材料信息学；数据科学方法在材料学中的应用；MAX/MXene；核能材料的计算设计

熟悉机器学习与数据挖掘的基本概念，了解当前机器学习方法在材料学领域的应用。

运用机器学习方法，并结合对材料（例如，MAX/MXene材料、核能材料）的物理理解，总结获得针对特定材料的设计规则。

080501-材料物理与化学
080502-材料学

材料信息学，材料大数据，数据挖掘方法在材料学的应用
核包壳材料，MAX相材料
智能电网与储能

2006-09--2010-01   英国伦敦大学玛丽皇后学院   博士
2003-09--2006-07   英国伦敦大学玛丽皇后学院   工学硕士（一等荣誉学位）
2000-09--2003-07   浙江理工大学   本科学习

研究生

博士

2012-12~现在, 中国科学院宁波材料技术与工程研究所, 副研究员
2012-10~2012-12,中国科学院宁波材料技术与工程研究所, 助理研究员
2010-08~2012-10,中国科学院宁波材料技术与工程研究所, 博士后
2010-03~2010-08,英国伦敦大学玛丽皇后学院, 访问学者

2012-12~现在, 中国科学院宁波材料技术与工程研究所, 副研究员
2012-10~2012-12,中国科学院宁波材料技术与工程研究所, 助理研究员
2010-08~2012-10,中国科学院宁波材料技术与工程研究所, 博士后
2010-03~2010-08,英国伦敦大学玛丽皇后学院, 访问学者

   

（ 1 ） 基于石墨烯填料的通用电子浆料, 发明, 2011, 第 2 作者, 专利号: CN 102254584 B
（ 2 ） 一种两相反应材料和单相反应材料混合的放电 曲线计算方法, 发明, 2016, 第 2 作者, 专利号: CN103792497A
（ 3 ） 一种电池荷电状态估计方法及装置, 发明, 2016, 第 2 作者, 专利号: CN104573401 A
（ 4 ） 一种老化的锂电池充放电状态 下热分析方法和系统, 发明, 2016, 第 2 作者, 专利号: 201610247795.5
（ 5 ） 一种锂离子电池针刺测试仿真方法与装置, 发明, 2016, 第 2 作者, 专利号: 201610586684.7

   

