(1)Guo C., Fang K., Yue H., Guo K.*, Deng Z., Gong Z., Li K., Zhang H., Liu Z., Xie B., Mao P., Lu J., Tan C.K.I., Yao K. and Tay F.E.H., Machine learning and first-principles guided design of BaTiO3-based materials for potential capacitor applications, J. Appl. Phys., 2026, 139(6): 064101.
(2)Guo C., Guo K.*, Deng Z., Zhang H., Li K., Liu Z., Xie B, Mao P., Tan C. K. I. , Yao K., and Tay F. E. H., Machine learning-accelerated screening of all-inorganic perovskites for tandem solar cells, Mater. Today Energy, 2026, 55: 102179.
(3)Deng Z., Fang K., Guo C., Gong Z., Yue H., Zhang H., Li K., Guo K.*,Liu Z., Xie B., Lu J., Yao K. and Tay F.E.H., Prediction of ABX3 perovskite formation energy using machine learning, Materials, 2025, 18(13):2927.
(4)Li K., Yue H., Gong Z., Guo K.*, Liu Z., Xie B., Mao P., Yao K. and Tay F.E.H., The Mechanism of Weakly Coupled Relaxor Ferroelectric Properties in Dy-doped BCT Ceramics: Insights from First-Principles Calculations, Ceram. Int., 2025, 51(19):29448-29456.
(5)Gong Z., Yue H., Fang K., Guo K.*, Li K., Guo C., Zhang H., Deng Z., Liu Z., Xie B., Mao P., Lu J., Guo S., Yao K. and Tay F.E.H., Multifunctional energy storage and photoluminescence of Er-modified KNN-based transparent ferroelectric ceramics, J Materiomics, 2025, 11(4): 100993.
(6)Gong Z., Yue H., Fang K., Guo K.*, Xie B., Liu Z., Mao P., Lu J., Yao K., Tay F.E.H., Investigation of Structural, Electronic, and Optical Properties of Er-Doped KNN System Based on First-Principles Calculations, J. Electroceram, 2025, 53: 165-175.
(7)Yue H., Fang K., Gong Z., Chen L., Guo K.*, Guo S., Liu H., Tan I., Liu Z., Xie B., Lu J., Chen Z., Tian J., Tay F. E. H., The Mechanism of Ferroelectric Phase Transformation in Gd2O3 Modified BCZT Ceramics: Experimental Studies and First-Principles Calculations, Ceram. Int., 2024,50(7): 10416-10426.
(8)Yue H., Fang K., Gong Z., Guo K.*, Guo S., Liu H., Yao K., Tay F. E. H., Heat treatments for thermal sprayed lead-free piezoelectric ceramic coatings, J. Mater. Res. Technol., 2023, 27: 2080-2088.
(9)Yue H., Fang K., Guo K.*, Guo S., Tay F. E. H., First-Principles Study on the Mechanical Properties of Gd-doped BCZT Ceramics, Crystals, 2023, 13(9): 1305.
(10)Yue H., Fang K., Chen T., Jing Q., Guo K.*, Liu Z., Xie B., Mao P., Lu J., Tay F. E. H, Tan C. K. I and Yao K., First-Principle Study on Correlate Structural, Electronic and Optical Properties of Ce-Doped BaTiO3, Crystals, 2023, 13(2): 255.