利用反射光谱和机器学习分类技术改进聚酯生物塑料的光学分类

IF 4.7 2区 化学 Q2 MATERIALS SCIENCE, MULTIDISCIPLINARY
Alexis Hocken, Sharona Huang, Eleanor Ng and Bradley D. Olsen*, 
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引用次数: 0

摘要

在过去的几十年里,生物基可堆肥聚合物的几个例子已经实现了商业化,显示出解决塑料可持续性危机的希望。虽然它们的可组合性最大限度地减少了对垃圾填埋场的影响,但大规模使用这些材料作为一次性塑料将需要大量的资源用于作物生产,以满足当前的塑料需求。虽然这些热塑性塑料原则上是机械可回收的,但无法有效地将它们与聚(对苯二甲酸乙酯)分离,阻碍了实际的回收计划,使它们能够重新使用。这项工作探讨了光学分类的潜在进展,使聚酯生物塑料的分类。收集了500多个样本的近红外(NIR)和中红外(MIR)光谱数据,用于机器学习分类。研究了随机森林(RF)、K近邻(kNN)和结合PCA-RF和PCA-kNN的主成分分析(PCA)四种分类方案。两个红外区域的预测精度均为92%,通过实施模型置信度阈值,预测精度可进一步提高至98%。对样品属性及其对材料分类影响的探索表明,样品颜色和不透明度对近红外区域的分类影响最大,而MIR区域则不受影响。此外,进行了特征重要性分析和特征约简,表明光学分选器可以实现更小的特征集,以便仅使用最具信息量的波长更有效地扫描样品。最后,在样本光谱中引入高斯合成噪声来模拟环境噪声,验证了该分类模型对外界噪声有一定的容忍度。
本文章由计算机程序翻译,如有差异,请以英文原文为准。

Improving the Optical Sorting of Polyester Bioplastics via Reflectance Spectroscopy and Machine Learning Classification Techniques

Improving the Optical Sorting of Polyester Bioplastics via Reflectance Spectroscopy and Machine Learning Classification Techniques

Several examples of bio-based, compostable polymers have reached commercialization over the past several decades, showing promise for addressing the plastics sustainability crisis. Although their composability minimizes the impact in landfills, employing these materials as single use plastics on a large scale would require exhaustive amounts of resources for crop production to meet current plastic demands. While these thermoplastics are, in principle, mechanically recyclable, the inability to effectively separate them from poly(ethylene terephthalate) impedes practical recycling programs that would enable their reuse. This work explores the potential advancement of optical sorting to enable the classification of polyester bioplastics. Near-infrared (NIR) and mid-infrared (MIR) spectral data were collected for over 500 samples to be used for machine learning classification. Four classification schemes were investigated, including random forest (RF), K nearest neighbors (kNN), and principal component analysis (PCA) coupled with both schemes (PCA-RF and PCA-kNN). Prediction accuracies >92% were demonstrated for both IR regions with the ability to further boost accuracy to >98% by implementing model confidence thresholds. Exploration of sample attributes and their impact on material classification revealed that sample color and opacity have the largest impact on classification in the NIR region, while the MIR region is unimpacted. Additionally, feature importance analysis and feature reduction were carried out, showing that a smaller feature set can be implemented in optical sorters to more efficiently scan samples using only the most informational wavelengths. Finally, synthetic Gaussian noise was introduced into the sample spectra to mimic environmental noise to demonstrate that the classification models have some tolerance to external noise.

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来源期刊
CiteScore
7.20
自引率
6.00%
发文量
810
期刊介绍: ACS Applied Polymer Materials is an interdisciplinary journal publishing original research covering all aspects of engineering, chemistry, physics, and biology relevant to applications of polymers. The journal is devoted to reports of new and original experimental and theoretical research of an applied nature that integrates fundamental knowledge in the areas of materials, engineering, physics, bioscience, polymer science and chemistry into important polymer applications. The journal is specifically interested in work that addresses relationships among structure, processing, morphology, chemistry, properties, and function as well as work that provide insights into mechanisms critical to the performance of the polymer for applications.
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