{"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}
引用次数: 0
Abstract
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.