李妍璐，女，博士，現任山東大學晶體材料研究所教師。
基本介紹
- 中文名：李妍璐
- 學位/學歷：博士
- 職業：教師
- 專業方向：為光學晶體、壓電晶體等無機功能晶體的構效關係研究
- 任職院校：山東大學晶體材料研究所
個人經歷,主講課程,研究方向,學術成果,
個人經歷
2007年畢業於濟南大學材料學院材料物理專業，獲得學士學位。2011年于山東大學晶體材料研究所材料物理與化學專業博士畢業，2012年赴德國帕德博恩大學理論物理系從事博士後研究，2014年就職于山東大學晶體所，趙顯教授課題組，聘為副研究員，2015年聘為碩士生導師，2017年聘為副教授，2018年聘為博士生導師
學習及工作經歷：
2018.09至今：山東大學晶體所，副教授，博士生導師
2017.09-2018.08：山東大學晶體所，副教授，碩士生導師
2015.09-2017.08：山東大學晶體所，副研究員，碩士生導師
2014.12-2015.08：山東大學晶體所，副研究員
2012.06-2014.12：德國帕德博恩大學，理論物理系，博士後
2007.09-2011.12：山東大學晶體所，材料物理與化學專業，博士
2003.09-2007.07：濟南大學材料學院，材料物理專業，本科
主講課程
《材料分子模擬》
研究方向
當前研究方向為光學晶體、壓電晶體等無機功能晶體的構效關係研究、石墨烯生長和電子結構調控、儲能材料的結構設計和機理研究等
無機功能晶體構效關係研究、
石墨烯生長及電子結構調控、
儲能材料結構設計和機理研究
學術成果
主持科研項目：
2018.01-2019.12，“KDP類晶體雷射損傷來源的理論研究”，重點實驗室自主課題，負責人
2016.01-2018.12，“鈮酸鋰晶體摻雜離子與本徵缺陷相互作用的機理探索”，國家自然科學基金青年項目，負責人
發表的科研論文：
2019年：
1. Tingting Sui, Yafei Lian, Mingxia Xu, Lisong Zhang,Yanlu Li,*Xian Zhao, Xinguang Xu, Xun Sun* "Comparison of hydrogen vacancies in KDP and ADP crystals: A Combination of Density Functional Theory Calculation and Experiment"Phys. Chem. Chem. Phys. Accepted(2019).
2. Shiwei Tian, Lili Li, Feifei Chen, Chao Jiang, Fapeng Yu,*Yanlu Li,*Xiulan Duan, Zhengping Wang, Shujun Zhang, Xian Zhao "Electrical properties of yttrium calcium oxyborate crystals annealed at high temperature and low oxygen partial pressure"Journal of MateriomicsDOI:org/10.1016/j.jmat.2019.02.007 (2019).
3. Yunjie Li, Xiucai Sun, Zhenjie Cheng, Xiao Xu, Jun Pan, Xianfeng Yang, Fang Tian,Yanlu Li,*Jian Yang,* Yitai Qian "Mesoporous Cu2-xSe nanocrystals as an ultrahigh-rate and long-lifespan anode material for sodium-ion batteries"Energy Storage MaterialsDOI:org/10.1016/j.ensm.2019.02.009 (2019).
4. Li, Lili,Yanlu Li,*Xian Zhao "Interaction between Bi dopants and intrinsic defects in LiNbO3from local and hybrid density functional theory calculations"Inorg. Chem.DOI:10.1021/acs.inorgchem.8b03167 (2019).
5. Shouzhi Wang, Lili Li, Yongliang Shao, Lei Zhang,Yanlu Li,*Yongzhong Wu, Xiaopeng Hao*, “Transition-metal oxynitride: A facile strategy for improving electrochemical capacitor Storage”Adv. Mater.1806088 (2019).
6. Yongjun Fan,Lili Li,Yanlu Li,*Xueqin Sun, Xian Zhao “Hybrid density functional theory study of vanadium doping in stoichiometric and congruent LiNbO3”Phys. Rev. B99, 035147 (2019).
2018年：
1.Xiucai Sun, Zhen Su, Jing Zhang, Xizheng Liu,Yanlu Li,*Fapeng Yu,* Xiufeng Cheng, Xian Zhao “Graphene nucleation preference at CuO defects rather than Cu2O on Cu(111): A combination of DFT Calculation and Experiment”ACS Appl. Mater. Interfaces10, 43156 (2018).
2.Xiaoli Sun, Baitao Zhang,*Yanlu Li,*Xingyun Luo, Guoru Li, Yanxue Chen, Chengqian Zhang, Jingliang He “Tunable ultrafast nonlinear optical properties of graphene/MoS2van der waals heterostructures and their application in solid-state bulk lasers”ACS Nano12, 11376 (2018).
