{"title":"掺杂zno向列型液晶电光性质的机器学习预测","authors":"Mustafa Aksoy, Yesim Aygul, Onur Ugurlu, Umit Huseyin Kaynar, Gulnur Onsal","doi":"10.1007/s12034-025-03490-7","DOIUrl":null,"url":null,"abstract":"<div><p>This study explores the effect of zinc oxide (ZnO) nanomaterial doping on the electro-optical properties of 5CB-coded nematic liquid crystals and predicts these properties using machine learning algorithms. We produced seven composite structures with varying ZnO doping ratios and measured their electro-optical transmittance. Furthermore, a prediction model using four different machine learning algorithms (k-Nearest Neighbors, Decision Tree, Random Forest, and Extra Trees) was developed, which predicts optical transmittance as a function of voltage and doping ratio. The Extra Trees algorithm demonstrated the best prediction accuracy, achieving an <i>R</i><sup>2</sup> value of 91% on the experimental dataset. Subsequently, a new composite with a different doping ratio was then experimentally prepared and measured to validate the model, which was trained on the experimental dataset. This study highlights the utility of machine learning for predicting the electro-optical characteristics of doped liquid crystal structures, resulting in considerable time and resource savings in experimental procedures.</p></div>","PeriodicalId":502,"journal":{"name":"Bulletin of Materials Science","volume":"48 4","pages":""},"PeriodicalIF":2.1000,"publicationDate":"2025-10-11","publicationTypes":"Journal Article","fieldsOfStudy":null,"isOpenAccess":false,"openAccessPdf":"","citationCount":"0","resultStr":"{\"title\":\"Machine learning predictions of electro-optical properties in ZnO-doped nematic liquid crystals\",\"authors\":\"Mustafa Aksoy, Yesim Aygul, Onur Ugurlu, Umit Huseyin Kaynar, Gulnur Onsal\",\"doi\":\"10.1007/s12034-025-03490-7\",\"DOIUrl\":null,\"url\":null,\"abstract\":\"<div><p>This study explores the effect of zinc oxide (ZnO) nanomaterial doping on the electro-optical properties of 5CB-coded nematic liquid crystals and predicts these properties using machine learning algorithms. We produced seven composite structures with varying ZnO doping ratios and measured their electro-optical transmittance. Furthermore, a prediction model using four different machine learning algorithms (k-Nearest Neighbors, Decision Tree, Random Forest, and Extra Trees) was developed, which predicts optical transmittance as a function of voltage and doping ratio. The Extra Trees algorithm demonstrated the best prediction accuracy, achieving an <i>R</i><sup>2</sup> value of 91% on the experimental dataset. Subsequently, a new composite with a different doping ratio was then experimentally prepared and measured to validate the model, which was trained on the experimental dataset. This study highlights the utility of machine learning for predicting the electro-optical characteristics of doped liquid crystal structures, resulting in considerable time and resource savings in experimental procedures.</p></div>\",\"PeriodicalId\":502,\"journal\":{\"name\":\"Bulletin of Materials Science\",\"volume\":\"48 4\",\"pages\":\"\"},\"PeriodicalIF\":2.1000,\"publicationDate\":\"2025-10-11\",\"publicationTypes\":\"Journal Article\",\"fieldsOfStudy\":null,\"isOpenAccess\":false,\"openAccessPdf\":\"\",\"citationCount\":\"0\",\"resultStr\":null,\"platform\":\"Semanticscholar\",\"paperid\":null,\"PeriodicalName\":\"Bulletin of Materials Science\",\"FirstCategoryId\":\"88\",\"ListUrlMain\":\"https://link.springer.com/article/10.1007/s12034-025-03490-7\",\"RegionNum\":4,\"RegionCategory\":\"材料科学\",\"ArticlePicture\":[],\"TitleCN\":null,\"AbstractTextCN\":null,\"PMCID\":null,\"EPubDate\":\"\",\"PubModel\":\"\",\"JCR\":\"Q3\",\"JCRName\":\"MATERIALS SCIENCE, MULTIDISCIPLINARY\",\"Score\":null,\"Total\":0}","platform":"Semanticscholar","paperid":null,"PeriodicalName":"Bulletin of Materials Science","FirstCategoryId":"88","ListUrlMain":"https://link.springer.com/article/10.1007/s12034-025-03490-7","RegionNum":4,"RegionCategory":"材料科学","ArticlePicture":[],"TitleCN":null,"AbstractTextCN":null,"PMCID":null,"EPubDate":"","PubModel":"","JCR":"Q3","JCRName":"MATERIALS SCIENCE, MULTIDISCIPLINARY","Score":null,"Total":0}
引用次数: 0
摘要
本研究探讨氧化锌(ZnO)纳米材料掺杂对5cb编码向列液晶电光性能的影响,并利用机器学习算法预测这些性能。我们制备了7种不同ZnO掺杂率的复合结构,并测量了它们的电光透射率。此外,利用四种不同的机器学习算法(k-Nearest Neighbors, Decision Tree, Random Forest和Extra Trees)开发了一个预测模型,该模型可以预测光透射率作为电压和掺杂比的函数。Extra Trees算法表现出最好的预测精度,在实验数据集上达到91%的R2值。随后,实验制备了不同掺杂比例的复合材料,并对其进行了测量,验证了模型的有效性,并在实验数据集上进行了训练。这项研究强调了机器学习在预测掺杂液晶结构的电光特性方面的效用,从而在实验过程中节省了大量的时间和资源。
Machine learning predictions of electro-optical properties in ZnO-doped nematic liquid crystals
This study explores the effect of zinc oxide (ZnO) nanomaterial doping on the electro-optical properties of 5CB-coded nematic liquid crystals and predicts these properties using machine learning algorithms. We produced seven composite structures with varying ZnO doping ratios and measured their electro-optical transmittance. Furthermore, a prediction model using four different machine learning algorithms (k-Nearest Neighbors, Decision Tree, Random Forest, and Extra Trees) was developed, which predicts optical transmittance as a function of voltage and doping ratio. The Extra Trees algorithm demonstrated the best prediction accuracy, achieving an R2 value of 91% on the experimental dataset. Subsequently, a new composite with a different doping ratio was then experimentally prepared and measured to validate the model, which was trained on the experimental dataset. This study highlights the utility of machine learning for predicting the electro-optical characteristics of doped liquid crystal structures, resulting in considerable time and resource savings in experimental procedures.
期刊介绍:
The Bulletin of Materials Science is a bi-monthly journal being published by the Indian Academy of Sciences in collaboration with the Materials Research Society of India and the Indian National Science Academy. The journal publishes original research articles, review articles and rapid communications in all areas of materials science. The journal also publishes from time to time important Conference Symposia/ Proceedings which are of interest to materials scientists. It has an International Advisory Editorial Board and an Editorial Committee. The Bulletin accords high importance to the quality of articles published and to keep at a minimum the processing time of papers submitted for publication.