一、个人基本情况姓名：李艳丽
性别：女
学位：博士
职称：副教授
所在系：物理系
电子邮件：liyanli128@163.com
联系电话：**
二、教育背景与工作经历
2013~至今:武汉理工大学理学院物理系副教授
2012.08~2012.09:新加坡国立大学访问****
2010.01~2013.01:厦门大学讲师
2008.01~2010.01:法国巴黎高科（ENPC, ParisTech）博士后
2003.09~2008.06：华中科技大学硕士、博士
1998.09~2002.06：河南大学本科
三、研究方向
主要研究低维热电材料的热电输运性质；低维材料或结构的弛豫、重构、稳定性和
电子结构等微观机理的研究计算；有机磁性材料的磁学性质研究。
四、教学研究
主讲本科生《计算物理》、《大学物理A》、《大学物理B》、《大学物理实验》课；研究生在线课程《计算物理》；留学生课程《Physical property study on the low-dimensional materials》、《Computational Physics》。
五、科学研究
主持或参与的科研项目：
[1]主持国家自然科学基金青年基金：“过渡金属氧化物表面和界面的电子结构及微观机理研究”，26万，2012.1-2014.12（项目代码：**）
[2]主持武汉理工大学自主创新基金：“磁性材料表面的电子结构及磁性机理研究”，5万，2014.1-2015.12（项目编号：）
[3]主持湖北省自然科学基金面上项目：“有机高性能热电材料的结构设计和微观机理分析”，
3万，2016.1-2017.12（项目代码：2016CFB586）
[4]主持武汉理工大学自主创新基金重点项目：“半导体薄膜材料在外电场调控下的物性变化和微观机理研究”，20万，2017.1-2018.10（项目编号：）
[5]参与国家自然科学基金面上项目: “电负性客体填充的新型方钴矿材料合成和输运机制研究”, 60万，2018.1-2021.12 (项目代码: ** )
[6]参与国家自然科学基金面上项目: “高指数晶面铂族单金属/双金属纳米粒子的结构稳定性
与热稳定性研究”，第二负责人，80万，2013.1-2016.12 (项目代码: **)
[7]参与国家“973”计划课题“新型分子与受限小量子体系物性调控的理论研究”(项目代码: 2006CB921605)
[8]参与国家自然科学基金: “分子磁性材料的磁性机理及相变性质的研究” , 2006-01-01至2008-12-31 (项目代码: **)
[9]参与国家自然科学基金: “磁性/发光双功能纳米材料的制备、性能及对Alzheimer病早期诊断的研究”, 2006-01-01到2008-12-31 (项目代码: **)
[10]参与国家自然科学基金: “梯子和菱形结构的有机磁的机理及界面性质研究” , 2008-01-01到2010-12-31 (项目代码: **)
六、代表性论文及著作
[1]Y.L.Liand I.Dabo, “Electronic levels and electrical response of periodic molecular structures from plane-wave orbital-dependent calculations”,Phys. Rev. B,84, 155127 (2011).
[2].Y.L.Li,K.L.Yao, Q.H.Lu,Z.L.Liu,D.Xi, X.P.Luo, Q.Ning, “Atomic, electronic and magnetic structure of the Au(100)/Fe₃O₄(100)interface：Density functional theory study”,Phys. Rev. B,75, 165314 (2007).
[3].Y.L.Li, K.L.Yao, Z.L.Liu and G.Y. Gao, “First-principles study of the composition, structure, and stability of the FeO (111) surface”,Phys. Rev. B,72, 155446 (2005).
[4]Yan-Li Li,Dian-Na Zhang, Shao-Bo Qu, Ming Yang and Yuan-Ping Feng, “The effect of oxygen vacancies on the electronic structures, magnetic properties and the stabitily of SrTiO₃(001) surface”,Surface Science,641, 37 (2015).
[5].Y.L.Li, “First-principles study on the stability and the electronic structure of low-index CdTe/CdSe interfaces”,Solid State Communications.155, 73 (2013).
[6]Y.L.Li, Z.Fan and J.C.Zheng, “Enhanced thermoelectric performance in graphitic ZnO (0001) nanofilms ”,J.Appl.Phys.113, 083705 (2013).
[7].Y.L.Li,K.L.Yao and Z.L.Liu, “First-principles study on the electronic structure and magnetic properties of metallic antiferromagnet C₇H₃S₂N₂”,Journal of Magnetism and Magnetic Materials,312, L1-L4(2007).
[8].Y.L.Li,K.L.Yao and Z.L.Liu, “Structure, stability and magnetic properties of the Fe₃O₄(110)surface: density functional theory study”,Surface Science,601, 876-882 (2007).
[9].Y.L.Li,K.L.Yao and Z.L.Liu, “Spin distribution and electronic structure of the ferromagnetic half-metal [Mn(bipy)(N₃)₂]: ab initio study”,Physica B: Condensed Matter,395, 28 (2007).