3.Lili Li,Yanlu Li,*Xian Zhao “Doping stability of nonphotorefractive ions in stoichiometric and congruent LiNbO3”Phys. Chem. Chem. Phys.20, 17477 (2018),
4.Peng Zhao,Yanlu Li,*Lili Li, Shulin Bu, Weiliu Fan,* “Oxygen vacancy-modified B-/N-Codoped ZnGa2O4nanospheres with enhanced photocatalytic hydrogen evolution performance in the absence of a Pt cocatalyst”J. Phys. Chem. C122, 10737 (2018).
5.Tingting Sui, Yafei Lian, Mingxia Xu, Lisong Zhang,Yanlu Li,*Xian Zhao, Xun Sun,* “Stability and electronic structure of hydrogen vacancies in ADP: hybrid DFT with vdW correction”RSC Adv.8, 6931 (2018).
6.Dehui Sun, Wei Song, Lili Li, Yuke Chen, Fulei Wang, Longyue Liang, Xin Yu,Yanlu Li,*Yuanhua Sang,* Hong Liu* “Origin of ferroelectric modification: The thermal behavior of dopant ions”Cryst. Growth Des.18, 4860-4863 (2018).
7.Jing Yang,Yanlu Li, Xian Zhao, Weiliu Fan,* “Critical role of water and oxygen defects in C-O Scission during CO2Reduction on Zn2GeO4(010)”Langmuir34, 3742, (2018).
8.Shiwei Tian, Lili Li, Fapeng Yu,*Yanlu Li, Feifei Chen, Xiulan Duan, Xiufeng Cheng, Zhengping Wang, Shujun Zhang, Xian Zhao “Structural stability and electro-elastic property of YCOB crystal annealed in harsh environment”Appl. Phys. Lett.113, 122905 (2018).
9.Feifei Chen, Xinle Wang, Lei Wei, Fapeng Yu,* Shiwei Tian, Chao Jiang,Yanlu Li, Xiufeng Cheng, Zhengping Wang, Xian Zhao,* “Thermal properties and CW laser performances of pure and Nd doped Bi2ZnB2O7single crystals”CrystEngComm,20, 7094-7099 (2018).
10.Jing Zhang, Zhiyuan Yang, Li Sun, Fapeng Yu,*Yanlu Li, Xiufeng Cheng, Xizheng Liu, Xian Zhao “Preparation of bilayer graphene utilizing CuO as nucleation sites by CVD method”Journal of Materials Science: Materials in Electronics29, 4495 (2018).
2017年：
1.Yanlu Li, Lili Li, Xiufeng Cheng,* Xian Zhao,* “Microscopic properties of Mg in Li and Nb sites of LiNbO3by first-principle hybrid functional: Formation and related optical properties”J. Phys. Chem. C121, 8968 (2017).
2.Lili Li,Yanlu Li,*Xian Zhao “Hybrid density functional theory insight into the stability and microscopic properties of Bi-doped LiNbO3: Lone electron pair effect”Phys. Rev. B96, 115118 (2017).
3.Weishan Yan, Dongfang Zhao, Ling Zhang, Ran Jia, Naikun Gao, Dongdong Zhang, Wenyao Luo,Yanlu Li, Duo Liu,* “Optically induced reversible wettability transition on single crystal lithium niobate surfaces”Appl. Phys. Lett.111, 091603 (2017).
4.Xinle Wang, Hongwei Qi,Yanlu Li, Fapeng Yu, * Hewei Wang, Feifei Chen, Yanqing Liu, Zhengping Wang,* Xinguang Xu, Xian Zhao “Synthesis and characterization of new Sr3(BO3)2crystal for stimulated raman scattering applications”Crystals7, 125 (2017).
5.Feifei Chen, Lingfeng Kong, Fapeng Yu,* Chunlei Wang, Qingming Lu, Shujun Zhang,*Yanlu Li, Xiulan Duan, Lifeng Qin, Xian Zhao,* “Investigation of the crystal growth, thickness and radial modes of α-BiB3O6piezoelectric crystals”CrystEngComm19, 546 (2017),
6.Hewei Wang, Feifei Chen, Fapeng Yu,* Qingming Lu,Yanlu Li, Xiulan Duan, Shujun Zhang, Xian Zhao,* “Temperature dependence of the electro-elastic properties of the monoclinic α-BiB3O6crystals”Journal of Alloys and Compounds699, 505 (2017).
2016年：
Yanli Zhou,Yanlu Li, Jing Yang, Jian Tian, Huayun Xu, Jian Yang,* Weiliu Fan,* “Conductive polymer-coated VS4submicrospheres as advanced electrode materials in lithium-ion batteries”ACS Appl. Mater. Interfaces8, 18797 (2016).
