Computational Condensed Matter Physics

Articles 

260 publications with total citations of over 10000（H index 50）based on Web of Science, including: Progress in Materials Science （1）, Reports on Progress in Physics (1), NPG Asia Materials (2), Physical Review Letters (2)， Journal of the American Chemical Society（7）, Nano Letters (4），Advanced Materials (6）， Advanced Functional Materials (1）,  ACS Nano （4），Angewandte Chemie (1), 2D Materials (2), Chemistry of Materials (3), Small (2), Scientific Reports (9).

23 papers received over 100 citations each. 12 correspondence-authored articles were ranked as Highly Cited Papers, 1 article was ranked as Hot Paper by Essential Science Indicators of Web of Science, and 6 are invited reviews.

List of Representative Articles：

1.       High-performance sub-10 nm monolayer Bi2O2Se transistors, Ruge Quhe, Junchen Liu, Jinxiong Wu, Jie Yang, Yangyang Wang, Qiuhui Li, Tianran Li, Ying Guo, Jinbo Yang, Hailin Peng, Ming Lei, and Jing Lu*, Nanoscale 11(2), 532-540 (2019).

2.       Many-body Effect and Device Performance Limit of Monolayer InSe, Yangyang Wang, Ruixiang Fei, Ruge Quhe, Jingzhen Li, Han Zhang, Xiuying Zhang, Bowen Shi, Lin Xiao, Zhigang Song, Jinbo Yang, Jun-jie Shi, Feng Pan*, and Jing Lu*, ACS Applied Materials & Interfaces, 10(27), 23344 (2018).

3.       Simulations of Quantum Transport in Sub-5-nm Monolayer Phosphorene Transistors, Ruge Quhe, Qiuhui Li, Qiaoxuan Zhang, Yangyang Wang, Han Zhang, Jingzhen Li, Xiuying Zhang, Dongxue Chen, Kaihui Liu, Yu Ye, Lun Dai, Feng Pan, Ming Lei, and Jing Lu*, Phys. Rev. Appl. 10(2), 024022 (2018)

4.       Dependence of excited-state properties of tellurium on dimensionality: From bulk to two dimensions to one dimensions, Yuanyuan Pan, Shiyuan Gao, Li Yang*, and Jing Lu*, Phys. Rev. B 98, 085135 (2018).

5.       Valley Pseudospin with a Widely Tunable Bandgap in Doped Honeycomb BN Monolayer, Zhigang Song†, Ziwei Li†, Hong Wang, Xuedong Bai, Wenlong Wang, Honglin Du, Sunquan Liu, Changsheng Wang, Jingzhi Han, YingchangYang, Zheng Liu, Jing Lu*, Zheyu Fang*, Jinbo Yang*, Nano Lett. 17, 2079 (2017)

6.       Many-body Effect, Carrier Mobility, and Device Performance of Hexagonal Arsenene and Antimonene, Yangyang Wang, Pu Huang, Meng Ye, Ruge Quhe, Yuanyuan Pan, Han Zhang, Hongxia Zhong, Junjie Shi, * Jing Lu, * Chemistry of Materials, DOI: 10.1021/acs.chemmater.6b04909. (2017)

7.       Monolayer Phosphorene Metal Contacts, Yuanyuan Pan, Yangyang Wang, Meng Ye, Ruge Quhe, Hongxia Zhong, Zhigang Song, Xiyou Peng, Dapeng Yu, Jinbo Yang, Junjie Shi, and Jing Lu*, Chemistry of Materials 28, 2100 (2016).

8.       Interfacial Properties of Monolayer and Bilayer MoS2 Contacts with Metals: Beyond the Energy Band Calculations, Hongxia Zhong,# Ruge Quhe,# Yangyang Wang, Zeyuan Ni, Meng Ye, Zhigang Song, Yuanyuan Pan, Jinbo Yang, Li Yang, Lei Ming, Junjie Shi*, and Jing Lu*, Scientific Reports 6, 21786 (2016).

9.       All-metallic Vertical Transistors Based on Stacked Dirac Materials, Yangyang Wang, Zeyuan Ni, Qihang Liu, Ruge Quhe, Jiaxin Zheng, Meng Ye, Dapeng Yu, Junjie Shi, Jinbo Yang, Ju Li, and Jing Lu*, Advanced Functional Materials 25, 68 (2015).