[10]Y.L.Liand D.N.Zhang, “First-principles study on the magnetic, half-metal and thermoelectric transport properties of inorganic-organic hybrid compounds [C₄N₂H₁₂][Fe^II₄(HPO₃)₂(C₂O₄)₃]”,Commun. Theor. Phys.60, 233-239 (2013).
[11]Tai-Gang Liu, Wen-Qing Zhang,Yan-Li Li^*, “First-principles study on the structure, electronic and magneticpropertiesof HoSi_n(n= 1–12, 20) clusters”,Front. Phys.9(2), 210 (2014).
[12] Dan-Na Zhang, Li Zhao, Jia-Fu Wang,Yan-Li Li*,“Electronic structures and the stabitily of MgO surface: density-functional study”,Surface Review and Letters,22(3), ** (2015).
[13]Jia-Ning Li, San-Lue Hu, Hao-Yu Dong, Xiao-Ying Xu, Jia-Fu Wang, Ang Li, Qing-Guo Wang andYan-Li Li,*, “The tuning effect of the electric field on thephysical properties ofsome typicalwurtzite semiconductors”,Mod.Phys.Lett.B,31, ** (2017).[14]San-Lue Hu, Li Zhao andYan-Li Li^*, “Graphitic Nanofilms of Zinc-Blende Materials: Ab Initio Calculations”,Mater.Res.Express4,125018(2017).
[15]J. K.Wang, Y. J. Ke, Q. X. Xie,Y. L. Liand J. F. Wang, “ Electric field manipulation of multiple nonequivalent Dirac cones in the electronic structures of hexagonal CrB₄sheet”, Chin.Phys.B27, 097304 (2018).
[16]C.P.Chen,J.P.WuandY.L.Li，“TheCalculatedMagneticandOpticalPropertiesof (Mn,N) Co-dopedZnS”,RussianJournalofPhysicalChemistryA,88(7), 1215 (2014).
[17] I.Dabo, A.Ferretti, C-H.Park, N.Poilvert,Y.L.Li, M.Cococcioni and N.Marzari, “Donor and acceptor levels of organic photovoltaic compounds from first principles”,Phys. Chem. Chem. Phys.15, 685 (2013).
[18] K.L.Yao,Y.L.Liand Z.L.Liu，“First-principles study on the electronic structure and the ferromagnetic properties of the organic-inorganic hybrid compound Cr[(H3N-(CH2)2-PO3)(Cl)(H2O)]”，Journal of Magnetism and Magnetic Materials301, 112 (2006).
[19] K.L.Yao,Y.L.Li, Z.L.Liu and S.H.Qu, “The electronic structure and the ferromagnetic properties of Fe[CH₃PO₃].H₂O”,Physica B: Physics of Condensed Matter369,123 (2005).
[20]I.Dabo, é.Cances,Y.L.Li,and N.Marzari, “First-principles simulation of electrochemical systemsat fixed applied voltage:vibrationalstark effect for CO on platinum electrodes”, (submitted to PRL).
[21] I.Dabo,Y.L.Li，N.Bonnet and N.Marzari,“Ab initio electrochemical properties of electrode surfaces”, Fuel Cell Science: Theory, Fundamentals, and Biocatalysis, Wiley, 2010.（著作）
[22] I.Dabo, A.Ferretti, N.Poilvert,Y.L.Li, N.Marzari and M.Cococcioni, “Koopmans’ condition for density-functional theory”,Phys. Rev. B82, 115121 (2010).
[23] I.Dabo, é.Cances,Y.L.Li,and N.Marzari, “First-principles electrochemistry”, (conference paper)-14^thinternational workshop on computational physics and materials science: total energy and force methods, 8-10 January 2009, Trieste, Italy.（会议）
[24] Yao K.L., Gao G.Y., Liu Z.L., Zhu, L., andY.L.Li., “Half-metallic ferromagnetic semiconductors of V- and Cr-doped CdTe studied from first-principles pseudopotential calculations”,Physica B: Physics of Condensed Matter366, 62 (2005).
[25] G.Y. Gao, K. L. Yao, Z.L. Liu,Y.L.Li, Y.C. Li, Q.M. Liu, “Ab initio pseudopotential studies of the pressure dependences of structural, electronic and optical properties for GaN”,Solid State Communications,138, 494, (2006).
[26] G.Y.Gao, K.L.Yao, Z.L.Liu, andY.L.Li, “Half-metallic ferromagnetism of Cr-doped rutile TiO2: A first-principles pseudopotential study”,Physica B: Physics of Condensed Matter,382, 14,(2006).
[27] K.L.Yao, X.L.Li, Z.L.Liu,Y.L.Li,and G.Y.Gao, “First-principles study on the metallic antiferromagnet Co[PhPO₃] .H₂O”,Journal of Magnetism and Magnetic Materials,312, 16 (2007).