2015年：
1.Yanlu Li,Xian Zhao,* Xiufeng Cheng “Point defects and defect-induced optical response in ternary LiInSe2crystals: First-principles insight”J. Phys. Chem. C119, 29123 (2015).
2.Yanlu Li,Wolf Gero Schmidt, Simone Sanna* “Defect complexes in congruent LiNbO3and their optical signatures”Phys. Rev. B91, 174106 (2015).
3. Huan Wang, Chuanyi Jia, Jing Yang, Xian Zhao,Yanlu Li, Honggang Sun, Weiliu Fan* “Theoretical study of surface dependence of NH3adsorption and decomposition on spinel-type MgAl2O4”RSC Adv.5, 77973 (2015).
2014年：
1. Lei Yang, Weiliu Fan,Yanlu Li,*Lei Wei, Xian Zhao* “Pressure-induced ferroelastic phase transition in SnO2from density functional theory”J. Chem. Phys.140, 164706 (2014).
2.Yanlu Li,*Simone Sanna, Wolf Gero Schmidt “Modeling intrinsic defects in LiNbO3within the Slater-Janak transition state model”J. Chem. Phys.140, 234113 (2014).
3.Yanlu Li,*Wolf Gero Schmidt, Simone Sanna “Intrinsic LiNbO3point defects from hybrid density functional calculations”Phys. Rev. B89, 094111 (2014).
2013年：
1. S. Sanna,* A. Riefer, M. Rohrmueller, M. Landmann, E. Rauls, N. J. Vollmers, R. Hoelscher, M. Witte,Yanlu Li, U. Gerstmann, W. G. Schmidt, “Lithium niobate dielectric function and second-order polarizability tensor from massively parallel ab initio calculations”High performance computing in science and engineering ’13, Springer, 93-104 (2013).
2. A. Riefer, M. Rohrmueller, M. Landmann, S. Sanna,* E. Rauls, N. J. Vollmers, R. Hoelscher, M. Witte,Yanlu Li, U. Gerstmann, A. Schindlmayr, W. G. Schmidt, “Polarization dependent water adsorption on the lithium niobate Z-cut surfaces”High performance computing in science and engineering ’13, Springer, 155-166 (2013).
3. Lei Wei, Guodong Zhang, Weiliu Fan,*Yanlu Li, Lei Yang, Xian Zhao,* “Anisotropic thermal anharmonicity of CdSiP2and ZnGeP2: Ab initio calculations”J. Appl. Phys.114, 233501 (2013).
4. Lei Wei, Weiliu Fan,*Yanlu Li, Xian Zhao,* Lei Yang, “Effect of cation ordering on the electronic and lattice dynamic properties of Ag2CdGeS4polytypes: First-principle calculation”J. Solid State Chem.201, 48 (2013).
2012年：
1.Yanlu Li,Weiliu Fan,* Xiufeng Cheng, Xian Zhao “Theoretical insights into the Ag doping in monolayer and bilayer ZnO armchair nanoribbons: Edge effect and position-dependent properties”J. Nanopart. Res.14, 1 (2012).
2.Yanlu Li,Weiliu Fan,* Honggang Sun, Xiufeng Cheng, Xian Zhao “Role of cross section on the stability and electronic structure of Ag-doped ZnO nanowires”J. Nanopart. Res.14, 739 (2012).
3. Liming Sun, Xian Zhao, Xiufeng Cheng, Honggang Sun,Yanlu Li, Pan Li, Weiliu Fan,* “Role of passivated N-F pairs in enhancing photoactivity of ZnWO4(010) surface: Emphasis on correlation between codoping forms and compensation mechanisms”Chem. Eng. J.211, 168 (2012).
4. Pan Li, Xian Zhao, Chunjiang Jia, Honggang Sun,Yanlu Li, Liming Sun, Xiufeng Cheng, Li Liu, Weiliu Fan,* “Mechanism of morphology transformation of tetragonal phase LaVO4nanocrystals by surface chemistry: Experimental and theoretical insights”Cryst. Growth Des.12, 5042 (2012).
5. Lei Yang, Weiliu Fan,*Yanlu Li, Honggang Sun, Lei Wei, Xiufeng Cheng, Xian Zhao,* “Theoretical insight into the structural stability of KZnB3O6polymorphs with different BOxpolyhedral networks”Inorg. Chem.51, 6762 (2012).
6. Liming Sun, Xian Zhao, Xiufeng Cheng, Honggang Sun,Yanlu Li, Pan Li, Weiliu Fan,* “Synergistic effects in La/N codoped TiO2anatase (101) surface correlated with enhanced visible-light photocatalytic activity”Langmuir28, 5882(2012).