[1] Zhao, Meiting, Wu, Erxiao, Li, Dongyang, Luo, Junfei, Zhang, Xin, Wang, Zhuquan, Huang, Qing, Du, Shiyu, Zhang, Yiming. Development of a baseline model for MAX/MXene synthesis recipes extraction via pre-trained model with domain knowledge. JOURNAL OF MATERIALS RESEARCH AND TECHNOLOGY-JMR&T[J]. 2023, 22: 2262-2274, http://dx.doi.org/10.1016/j.jmrt.2022.12.076.
[2] Erxiao Wu, Yiming Zhang, Mian Li, Youbing Li, Kun Liang, Shiyu Du, Qing Huang. The rendering from the periodic system of elements on the stability, elastic, and electronic properties of M2AC phases. MATERIALIA. 2023, 27: http://dx.doi.org/10.1016/j.mtla.2023.101676.
[3] Li, Ziqian, Wu, Erxiao, Chen, Ke, Wang, Xudong, Chen, GuoXin, Miao, Lijing, Zhang, Yiming, Song, Yujie, Du, Shiyu, Chai, Zhifang, Huang, Qing. Chalcogenide MAX phases Zr2Se(B1-xSex) (x=0-0.97) and their conduction behaviors. ACTA MATERIALIA[J]. 2022, 237: 118183-, http://dx.doi.org/10.1016/j.actamat.2022.118183.
[4] Chen, Ke, Bai, Xiaojing, Mu, Xulin, Yan, Pengfei, Qiu, Nianxiang, Li, Youbing, Zhou, Jie, Song, Yujie, Zhang, Yiming, Du, Shiyu, Chai, Zhifang, Huang, Qing. MAX phase Zr2SeC and its thermal conduction behavior. JOURNAL OF THE EUROPEAN CERAMIC SOCIETY[J]. 2021, 41(8): 4447-4451, http://dx.doi.org/10.1016/j.jeurceramsoc.2021.03.013.
[5] Wu, Erxiao, Qiu, Nianxiang, Luo, Kan, Chen, Xinyu, Shi, Diwei, Bu, Moran, Du, Shiyu, Chai, Zhifang, Huang, Qing, Zhang, Yiming. The studies of electronic structure, mechanical properties and ideal fracture behavior of U3Si1.75Al0.25: first-principle investigations. JOURNALOFMATERIALSRESEARCHANDTECHNOLOGYJMRT[J]. 2021, 15: 1356-1369, http://dx.doi.org/10.1016/j.jmrt.2021.08.143.
[6] Chen, Xinyu, Qin, Yanqing, Shi, Diwei, Guo, Yaolin, Song, Jiexi, Bu, Moran, Zhang, Yiming, Huang, Qing, Liu, Guoquan, Chai, Zhifang, Du, Shiyu. Investigations of the stability and electronic structures of U3Si2-Al: A first-principles study. CHEMICAL PHYSICS[J]. 2021, 543: http://dx.doi.org/10.1016/j.chemphys.2020.111088.
[7] Yuan, Yuan, Qin, Yanqing, Xu, Kai, Zhang, Yiming, Huang, Qing, Chang, Keke, Du, Shiyu. Exploring U3Si2-based alloys through phase diagram investigations. JOURNAL OF NUCLEAR MATERIALS[J]. 2021, 547: http://dx.doi.org/10.1016/j.jnucmat.2020.152770.
[8] Yiming Zhang, Zeyu Mao, Qi Han, Youbing Li, Mian Li, Shiyu Du, Zhifang Chai, Qing Huang. The role of Hume-Rothery's rules play in the MAX phases formability. MATERIALIA[J]. 2020, 12: [[[]]]-, http://dx.doi.org/10.1016/j.mtla.2020.100810.
[9] Chu, Xiaolong, Zhang, Yiming, Liu, Zhen, Huang, Qing, Lu, Xiaogang, Chai, Zhifang, Du, Shiyu. The role of nuclear charges in unifying the descriptions of neural networks (NN)-based force fields. MATERIALS LETTERS[J]. 2020, 276: http://dx.doi.org/10.1016/j.matlet.2020.128262.
[10] Zhang, Yiming, Evans, Julian R G, Yang, Shoufeng. Exploring Correlations Between Properties Using Artificial Neural Networks. METALLURGICAL AND MATERIALS TRANSACTIONS A-PHYSICAL METALLURGY AND MATERIALS SCIENCE[J]. 2020, 51(1): 58-75, http://dx.doi.org/10.1007/s11661-019-05502-8.
[11] Li, Youbing, Lu, Jun, Li, Mian, Chang, Keke, Zha, Xianhu, Zhang, Yiming, Chen, Ke, Persson, Per O A, Hultman, Lars, Eklund, Per, Du, Shiyu, Francisco, Joseph S, Chai, Zhifang, Huang, Zhengren, Huang, Qing. Multielemental single atom-thick A layers in nanolaminated V2(Sn, A) C (A = Fe, Co, Ni, Mn) for tailoring magnetic properties. PROCEEDINGS OF THE NATIONAL ACADEMY OF SCIENCES OF THE UNITED STATES OF AMERICA[J]. 2020, 117(2): 820-825, https://www.webofscience.com/wos/woscc/full-record/WOS:000508976200011.
[12] Chen, Xinyu, Qin, Yanqing, Shi, Diwei, Guo, Yaolin, Bu, Moran, Yan, Tao, Song, Jiexi, Liu, Guoquan, Zhang, Yiming, Du, Shiyu. First-principles investigations on the anisotropic elasticity and thermodynamic properties of U3Si2-Al. RSC ADVANCES[J]. 2020, 10(58): 35049-35056, http://dx.doi.org/10.1039/d0ra07374a.
[13] 张一鸣. The role of nuclear charges in unifying the descriptions of neural netwworks (NN)-based force fields. Materials Letter. 2020, [14] Yuchen Jiang, Yiming Zhang, Qing Huang, Lvyuan Hao, Shiyu Du. The compositional dependence of structural stability and resulting properties for Mn+1CnT2 (M = Sc, Ti, V; T = O, OH, F, Cl, Br and I; n = 1, 2): first-principle investigations. JOURNAL OF MATERIALS RESEARCH AND TECHNOLOGY[J]. 2020, 9(6): 14979-14989, http://dx.doi.org/10.1016/j.jmrt.2020.10.083.
[15] Jiang, Yuchen, Zhang, Yiming, Huang, Qing, Hao, Lvyuan, Du, Shiyu. The compositional dependence of structural stability and resulting properties for Mn+1CnT2 = Sc, Ti, V; T = O, OH, F, Cl, Br and I; n=1, 2): first-principle investigations. JOURNAL OF MATERIALS RESEARCH AND TECHNOLOGY-JMR&T[J]. 2020, 9(6): 14979-14989, http://dx.doi.org/10.1016/j.jmrt.2020.10.083.
