Conversion of hazardous waste into thermal conductive polymer: A prediction and guidance from machine learning.

Journal: Journal of environmental management
PMID:

Abstract

The preparation methods and thermal conductivity (TC) of the reported thermal conductive polymers vary significantly. A method to clarify the relationship between TC and influencing factors and to reach consistent conclusions is needed. In this study, we compiled 403 sets of data from the literature. Six typical features and three machine learning (ML) algorithms were selected and optimized. XGBoost algorithm achieved the best prediction of TC of thermal conductive polymer (correlation coefficient with 0.855). To further investigate the influence of the 6 features on the TC of thermal conductive polymer, we conducted the SHapley Additive exPlanations (SHAP) analysis. Based on the above results, pyrrhotite tailings were determined as the filler and the corresponding process parameters were also determined. However, the above model built based on literature was still unsatisfactory. We further optimized XGBoost and built XGBoost-Exp through data from the real experiment. Finally, a small percentage (23%) of real experimental data can significantly improve the prediction power of XGBoost-Exp for unseen data (correlation coefficient with 0.815). To summarize, XGBoost-Exp exhibits exceptional predictive performance for the TC of the unseen data, offering valuable insights into the influence of various features. Meanwhile, this method provides a new perspective for the utilization of hazardous sulfide minerals.

Authors

  • Zhiyi Wang
    Department of Infectious Diseases, Key Laboratory of Molecular Biology for Infectious Diseases (Ministry of Education), Institute for Viral Hepatitis, The Second Affiliated Hospital of Chongqing Medical University, Chongqing, China.
  • Jiming Su
    College of Minerals Processing & Bioengineering, Central South University, Changsha, 410083, Hunan, PR China.
  • Yijin Feng
    College of Chemistry and Chemical Engineering, Central South University, Changsha, 410083, Hunan, PR China.
  • Qianqian Xu
    School of Chemistry and Biological Engineering, University of Science and Technology Beijing, Beijing, China.
  • Hui Wang
    Department of Vascular Surgery, Xuanwu Hospital, Capital Medical University, Beijing, China.
  • Hongru Jiang
    College of Chemistry and Chemical Engineering, Central South University, Changsha, 410083, China.