本人主要从事以电热输运理论以及多尺度计算为基础的理论工作，利用多学科优势（物理、化学、材料、信息科学）理解千变万化的材料世界。具体研究内容涉及高性能热电材料设计，材料数据库智能建立，机器学习势函数及其在热电材料中的应用，热电材料的多尺度计算等。截止2025年2月，在Nat. Phys., J. Am. Chem. Soc., Energy. Environ. Sci., Adv. Mater., NPJ Comp. Mater., Nat. Commun.等SCI刊物上发表论文200余篇。总引用数10000余次，H因子55，并发表国际热电专著一章。在APS、PACRIM、TMS、ICT等国际会议上做邀请报告9次。
完整文章列表请见：https://www.webofscience.com/wos/author/record/K-6330-2014
近5年来代表性工作： v Zhiyuan Lang, Ying Jiang*, and Jiong Yang*, et al., Microstructures, 5, 2025004, 2025 v Yihang Zhao, Jinyang Xi*, Jiong Yang*, et al.,Computational Materials Today, 5, 100019, 2025 v Qiyong Chen, Jiong Yang*, and Lili Xi*, et al., Journal of Materiomics, 11, 100832, 2025 v Yasong Wu, Di Qiu*, Jinyang Xi*, and Jiong Yang*, et al., Journal of Materials Science & Technology, 204, 245, 2025 v Yuyan Yang, Shengnan Dai*, and Jiong Yang*, et al., Digital Discovery, 3, 2201, 2024 v Qiyong Chen, Jiong Yang*, Lili Xi*, et al., Materials Today Physics, 46, 101531, 2024 v Yuzheng He, Jinbo Wu*, and Jiong Yang*, et al., Journal of Materials Informatics, 4, 18, 2024 v Jiangtao Wu, Tianran Wei*, Jiong Yang*, and Jie Ma*, et al., Nature Communications, 15, 6248, 2024 v Sen Xie, Jiong Yang*, Wei Liu*, and Xinfeng Tang*, et al., Advanced Materials, 36, 2400845, 2024 v Shengnan Dai, Jinyang Xi*, Jiong Yang*, et al., Computational Materials Science, 244, 113190, 2024 v Lu Liu, Wenqing Zhang*, and Jiong Yang*, et al., MGE Advances, 2, e21, 2024 v Qinghang Tang, Huijun Liu*, and Jiong Yang*, et al., Energy & Environmental Science, 17, 611, 2024 v Shen Han#, Shengnan Dai#, Jie Ma#, Jiong Yang*, Chenguang Fu*, and Tiejun Zhu*, et al., Nature Physics 19, 1649, 2023 v Yeqing Jin, Jiong Yang*, and Lili Xi*, et al., NPJ Comput. Mater. 9, 190, 2023 v Yifan Zhu, Jiong Yang*, and Wenqing Zhang*, et al., Physical Review B 108, 014108, 2023 v Mingjia Yao, Jinyang Xi*, Jiong Yang*, and Wenqing Zhang*, et al.,Science China Materials 66, 2768, 2023 v Shengnan Dai, Jinyan Ning*, Jinyang Xi*, Jiong Yang*, et al., Materials Today Physics, 31, 100993, 2023 v Jialin Ji, Jiong Yang*, and Wenqing Zhang*, Journal of the American Chemical Society, 144, 18552-18561, 2022 v Huifang Luo, Xin Li*, Jiong Yang*, et al., NPJ Computational Materials, 8, 199, 2022 v Yan Cao, Lili Xi*, Jiong Yang*, et al., Journal of Materials Chemistry A, 10, 1039-11045, 2022 v Yifei Xiong, Pengfei Qiu*, Jiong Yang*, Xun Shi*, et al, Journal of the American Chemical Society, 144, 8030-8037, 2022 v Zhou Zhang, Jiong Yang*, et al., Materials Today Physics, 25, 100702, 2022 v Hongliang Yang, Jiong Yang*, Wenqing Zhang*, et al., Physical Review B, 104, 094310, 2021 v Ye Sheng, Jinyang Xi*, Yuexing Han*, Jiong Yang*, et al., Chemistry of Materials, 33, 6918-6924, 2021 v Mingjia Yao, Jiong Yang*, et al., Scientific Data, 8, 236, 2021 v Ziyu Wang, Jinyang Xi*, Jiong Yang*, Wenqing Zhang*, et al., Chemistry of Materials, 33, 1046-1052, 2021 v Jincheng Ding, Jinyang Xi*, Jiong Yang*, et al., Journal of Materiomics, 7, 310-319, 2021 v Xin Li, Jiong Yang*, et al., Computational Materials Science, 186, 110074, 2021 v Yifan Zhu, Jiong Yang*, Chenguang Fu*, Wenqing Zhang*, et al., Research, 2020, 4589786, 2020 v Ye Sheng, Jiong Yang*, Wenqing Zhang*, et al., NPJ Computational Materials, 6, 171, 2020 v Yiming Zhang, Ziyu Wang, Jinyang Xi*, Jiong Yang*, Journal of Physics: Condensed Matter, 32, 475503, 2020 v Xin Li, Jiong Yang*, Wenqing Zhang*, et al., NPJ Computational Materials, 6, 107, 2020 v Qingyong Ren, Chenguang Fu*, Jiong Yang*, Jie Ma*, et al., Nat. Commun. , 11, 3142, 2020
软件： TransOpt，基于VASP电子结构计算与跃迁矩阵元方法处理电输运，有效避免”能带交叉”问题。同时在电子驰豫时间上考虑了常数电声耦合近似、形变势方法以及电离杂质散射等方法。https://github.com/yangjio4849/TransOpt.git
MatHub第一性原理计算数据库：
三维体系 www.mathub3d.net
二维体系 www.mathub2d.net |