7. Pan Li, Xian Zhao,Yanlu Li, Honggang Sun, Liming Sun, Xiufeng Cheng, Xiaopeng Hao, Weiliu Fan,* “Effects of surface chemistry on the morphology transformation of ZnWO4nanocrystals: investigated from experiment and theoretical calculations”CrystEngComm14, 920 (2012).
2011年：
1.Yanlu Li,Weiliu Fan,* Honggang Sun, Xiufeng Cheng, Pan Li, Xian Zhao* “Computational insight into the effect of monovalent cations on the electronic, optical, and lattice dynamic properties of XInSe2(X = Cu, Ag, Li)”J. App. Phys.109, 113535 (2011).
2.Yanlu Li,Weiliu Fan,* Honggang Sun, Xiufeng Cheng, Pan Li, Xian Zhao* “Electronic, optical and lattice dynamic properties of the novel diamond-like semiconductors Li2CdGeS4and Li2CdSnS4”J. Phys: Condens. Matter23, 225401 (2011).
3.Yanlu Li,Xian Zhao, Weiliu Fan* “Structural, electronic, and optical properties of Ag-doped ZnO nanowires: First-principles study”J. Phys. Chem. C115, 3552 (2011).
4. Liming Sun, Xian Zhao,* Xiufeng Cheng, Honggang Sun,Yanlu Li, Pan Li, Weiliu Fan,* “Evaluating the C, N, and F pairwise codoping effect on the enhanced photoactivity of ZnWO4: The charge compensation mechanism in donor-acceptor pairs”J. Phys. Chem. C115, 15516 (2011).
5. Honggang Sun, Weiliu Fan,*Yanlu Li, Xiufeng Cheng, Pan Li, Jingcheng Hao, Xian Zhao* “Origin of improved visible photocatalytic activity of nitrogen/hydrogen codoping cubic In2O3: First-principles calculations”Phys. Chem. Chem. Phys.13, 1379 (2011).
2010年：
1.Yanlu Li, Weiliu Fan,* Honggang Sun, Xiufeng Cheng, Pan Li, Xian Zhao,* Minhua Jiang, “Nitrogen vacancy and ferromagnetism in Cr-doped GaN: First-principles calculations”J. Solid State Chem.183, 2662 (2010).
2.Yanlu Li, Weiliu Fan,* Honggang Sun, Xiufeng Cheng, Pan Li, Xian Zhao,* “Structural, electronic, and optical properties of αand β-TeO2”J. App. Phys.107, 093506 (2010).
3.Yanlu Li, Weiliu Fan,* Honggang Sun, Xiufeng Cheng, Pan Li, Xian Zhao,* Minhua Jiang, “First-principles study of the electronic structure, optical properties, and lattice dynamics of BC2N”J. Phys. Chem. C114, 2783 (2010).
4.Yanlu Li, Weiliu Fan,* Honggang Sun, Xiufeng Cheng, Pan Li, Xian Zhao,* Jingcheng Hao, Minhua Jiang, “Optical properties of the high-pressure phases of SnO2: First-principles calculation”J. Phys. Chem. A114, 1052 (2010).
5. Honggang Sun, Weiliu Fan,*Yanlu Li, Xiufeng Cheng, Pan Li, Xian Zhao,* “Origin of improved photocatalytic activity of F-doping ZnWO4: A quantum mechanical study”J. Solid State Chem.183, 3052 (2010).
6. Liming Sun, Xian Zhao,*Yanlu Li, Pan Li, Honggang Sun, Xiufeng Cheng, Weiliu Fan,* “First-principles studies of electronic, optical, and vibrational properties of LaVO4polymorph”J. Appl. Phys.108, 093519 (2010).
7. Pan Li, Weiliu Fan,*Yanlu Li, Honggang Sun, Xiufeng Cheng, Xian Zhao,* Minhua Jiang, “First-principles study of the electronic, optical properties and lattice dynamics of Tantalum Oxynitride”Inorg. Chem.49, 6917 (2010).
8. Honggang Sun, Weiliu Fan,*Yanlu Li, Xiufeng Cheng, Pan Li, Xian Zhao,* “Origin of the visible photocatalytic activity of N-doped In2O3: A quantum mechanical study”J. Phys. Chem. C114, 3028 (2010).
2009年：
1.Yanlu Li,Weiliu Fan,* Honggang Sun, Xiufeng Cheng, Pan Li, Xian Zhao,* "First-principles study of the electronic, optical, and lattice dynamics properties of LiInSe2polymorph",J. App. Phys.106, 033704 (2009).
