个人简介
刘雪飞，男，中共党员，1988年出生，博士，教授，博士生导师，物电（中国）官方网站党委委员，人工智能系主任，全国21届青年岗位能手，贵州省第二届“最美劳动者”，贵州省教育厅功能材料与器件科技创新团队带头人，贵州省青年千层次人才，贵州省教育厅青年拔尖人才，目前为《稀有金属》青年编委，维泽专家库（VE）材料专家委员会委员，贵州省物理学会、人工智能学会、人工智能教育学会会员，全国能源材料与器件专家委员会常务委员。担任Applied surface science、2D materials、Journal of Energy Chemistry、 Journal of Physical Chemistry Letters，Journal of Materials Chemistry A等国内外期刊审稿人。在全国纳米科学与信息材料发展论坛、全国能源与材料化学高峰论坛、贵州省物理学会受邀请做报告多次。主要研究方向：1）基于第一性原理、机器学习、深度学习对能源材料的理性设计与构效关系研究；2）二维异质结及器件的结构设计与性能研究；3）功率器件与集成电路设计；目前以第一或通讯作者在国内外核心期刊发表SCI学术论文30余篇,申请专利6项；主持省部级项目4项，主持国家自然科学基金2项，获省级教学成果三等奖一项、贵州省教学创新大赛二等奖一项；指导学生参加大学生电子设计竞赛，蓝桥杯，挑战杯，互联网＋，计算机设计等学科竞赛获奖省级以上奖项40余项并多次获得优秀指导教师；主要在凝聚态物理，电子信息方向招收研究生；
（中国）官方网站部门：物理与电子科学（中国）官方网站 人工智能系
办公电话：18685001472，办公室（1403右）
邮 箱：201307129@gznu.edu.cn
学习经历
博 士：2016年-2020年，贵州大学，微电子学与固体电子学专业
硕 士：2010年-2013年，贵州大学，微电子学与固体电子学专业
本 科：2006年-2010年，贵州大学，电子科学与技术专业
工作经历
2013年至今，物理与电子科学（中国）官方网站，贵州师范大学
研究方向
1、能源材料结构设计及基于人工智能技术交叉应用研究 （凝聚态物理方向招生）
2、微纳器件、半导体缺陷、异质结理论研究（凝聚态物理方向招生）
3、集成电路、功率半导体器件设计与测试（电子信息方向招生）
科研成果
1、近几年代表作：
[1] Liu Xuefei, Gao Zhibin, Wang Vei, et al. Extrapolated Defect Transition Level in Two-Dimensional Materials: The Case of Charged Native Point Defects in Monolayer Hexagonal Boron Nitride [J]. ACS Appl. Mater. Interfaces, 2020, 12(14): 17055-61.
[2] Liu Xuefei, Luo ZiJiang, Zhou Xun, et al. Theoretical study of stress and strain distribution in coupled pyramidal InAs quantum dots embedded in GaAs by finite element method [J]. The European Physical Journal B, 2019, 92(7): 138.
[3] Liu Xuefei, Lv Bing, Ding Zhao, et al. Van der Waals heterostructure of graphene and As2S3: Tuning the Schottky barrier height by vertical strain [J]. Journal of Crystal Growth, 2020, 549(10): 125882.
[4] Liu Xuefei, Lv Bing, Ding Zhao, et al. External uniaxial compressive strain induced built-in electric field in bilayer two-dimensional As2S3 for photocatalytic water splitting: A first-principles study [J]. Appl. Surf. Sci., 2021, 535(3): 147701.
[5] Liu Xuefei, Yang Xin, Yang Xiuzhang, et al. Exploration of n- and p-type doping for two-dimensional gallium nitride: charged defect calculation with first principles [J]. The European Physical Journal B, 2020, 93(8): 148.
[6] Liu X., Zhang Y., Wang W., et al. Transition Metal and N Doping on AlP Monolayers for Bifunctional Oxygen Electrocatalysts: Density Functional Theory Study Assisted by Machine Learning Description [J]. ACS Appl Mater Interfaces, 2021,
[7] Liu Xuefei, Zhang Zhaofu, Ding Zhao, et al. Highly anisotropic electronic and mechanical properties of monolayer and bilayer As2S3 [J]. Appl. Surf. Sci., 2021, 542(3): 148665.
[8] Liu Xuefei, Zhang Zhaofu, Luo Zijiang, et al. Tunable Electronic Properties of Graphene/g-AlN Heterostructure: The Effect of Vacancy and Strain Engineering [J]. Nanomaterials, 2019, 9(12): 1674.
[9] Liu Xuefei, Zhang Zhaocai, Lv Bing, et al. The external electric‐field‐induced Schottky‐to‐ohmic contact transition in graphene/As2S3 interface: A study by the first principles [J]. International Journal of Energy Research, 2020, 45(3): 4727.
[10] Liu Xuefei, Zhang Zhaocai, Lv Bing, et al. Impact of the vertical strain on the Schottky barrier height for graphene/AlN heterojunction: a study by the first-principles method [J]. The European Physical Journal B, 2021, 94(1): 1-7.
[11] Liu Xuefei, Luo Zi-Jiang, Zhou Xun, et al. Structural, mechanical, and electronic properties of 25 kinds of III–V binary monolayers: A computational study with first-principles calculation [J]. Chin. Phys. B, 2019, 28(8): 086105.
[12] Liu Xuefei; Zhang, Z.; Lv, B.; Ding, Z.; Luo, Z. The External Electric Field-Induced Tunability of the Schottky Barrier Height in Graphene/AlN Interface: A Study by First-Principles [J]. Nanomaterials, 2020, 10(9): 1794.