[16] Liu, Zhen, Han, Qi, Guo, Yaolin, Lang, Jiajian, Shi, Diwei, Zhang, Yiming, Huang, Qing, Deng, Huiqiu, Gao, Fei, Sun, Baiyu, Du, Shiyu. Development of interatomic potentials for Fe-Cr-Al alloy with the particle swarm optimization method. JOURNAL OF ALLOYS AND COMPOUNDS[J]. 2019, 780: 881-887, http://dx.doi.org/10.1016/j.jallcom.2018.11.079.
[17] Du ShiYu, Zhang YiMing, Luo Kan, Huang Qing. Design of the Nature-inspired Algorithms Library and Its Significance for New Materials Research and Development. JOURNAL OF INORGANIC MATERIALSnull. 2019, 34(1): 27-36, http://sciencechina.cn/gw.jsp?action=detail.jsp&internal_id=6430207&detailType=1.
[18] 都时禹, 张一鸣, 罗侃, 黄庆. 自然启发算法库构建设想及其在新材料研发中的意义. 无机材料学报[J]. 2019, 34(1): 27-36, http://lib.cqvip.com/Qikan/Article/Detail?id=7001185377.
[19] Du, Qiang, Han, Qi, Zhang, Yiming, Liu, Zhaoping, Tian, Shuang, Zhang, Zhimin. Adopting combined strategies to make state of charge (SOC) estimation for practical use. JOURNAL OF RENEWABLE AND SUSTAINABLE ENERGY[J]. 2018, 10(3): https://www.webofscience.com/wos/woscc/full-record/WOS:000437280300018.
[20] Zhang, Milin, Wang, Pu, Zhang, Yiming, Ji, Debin, Yan, Yongde, Shi, Weiqun, Huang, Qing, Du, Shiyu. New formulation for reduction potentials of (Cu, Ni, Al, Zn)-lanthanide alloys - Implications for electrolysis-based pyroprocessing of spent nuclear fuel. ELECTROCHEMISTRY COMMUNICATIONS[J]. 2018, 93: 180-182, http://dx.doi.org/10.1016/j.elecom.2018.07.013.
[21] 张一鸣. Formation mechanism of solid electrolyte interphase (SEI) and effect of formation process on it in lithium ion batteries. Chinese Journal of Power Sources. 2018, [22] Liang, Guozhou, Zhang, Yiming, Han, Qi, Liu, Zhaoping, Jiang, Zhen, Tian, Shuang. A novel 3D-layered electrochemical-thermal coupled model strategy for the nail-penetration process simulation. JOURNAL OF POWER SOURCES[J]. 2017, 342: 836-845, http://dx.doi.org/10.1016/j.jpowsour.2017.01.005.
[23] 张一鸣. Nail penetration safety test of lithium-ion batteries. Chinese Journal of Power Sources. 2016, [24] Zhang, Yiming, Tang, Xisheng, Qi, Zhiping, Liu, Zhaoping. The Ragone plots guided sizing of hybrid storage system for taming the wind power. INTERNATIONAL JOURNAL OF ELECTRICAL POWER & ENERGY SYSTEMS[J]. 2015, 65: 246-253, http://dx.doi.org/10.1016/j.ijepes.2014.10.006.
[25] Cao, Hailiang, Zhou, Xufeng, Zhang, Yiming, Chen, Liang, Liu, Zhaoping. Microspherical polyaniline/graphene nanocomposites for high performance supercapacitors. JOURNAL OF POWER SOURCES[J]. 2013, 243(1): 715-720, http://dx.doi.org/10.1016/j.jpowsour.2013.06.032.
[26] Xin, Xing, Yao, Xiayin, Zhang, Yiming, Liu, Zhaoping, Xu, Xiaoxiong. Si/C nanocomposite anode materials by freeze-drying with enhanced electrochemical performance in lithium-ion batteries. JOURNAL OF SOLID STATE ELECTROCHEMISTRY[J]. 2012, 16(8): 2733-2738, https://www.webofscience.com/wos/woscc/full-record/WOS:000306549200020.
[27] 杨守峰, Y. M. Zhang, R. Ubic, D. F. Xue, and S. Yang, ∗. Predicting the Structural Stability and Formability of ABO3-Type Perovskite Compounds Using Artificial Neural Networks. MATER. FOCUS[J]. 2012, 57—64-, http://www.irgrid.ac.cn/handle/1471x/755279.
[28] Yao, Xiayin, Xin, Xing, Zhang, Yiming, Wang, Jun, Liu, Zhaoping, Xu, Xiaoxiong. Co3O4 nanowires as high capacity anode materials for lithium ion batteries. JOURNAL OF ALLOYS AND COMPOUNDS[J]. 2012, 521: 95-100, http://www.irgrid.ac.cn/handle/1471x/755181.
[29] Wang, Jun, Xia, Yonggao, Yao, Xiayin, Zhang, Minghao, Zhang, Yiming, Liu, Zhaoping. Synthesis and Electrochemical Feature of a Multiple-Phases Li-Rich Nickel Manganese Oxides Cathode Material. INTERNATIONAL JOURNAL OF ELECTROCHEMICAL SCIENCE[J]. 2011, 6(12): 6670-6681, https://www.webofscience.com/wos/woscc/full-record/WOS:000297571400056.
[30] Zhang, Yiming, Evans, Julian R G, Yang, Shoufeng. Corrected Values for Boiling Points and Enthalpies of Vaporization of Elements in Handbooks. JOURNAL OF CHEMICAL AND ENGINEERING DATA[J]. 2011, 56(2): 328-337, http://www.irgrid.ac.cn/handle/1471x/754516.
[31] 张一鸣. The prediction of solid solubility of alloys: developments and applications of Hume-Rothery’s Rules. J. Cryst. Phys. Chem.. 2010, [32] Zhang, Y M, Evans, J R G, Yang, S F. Detection of material property errors in handbooks and databases using artificial neural networks with hidden correlations. PHILOSOPHICAL MAGAZINE[J]. 2010, 90(33): 4453-4474, https://www.webofscience.com/wos/woscc/full-record/WOS:000282132700008.
[33] Zhang, Y M, Yang, S, Evans, J R G. Revisiting hume-rothery's rules with artificial neural networks. ACTA MATERIALIA[J]. 2008, 56(5): 1094-1105, https://www.webofscience.com/wos/woscc/full-record/WOS:000254183000019.