10.     Quantum spin Hall insulators and quantum valley Hall insulators of BiX/SbX (X = H, F, Cl, and Br) monolayers with a record bulk band gap, Zhigang Song, Cheng-Cheng Liu, Jinbo Yang*, Jingzhi Han, Meng Ye, Botao Fu, Yingchang Yang, Qian Niu, Jing Lu* & Yugui Yao*, NPG Asia Materials 6,e147 (2014)

11.     Interfacial Properties of Bilayer and Trilayer Graphene on Metal Substrates, Jiaxin Zheng,Yangyang Wang, Lu Wang, Ruge Quhe, Zeyuan Ni, Wai-Ning Mei, Zhengxiang Gao, Dapeng Yu, Junjie Shi, and Jing Lu*, Scientific Reports 3, 2081 (2013); doi:10.1038/srep02081.

12.     Tunable and Sizable Band Gap of Single Layer Graphene Sandwiched between Hexagonal Boron Nitride, Ruge Quhe, Jiaxin Zheng, Guangfu Luo, Qihang Liu, Rui Qin, Jing Zhou, Dapeng Yu, Shigeru Nagase, Wai-Ning Mei, Zhengxiang Gao, and Jing Lu*, NPG Asia Materials 4, e6 (2012); doi:10.1038/am.2012.10.

13.     Tunable and sizable band gap in silicene by surface adsorption, Ruge Quhe, Ruixiang Fei, Qihang Liu, Jiaxin Zheng, Hong Li, Chengyong Xu, Zeyuan Ni, Yangyang Wang, Dapeng Yu, Zhengxiang Gao, and Jing Lu*, Scientific Reports 2：853 (2012); doi:10.1038/srep00853.

14.     Tunable band gap in silicene and germanene, Zeyuan Ni, Qihang Liu, Kechao Tang, Jiaxin Zheng, Jing Zhou, Rui Qin, Zhengxiang Gao, Dapeng Yu, Jing Lu*, Nano Lett. 12, 113 (2012).

15.     Co–crystal of Paramagnetic Endohedral Metallofullerene La@C82 and Nickel Porphyrin with High Electronic Mobility, Satoru Sato*, Hidefumi Nikawa, Shu Seki, Lu Wang, Guangfu Luo, Jing Lu*, Masayuki Haranaka, Takahiro Tsuchiya, Shigeru Nagase* and Takeshi Akasaka*, Angewandte Chemie 7, 1589 (2012).

16.     Tunable Charge-transport Property of Ih–C80 Endohedral Metallofullerenes: Investigation of La2@C80, Sc3N@C80, and Sc3C2@C80, Satoru Sato, Shu Seki* Guangfu Luo, Mitsuaki Suzuki, Jing Lu* Shigeru Nagase* and Takeshi Akasaka*, J. Am. Chem. Soc. 134,  11681（2012）.

17.     Functionalized Graphene for High Performance Two-dimensional Spintronics Devices, Linze Li, Rui Qin, Hong Li, Lili Yu, Qihang Liu, Guangfu Luo, Zhengxiang Gao, and Jing Lu*, ACS NANO 4, 2061 (2011).

18.     Semi-metallic Single-component Crystal of Soluble La@C82 Derivative with High Electron Mobility, Satoru Sato, Shu Seki, Yoshihito Honsho, Guangfu Luo, Lu Wang, Jing Lu, Hidefumi Nikawa, Masayuki Haranaka, Takahiro Tsuchiya, Shigeru Nagase and Takeshi Akasaka*,J. Am. Chem. Soc. 133, 2766 (2011).

19.     Mixed Low-dimensional Nanomaterial: 2D MoS2 Inorganic Nanoribbons Encapsulated in Quasi-1D Carbon Nanotubes, Zhiyong Wang, Hong Li, Zheng Liu, Zujin Shi,* Jing Lu*, Kazu Suenaga,* Soon-Kil Joung, Toshiya Okazaki, Zhennan Gu, Jing Zhou, Zhengxiang Gao, Guangping Li, Stefano Sanvito, Enge Wang, and Sumio Iijima, J. Am. Chem. Soc. 132, 13840 (2010).