[13] Luo Zijiang, Ma Yuandong, Yang Xiuzhang, Liu Xuefei* et al. Native Point Defects in Monolayer Hexagonal Boron Phosphide from First Principles [J]. Journal of Electronic Materials, 2020, 49(10): 5782-9.
[14] Luo ZiJiang, Yang YunFan, Yang XiuZhang, Liu xuefei* et al. The mechanical properties and strain effect on the electronic properties of III-nitride monolayers: ab-initio study [J]. Mater. Res. Express, 2019, 6(11): 115915.
[15] Xuefei Liu, Zhao Ding, Zijiang Luo, et al. Theoretical study on the electronic and optical properties of bulk and surface (001) In x Ga 1-x As [J]. Physica B: Condensed Matter, 2018, 537(09): 68-76.
[16] Xuefei Liu, Zijiang Luo, Xun Zhou, et al. Calculation of electronic and optical properties of surface InxGa1−xP and indium-gradient structure on GaP (0 0 1) [J]. Computational Materials Science, 2018, 153,356-62.
[17] Zhang Yuefei, Wei Jiemin, Liu Tianyun, Liu Xuefei * et al. Tunable properties of ZnSe/graphene heterostructure as a promising candidate for photo/electro-catalyst applications [J]. Applied Surface Science, 2022, 574
[18] Xiao W., Liu T., Zhang Y., Liu Xuefei* et al. Tunable Schottky Barrier and Interfacial Electronic Properties in Graphene/ZnSe Heterostructures [J]. Front Chem, 2021, 9,744977.
[19] Liu Xuefei, Yuefei Zhang, Liu Tianyun et al. Rational Design Synergistic Metal-free Dual-atom Electrocatalyst for N2 to NH3 Reaction on g-CN: A First Principle Study [J]. Applied Surface Science ,2022,605,154831
[20] Liu Xuefei, Liutianyun, Weijun Xiao et al. Strain engineering in single-atom catalysts: GaPS 4 for bifunctional oxygen reduction and evolution [J]. Inorganic Chemistry Frontiers, 2022,9(16), 4272-4280.
[21] Tianyun Liu, et al., Xuefei Liu*. Regulating on photocatalytic overall water splitting performance of gallium thiophosphate based on transition metal doping: A first-principles study[J]. Molecular Catalysis, 2022,553(12),112765.
[22]Yuefei Zhang, Xuefei Liu* ,et al. GaPS2Se2 Monolayer: Novel Stable 2D Janus Semiconductor with Anisotropic Properties for Spontaneous Water splitting under the Irradiation of Solar Light[J]. Journal of Materials Chemistry C, 2022(publish in advance).
[23]Yuanjun Hu, Xin Zhao, Xuefei Liu*, et al. Coordination Engineering on Novel 2D Pentagonal NiN2 for Bifunctional Oxygen Electrocatalysts[J]. Applied surface science, 2023, 614(3),156256.
[24] Xin Zhao, Yu Yang, Xuefei Liu*, et al. Theoretical Calculation of Hydrogen Evolution Reaction in Two-dimensional As2X3 (X= S, Se, Te) Doped with Transition Metal Atoms[J]. Applied surface science, 2023, 616(4),156475.
[25]Tianyun Liu, Xin Zhao, Xuefei Liu*,et al. Understanding the hydrogen evolution reaction activity of doped single-atom catalysts on two-dimensional GaPS4 by DFT and machine learning[J].Journal of Energy Chemistry,2023,81(6),93-100.
[26]Wang Yi, Guang Wang, Xuefei Liu*,et al. Electrocatalytic activity of MoSi2N4 monolayers decorated with single transition metal atoms: a computational study[j]. Nanotechnology,2023,34(3),245705.
2、主持科研项目：
1）贵州省科学技术厅基础研究计划-黔科合LH字【2017】7341号（2017-2020），多层InGaAs 两种点均匀有序化生长及其光学特性研究，6.6万（主持）；
2）贵州省科学技术基金基础研究计划-黔科合基础-ZK[2022]一般308（2022-2024），二维As2X3(X=S,Se,Te)单原子催化制氢活性来源及关键描述符研究，10万（主持）；
3）国家自然科学基金地区项目（12164009）（2022-2025），二元类磷烯光电材料有氧环境稳定结构的设计与调控，38万（主持）；
4）贵州师范大学基金-0418010（2017-2018），以电子设计大赛为依托的创新创业教育模式探索，1万（主持结题）；
5）贵州师范大学教改项目（2022-2023），依托学科竞赛提高学生解决复杂工程问题能力的电子系统设计实践课程改革，0.5 万（主持）；
6）贵州省（第六批）高层次创新型人才青年千层次-2022-2024）,10万（主持）
7）贵州省青年拔尖人才计划项目（2022-2024）黔教技[2022]078，基于机器学习的二维GaPX4（X=S,Se，Te）单原子催化活性机理研究40万（主持）
8）贵州省高等学校功能材料与器件科技创新团队；黔教技[2023]058号，2023.7.1-2026.6.30, 60万，主持；
9）国家自然科学青年基金（12304259），基于图卷积神经网络的二维双原子催化剂“协同效应”机制研究，30万（主持）
10）贵州师范大学学术新苗基金，（项目合同编号：黔师新苗[2022]06号），二元二维含磷材料结构搜索与性能调控，3.8万（主持）
11)贵州省高校新能源电动汽车充电技术工程研究中心，2023,100万，研究骨干；