（1） 平抑风功率波动的混合储能系统规划软件（软件著作权）, SWEF-HESS, v1.0 , 中华人民共和国国家版权局, 2012-09, 第 1 作者
（2） 平抑风功率波动的混合储能系统协调控制仿真软件（软件著作权）, SWEF-HESCSS, v1.0, 中华人民共和国国家版权局, 2012-10, 第 1 作者
（3） 多种混合储能应用于分布式微网的协调控制软件（软件著作权）, 中华人民共和国国家版权局, 2015-08, 第 1 作者
（4） 预测混合正极材料放电曲线计算分析仿真软件（软件著作权）, 中华人民共和国国家版权局, 2015-10, 第 2 作者
（5） 锂电池管理系统监测软件, 中华人民共和国国家版权局, 2015-12, 第 2 作者

   

（ 1 ） 先进核燃料包壳的材料基因组多尺度软件设计开发和应用示范, 参与, 国家级, 2017-06--2021-06
（ 2 ） 石墨烯等碳基纳米材料标准研制及应用, 主持, 国家级, 2016-07--2020-07
（ 3 ） 基于材料信息学方法的事故容错复合燃料服役性能研究与设计参数优化, 主持, 国家级, 2019-01--2022-12

（1）Exploring Correlations Between Properties Using Artificial Neural Networks   第5届集成计算材料工程学术会议   Yiming Zhang, Julian R. G. Evans, and Shoufeng Yang   2019-07-21