ISSN   1004-0595

CN  62-1224/O4

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基于红外光谱的多标签一维卷积神经网络实现润滑油中添加剂分类识别

Multi-Label One-Dimensional Convolutional Neural Network Based on Infrared Spectroscopy for the Identification of Additives in Lubrication Oils

  • 摘要: 对于润滑油中添加剂的识别问题,选用聚α-烯烃(PAO40)和多元醇酯(PriEco3000)的混兑基础油与4种常见商用润滑油极压抗磨添加剂MoDTC、ZDDP、L135和L57按照不同比例调配润滑油样本. 利用傅里叶变换红外光谱仪采集样本的中红外光谱,并对所获光谱进行一阶求导和二阶求导;基于多目标分类思想,提出了1种多标签一维卷积神经网络(ML-1D-CNN)模型,对输入的润滑油红外光谱进行有监督的特征筛选和添加剂物质识别;引入梯度加权分类激活映射(Grad-CAM),用于观测模型对输入数据的特征提取结果的有效性. 将模型与近年文献中出现的3种混合模型进行对比分析,结果显示:所提出的模型提取的光谱特征与原始光谱特征峰有很好的对应性,ML-1D-CNN模型的表现最为优异,对添加剂的识别准确率为93.33%~100%,具有较强的添加剂同步识别能力. 此外,在掺杂模型训练样本之外的添加剂时,ML-1D-CNN模型对已训练过的添加剂仍具有令人满意的识别率,具有较高的泛化能力.

     

    Abstract: Lubricating oil additive is a chemical substance used to improve and enhance the original performance of oil products, endowing oil products with new characteristics and is widely used in various types of lubricating oils. Exploring effective methods for component analysis and substance identification of additives in lubricating oil has practical significance and theoretical value for the identification and evaluation of new oil quality, and the determination of using oil operation and maintenance plans. It has always been a research direction of concern for scholars. Focused on the issue of identifying additives in lubricating oil, polyalphaolefins (PAO40) and Polyol ester (PriEco3000) were mixed as base oil and four common commercial additives (MoDTC, ZDDP, L135 and L57) were blended in different proportions to prepare lubricating oil samples. Fourier transform infrared radiation (FT-IR) was employed to collect mid-infrared spectral information of the samples, which were then subjected to first and second derivative processing. The three spectra were integrated into a Lube oil feature matrix as the input of the model for displaying the feature information of lubricating oil FT-IR spectra to the greatest extent. Different from the traditional single-spectrum and single-label classification task, the identification of additives in lubricating oil essentially reflected the existence of multiple labels in a single FT-IR spectrum. Based on the idea of multi-label classification, a Multi-Label One-Dimensional Convolutional Neural Network (ML-1D-CNN) model was proposing. The model performed supervised feature selection and additive recognition on the input lubricating oil infrared spectra. Deep learning model that was correct and had a certain degree of generalization ability should be able to extract the FT-IR spectral features of each additive, and the effect of feature extraction was an important criterion for judging the correctness of the model. Gradient-weighted Class Activation Mapping (Grad-CAM) was introduced to observe the effect of the models in extracting features from input data. Experimental results revealled that the spectral features extracted by the proposed models corresponding well with the original spectral feature peaks. It was shown that the model could effectively and correctly study the FT-IR spectra of each additive. Whether on the validation set of the training process or on additional test set data, a comparison with three hybrid models PCA+PLS-DA, SPA+SVM and IGA+RF recently mentioned in the literature showed that ML-1D-CNN model performed exceptionally, achieving an recognition accuracy rate of 93.33% to 100% for individual additives and demonstrated strong synchronous recognition capabilities for similar additives. Furthermore, the ML-1D-CNN model maintained a satisfactory recognition rate for additives trained outside the model samples, showing a good generalization ability.

     

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