑料对于监测污染水平和评估潜在的健康风险至关重要。本研究采用拉曼光谱和衰减全反射傅立叶变换红外光谱(ATR-FTIR)对8种微塑料进行了光谱分析,建立了光谱数据库。此外,我们开发了一个一维卷积神经网络(1D-CNN)模型,该模型包含一个嵌入式多头注意机制,用于对八种微塑料进行分类。ATR-FTIR的识别准确率为73%,Raman的识别准确率为75%。为了克服单光谱数据的缺点,利用ATR-FTIR和拉曼光谱的互补优势,开发了一种三级数据融合分类识别算法。低水平、中级和高级融合模型的分类准确率分别为88%、97%和99%。通过在三种不同的介质(牛奶、可乐和自来水)中进行加标测试,我们进一步研究了该模型对实际样品的适用性。从这些测试中获得的数据作为评估模型泛化能力的外部验证集。值得注意的是,在所有三种加钉介质中,高级融合模型的识别准确率超过98%。本研究为微塑料的准确分类和鉴定提供了一种更为稳健有效的方法。
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来源期刊
Microchemical Journal
Microchemical Journal 化学-分析化学
CiteScore
8.70
自引率
8.30%
发文量
1131
审稿时长
1.9 months
期刊介绍: The Microchemical Journal is a peer reviewed journal devoted to all aspects and phases of analytical chemistry and chemical analysis. The Microchemical Journal publishes articles which are at the forefront of modern analytical chemistry and cover innovations in the techniques to the finest possible limits. This includes fundamental aspects, instrumentation, new developments, innovative and novel methods and applications including environmental and clinical field. Traditional classical analytical methods such as spectrophotometry and titrimetry as well as established instrumentation methods such as flame and graphite furnace atomic absorption spectrometry, gas chromatography, and modified glassy or carbon electrode electrochemical methods will be considered, provided they show significant improvements and novelty compared to the established methods.
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