姓名:雷雪玲
职称:教授
研究方向:凝聚态物理理论计算
办公地点:实验大楼 西510
办公电话: 13330056611
电子邮箱:xueling@mail.ustc.edu.cn
雷雪玲,博士生导师,beplay官方网站官网教授,九三学社社员。2007年河南大学获硕士学位,2012年中国科学技术大学获博士学位。曾于2014年7月—2015年6月在美国南卡罗来纳州立大学做博士后研究,2015年7月—2016年7月在美国本尼迪克特大学做博士后研究。主要从事凝聚态物理理论计算研究,近年来在J. Mater. Chem. A,J. Power Sources,J. Phys. Chem. C,Phys. Chem. Chem. Phys.等国际知名期刊上发表论文四十多篇。主持国家自然科学基金项目4项,江西省自然科学基金项目2项。
主要教育经历:
2009/09–2012/07, 中国科学技术大学, 凝聚态物理学, 博士
2004/09–2007/07, 河南大学, 凝聚态物理学, 硕士
2001/09–2004/07, 河南大学,物理学, 本科
主要科研与工作经历:
2019/12-至今,beplay官方网站官网,物理系,教授
2013/12-2019/11,beplay官方网站官网,物理系,副教授
2012/08-2013/11,beplay官方网站官网,物理系,讲师
2007/08-2012/07,新疆师范大学,物理系,讲师
2015/07-2016/06,美国本尼迪克特大学化学系,博士后研究
2014/07-2015/06,美国南卡大学机械系,博士后研究
主持的科研项目:
国家自然科学基金地区项目,理论研究(Li2O2)n团簇在石墨烯基催化基底上的分解机理,项目批准号:12164020,2022/01-2025/12,38万元,在研,主持。
国家自然科学基金地区项目,11764019,锂空电池阴极反应机理和锂离子输运动力学研究,2018/01-2021/12,45万元,结题,主持。
国家自然科学基金青年项目,11404149,Pt-Cu二元合金纳米晶微观结构及其催化性能的研究,2015/01-2017/12,26万元, 结题,主持。
国家自然科学基金地区项目,10964012,基于硼元素的团簇结构调控和物性研究,2010/01-2012/12,20万,结题,主持。
江西省自然科学基金面上项目,20202BAB201012,以(Li2O2)n团簇模型研究锂-氧电池放电产物过氧化锂的分解机理,2020/01-2022/12,6万,在研,主持。
江西省教育厅一般项目,GJJ14252,Pt-Cu二元合金纳米晶的微观结构和组分对其催化性能影响的理论研究,2014/01-2016/12,2万元,结题,主持。
主要著作:
Xueling Lei,Kahla Haines,Kevin Huang,Changyong Qin *, Density functional theory study of oxygen migration in molten carbonate,Journal of Power Sources,2016,305: 161~166.(SCI一区论文)
Yao Wang,Xueling Lei,Yanxiang Zhang, Fanglin Chen∗∗, Tong Liu∗, In-situ growth of metallic nanoparticles on perovskite parent as a hydrogen electrode for solid oxide cells.Journal of Power Sources, 2018, 405(30):114–123.(SCI一区论文)
Xueling Lei,Youngseok Jee,Kevin Huang *, Amorphous Na2Si2O5 as a fast Na+conductor: an ab initio molecular dynamics simulation,J. Mater. Chem. A,2015,3(39):19920~19927.(SCI一区论文)
Jingjing Tong,Xueling Lei,Jie Fang,Minfang Han,Kevin Huang *,Remarkable O2 permeation through a mixed conducting carbon capture membrane functionalized by atomic layer deposition,J. Mater. Chem. A, 2016, 4(5):1828~1837.(SCI一区论文)
Musheng Wu, Bo Xu,Xueling Lei, Kelvin Huang and Chuying Ouyang *, Bulk properties and transport mechanisms of a solid state antiperovskite Li-ion conductor Li3OCl: insights from first principles calculations.J. Mater. Chem. A, 2018, 6: 1150–1160.(SCI一区论文)
Hewen Wang, Musheng Wu,Xueling Lei,Zhengfang Tian, Bo Xu, Kevin Huang⁎, Chuying Ouyang⁎⁎, Siligraphene as a promising anode material for lithium-ion batteries predicted from first-principles calculations.Nano Energy, 2018, 49: 67–76.(SCI一区论文)
Xueling Lei*,Wenjun Wu, Bo Xu, Chuying Ouyang, Kevin Huang, LiGaOS is a fast Li-Ion conductor: A first-principles prediction,Materials & Design, 2020, 185, 108264.(SCI一区论文)
Binpeng Hou,Xueling Lei*, Shuying Zhong*, Baozhen Sun and Chuying Ouyang,Dissociation of (Li2O2)0,+on graphene and boron-doped graphene: insights from first-principles calculations,Phys. Chem. Chem. Phys., 2020, 22: 14216—14224.(SCI二区论文)
Binpeng Hou,Xueling Lei*, Zuoliang Gan, Shuying Zhong, Gang Liu and Chuying Ouyang, Structural and electronic properties of small lithium peroxide clusters in view of the charge process in Li–O2 batteries,Phys. Chem. Chem. Phys., 2019, 21: 19935—19943.(SCI二区论文)
Chanjuan Shang, Bo Xu*,Xueling Lei*, Shicheng Yu; Diancheng Chen, Musheng Wu, Baozhen Sun, Gang Liu, Chuying Ouyang, Bandgap tuning in MoSSe bilayers: synergistic effects of dipole moment and interlayer distance,Phys. Chem. Chem. Phys., 2018, 20: 20919~20926.(SCI二区论文)
Chanjuan Shang,Xueling Lei*, Binpeng Hou, Musheng Wu, Bo Xu, Gang Liu, and Chuying Ouyang, Theoretical Prediction of Janus MoSSe as a Potential Anode Material for Lithium-Ion Batteries,J. Phys. Chem. C, 2018, 122: 23899−23909.(SCI二区论文)