20.     A facile, low-cost and scalable method of selective etching semiconducting single-walled carbon nanotubes by a gas reaction, Y. Liu*, H. Zhang, L. Cao, D. Wei, Dr. Y. Wang, H. Kajiura*, Dr. Y. Li, K. Noda,G. Luo, L. Wang, J. Zhou, J. Lu*, Z. Gao, Advanced Materials 21， 813 （2009）.

21.     Novel One-Dimensional Organometallic Half Metals: Vanadium-Cyclopentadienyl, Vanadium-Cyclopentadienyl-Benzene, and Vanadium-Anthracene Wires: Lu Wang, Zixing Cai, Junyu Wang, Jing Lu*, Guangfu Luo, Lin Lai, Jing Zhou, Rui Qin, Zhengxiang Gao*, Dapeng Yu, Guangping Li, Wai Ning Mei, and Stefano Sanvito, Nano Lett. 8, 3640 (2008).

22.      Selective interaction of large or charge-transfer aromatic molecules with metallic single-wall carbon nanotubes: critical role of the molecular size and orientation, Jing Lu*, Shigeru Nagase*, Xinwei Zhang, Dan Wang, Ming Ni, Yutaka Maeda, Takatsugu Wakahara, Tsukasa Nakahodo, Takahiro Tsuchiya, Takeshi Akasaka*, Zhengxiang Gao, Dapeng Yu, Hengqiang Ye, W. N. Mei, Yunsong Zhou, J. Am. Chem. Soc. , 128, 5114 (2006).

23.     Large-Scale Separation of Metallic and Semiconducting Single-Walled Carbon Nanotubes, Yutaka Maeda, Shin-ichi Kimura, Makoto Kanda, Yuya Hirashima, Tadashi Hasegawa, Takatsugu Wakahara, Yongfu Lian, Tsukasa Nakahodo, Takahiro Tsuchiya, Takeshi Akasaka, Jing Lu, Xinwei Zhang, Zhengxiang Gao, Dapeng Yu,Shigeru Nagase, Said Kazaoui, Nobutsugu Minami, Tetsuo Shimizu, Hiroshi Tokumoto, Riichiro Saito, J. Am. Chem. Soc. 127, 10287 (2005).

24.     Amphoteric and controllable doping of carbon nanotubes by encapsulation of organic and organometallic molecules, Jing Lu*, Shigeru Nagase*, Dapeng Yu, Hengqiang Ye, Rushan Han, Zhengxiang Gao, Shuang Zhang, Lianmao Peng, Physical Review Letters 93, 116804 (2004).

25.     Structural and electronic properties of metal-encapsulated silicon clusters in a large size range, Jing Lu* and Nagase*, Physical Review Letters 90, 115506 (2003).

Review：

1.       Rise of Silicene: a Competitive 2D Material, Progress in Materials Science, Jijun Zhao*, Hongsheng Liu, Zhiming Yu, Ruge Quhe, Si Zhou, Yangyang Wang, Cheng Cheng Liu, Hongxia Zhong, Nannan Han, Jing Lu*, Yugui Yao*, Kehui Wu* ,  Progress in Materials Science 83，24 (2016).

2.       Silicene Spintronics, Yangyang Wang, Ruge Quhe, Dapeng Yu, and Jing Lu*, Chinese Physics B 24, 087201 (2015) (invited review). 

3.       Silicene Transistors, Ruge Quhe, Yangyang Wang, and Jing Lu*, Chinese Physics B 24, 088105 (2015) (invited review).

4.       Silicene on substrates: A theoretical perspective, HongXia Zhong, RuGe Quhe, YangYang Wang, JunJie Shi, Jing Lu*, Chinese Physics B 24, 087308 (2015) (invited review).

5.       Modeling of stacked 2D materials and devices, Xiaofeng Qian, Yangyang Wang, Wenbin Li, Jing Lu, and Ju Li, 2D Materials 2, 032003(2015) (review).

