Gas sensing beyond classification: Analysis of gas mixtures using multisensor array based on Al-doped zinc oxide

IF 4.9 2区 化学 Q1 CHEMISTRY, ANALYTICAL
Vishalkumar Rajeshbhai Gohel, Andrey Gaev, Nikolay P. Simonenko, Tatiana L. Simonenko, Elizaveta P. Simonenko, Anna Lantsberg, Valeriy Zaytsev, Albert G. Nasibulin, Fedor S. Fedorov
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Abstract

Understanding the composition of gas mixtures is still a primary prerogative of complex analytical units or biological olfaction systems. Attempts to mimic the olfactory processes by using a multisensor array combined with machine learning algorithms led mainly to solving a problem of a selective classification of odors or regression over the range of concentrations of the same odor. The identification of individual analytes in a mixture remains a difficult task. In this study, we test the identification of individual chemicals in the composition of the gas mixture with a feature extraction algorithm using a multisensor array based on aluminum-doped zinc oxide. Our approach is based on matching the selected parameters of the response curves which share considerable similarity if a volatile compound is common in any two mixture combinations. We demonstrate the efficiency of the method by analyzing five analytes such as acetone, benzene, methanol, ethanol, and isopropanol, and their mixtures. As a result, we were able to efficiently classify all 31 odors with an accuracy of about 99%. We have achieved the mean values of scores of 0.52, 0.63, and 0.59 reaching up to 0.80–0.86 for the prediction of every individual analyte in 2-, 3- and 4-component gas mixtures, respectively. While using just raw signals at steady state, we found that the results become rather biased as the number of analytes increases in a mixture. Thus, our approach enables an improved, more accurate, and thorough examination of the gas mixtures, expanding the scope of application of multisensor systems beyond the common “classification” tasks.
超越分类的气体传感:使用基于掺铝氧化锌的多传感器阵列分析混合气体
了解气体混合物的成分仍然是复杂分析装置或生物嗅觉系统的主要特权。通过使用多传感器阵列结合机器学习算法来模拟嗅觉过程的尝试,主要解决了气味选择性分类或同一气味浓度范围内的回归问题。混合物中单个分析物的识别仍然是一项艰巨的任务。在本研究中,我们使用基于掺铝氧化锌的多传感器阵列,通过特征提取算法测试了如何识别混合气体成分中的单个化学物质。我们的方法基于匹配响应曲线的选定参数,如果某挥发性化合物在任意两种混合物组合中都很常见,这些响应曲线就会具有相当大的相似性。我们通过分析丙酮、苯、甲醇、乙醇和异丙醇等五种分析物及其混合物,证明了该方法的高效性。因此,我们能够有效地对所有 31 种气味进行分类,准确率约为 99%。在预测 2、3 和 4 组分气体混合物中的每种分析物时,我们的平均得分分别达到了 0.52、0.63 和 0.59,最高为 0.80-0.86。在使用稳定状态下的原始信号时,我们发现随着混合物中分析物数量的增加,结果会变得相当有偏差。因此,我们的方法能够对气体混合物进行更好、更准确和更全面的检测,从而扩大了多传感器系统的应用范围,使其超越了普通的 "分类 "任务。
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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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