Xueling Lei *, Bo Xu, Chuying Ouyang, and Kevin Huang, Structural and Electronic Features of Nb-Doped SrCoO3: Insight from First-Principles Calculations,J. Phys. Chem. C,2017,121: 24987−24993.(SCI二区论文)
Xueling Lei,Godwin Mbamalu,Changyong Qin *,CO Oxidation by Molecular and Atomic Oxygen on Ag(100): A Density Functional Theory Study,J. Phys. Chem. C,2017,121: 2635~2642.(SCI二区论文)
Diancheng Chen,Xueling Lei *, Yanan Wang, Shuying Zhong, Gang Liu, Bo Xu, Chuying Ouyang, Tunable electronic structures in BP/MoSSe van der Waals heterostructures by external electricfield and strain,Applied Surface Science, 2019, 497: 143809.(SCI二区论文)
Wenjun Wu,Xueling Lei*, Shuying Zhong, Baozhen Sun, Chuying Ouyang, First-principles insights of hydrogen diffusion dynamics at the α-Al2O3(0001) surface,Applied Surface Science, 2020, 531: 147263.(SCI二区论文)
Xueling Lei*, Chuying Ouyang, Kevin Huang*, A First-Principles Investigation of Janus MoSSe as a Catalyst for Photocatalytic Water-Splitting,Applied Surface Science, 2020, 537:147919.(SCI二区论文)
Xueling Lei *, Haimen Mu, Shuai Li, Gang Liu, Bo Xu, Chuying Ouyang, The structural and electronic properties of Pt-Cu alloy clusters: Embedding atom method combined with density functional theory study.Journal of Alloys and Compounds, 2018, 741: 604−609.(SCI二区论文)
Haimen Mu,Bo Xu,Chuying Ouyang,Xueling Lei *,Highly optimized embedding atom method potential for Pt-Cu alloys,Journal of Alloys and Compounds,2017,696: 470~480.(SCI二区论文)
Xueling Lei,Jie Wang,Kevin Huang *,Fast Li-Ion Transport in Amorphous Li2Si2O5: An Ab Initio Molecular Dynamics Simulation,Journal of the Electrochemical Society,2016,163(7): A1401~A1407.(SCI二区论文)
Xueling Lei *,Gang Liu,Musheng Wu,Bo Xu,Chuying Ouyang,Bicai Pan,Hydrogen storage on calcium-decorated BC7 sheet: A first-principles study,International Journal of Hydrogen Energy,2014,39 (5): 2142~2148.(SCI二区论文)
Bo Xu,Xueling Lei *,Gang Liu,Musheng Wu,Chuying Ouyang,Li-decorated graphyne as high-capacity hydrogen storage media: First-principles plane wave calculations,International Journal of Hydrogen Energy,2014,39(30):17104~17111.(SCI二区论文)
Xueling Lei, Kevin Huang, Changyong Qin *, Proton Transfer in Molten Lithium Carbonate: Mechanism and Kinetics by Density Functional Theory Calculations,Scientific Reports, 2017, 7: 7381.(SCI三区论文)
Jingjing Tong,Xueling Lei, Peng Zhang, Kevin Huang, Godwin Mbamalua and Changyong Qin *, Can molten carbonate be a non-metal catalyst for CO oxidation?New J. Chem., 2018, 42(19): 16372−16377.(SCI三区论文)
Xueling Lei,Kevin Hang *,Changyong Qin *,Enhanced interfacial proton migration on BaZr(Y)O3 by molten carbonate: A first principles study,Solid State Ionics,2016,289: 48~54.(SCI三区论文)
H.W. Wang,X.L. Lei,Z.F. Tian, C.Y. Ouyang⁎, Bonding interactions in Li/Na oxides, peroxides and superoxides and their implication to the performance of the Li/Na-air batteries,Solid State Ionics, 2017, 303:24-28.(SCI三区论文)
Xiaolei Xiong,Xueling Lei,Cuijuan Zhang,Jie Wang,Kevin Huang *,Synergetic proton conduction in BaZr0.8Y0.2O3-δ–carbonate composite electrolyte for intermediate temperature solid oxide fuel cells,Solid State Ionics,2015,279:66~71.(SCI三区论文)
Xueling Lei,Changyong Qin,Kevin Huang *,Energetics of proton transfer in alkali carbonates: a first principles calculation,Rsc Advances, 2015, 5(69): 56205~56209.(SCI三区论文)
Xueling Lei,Kahla Haines,Kevin Huang,Changyong Qin *,DFT Study of Oxygen Dissociation in Molten Carbonate,J. Phys. Chem. A,2015,119 (33): 8806~8812.(SCI三区论文)
Xueling Lei *,Musheng Wu,Gang Liu,Bo Xu,Chuying Ouyang,The Role of Cu in Degrading Adsorption of CO on the PtnCu Clusters,J. Phys. Chem. A,2013,117 (34):8293~8297.(SCI三区论文)
Zuoliang Gan,Xueling Lei⁎,Wenjun Wu, Shuying Zhong⁎, Lithium vacancy migration in Li2O2: From first principles studies,Comp. Mater. Sci., 2020, 184:109873.(SCI三区论文)