Full publications：

2020

1.       Reaction Mechanism and Structural Evolution of Fluorographite Cathodes in Solid-State K/Na/Li Batteries, Zhengping Ding*†, Chen Yang†, Jian Zou, Shulin Chen, Ke Qu, Xiumei Ma, Jingmin Zhang, Jing Lu, Weifeng Wei, Peng Gao* and Liping Wang*, Adv. Mater., just accepted

2.       In situ TEM revealing the effects of dislocations on lithium-ion migration in transition metal dichalcogenides, Ruiwen Shao†, Chengkai Yang†, Chen Yang, Shulin Chen, Weikang Dong, Bairong Li, Xiumei Ma, Jing Lu, Lixin Dong, Peng Gao, Dapeng Yu, J. Energy Chem., just accepted

3.       A New Polyanion Na₃Fe₂(PO₄)P₂O₇ Cathode with High Electrochemical Performance for Sodium-Ion Batteries, Yongjie Cao†, Chen Yang†, Yao Liu, Xiuping Xia, Deqiang Zhao, Yuanjie Cao, Haishen Yang, Junxi Zhang*, Jing Lu* and Yongyao Xia*, ACS Energy Lett., just accepted

4.       Gate-tunable high magnetoresistance in monolayer Fe₃GeTe₂ spin valves, Jie Yang, Ruge Quhe, Shiqi Liu, Yuxuan Peng, Xiaotian Sun, Liang Zha, Baochun Wu, Bowen Shi, Chen Yang, Junjie Shi, Guang Tian, Changsheng Wang, Jing Lu* and Jinbo Yang*, Phys. Chem. Chem. Phys., 00, 1-10 (2020)

5.       Sub-5-nm Monolayer Silicane Transistor: A First-Principles Quantum Transport Simulation, Yuanyuan Pan, Jingrou Dai, Lin Xu, Jie Yang, Xiuying Zhang, Jiahuan Yan, Jingzhen Li, Bowen Shi, Shiqi Liu, Han Hu, Mingbo Wu* and Jing Lu*, Phys. Rev. Appl. 14, 024016 (2020)

6.       Direct Observation of Li Migration into V₅S₈: Order to Antisite Disorder Intercalation Followed by the Topotactic-Based Conversion Reaction, Shulin Chen†, Chen Yang†, Ruiwen Shao, Jingjing Niu, Mei Wu, Jian Cao, Xiumei Ma, Jicai Feng, Xiaosong Wu, Jing Lu*, Liping Wang*, Junlei Qi*, Peng Gao*, ACS Appl. Mater. Interfaces 12 (32), 36320-36328 (2020).

7.       Sub-5 nm monolayer germanium selenide (GeSe) MOSFETs: towards a high performance and stable device, Ying Guo, Feng Pan, Gaoyang Zhao, Yajie Ren, Binbin Yao, Hong Li, Jing Lu*, Nanoscale 12 (28), 15443-15452 (2020).

8.       Crepe Cake Structured Layered Double Hydroxide/Sulfur/Graphene as a Positive Electrode Material for Li-S Batteries, Shengtang Liu, Xiuying Zhang, Shitao Wu, Xi Chen, Xiaojing Yang, Wenbo Yue*, Jing Lu*, Wuzong Zhou*, ACS nano 14 (7), 8220–8231 (2020).

9.       Performance Limit of Monolayer WSe₂ Transistors; Significantly Outperform Their MoS₂ Counterpart, Xiaotian Sun*, Lin Xu, Yu Zhang, Weizhou Wang*, Shiqi Liu, Chen Yang, Zhiyong Zhang, Jing Lu*, ACS Appl. Mater. Interfaces 12, 20633-20644 (2020).

10.     Holey graphite: A promising anode material with ultrahigh storage for lithium-ion battery, Chen Yang†, Xiuying Zhang†, Jingzhen Li, Jiachen Ma, Linqiang Xu, Jie Yang, Shiqi Liu, Shibo Fang, Ying Li, Xiaotian Sun, Xiaoyu Yang, Feng Pan, Jing Lu*, Dapeng Yu, Electrochim. Acta 346, 136244 (2020).

11.     First-principles simulation of monolayer hydrogen passivated Bi₂O₂S₂-metal interfaces, Linqiang Xu†, Shiqi Liu†, Han Zhang, Xiuying Zhang, Jingzhen Li, Jiahuan Yan, Bowen Shi, Jie Yang, Chen Yang, Lianqiang Xu, Xiaotian Sun, Jing Lu*, Phys. Chem. Chem. Phys. 22, 7853-7863 (2020).

12.     Monolayer Honeycomb Borophene: A Promising Anode Material with a Record Capacity for Lithium-Ion and Sodium-Ion Batteries, Jingzhen Li, Georgios A. Tritsaris, Xiuying Zhang, Bowen Shi, Chen Yang, Shiqi Liu, Jie Yang, Linqiang Xu, Jinbo Yang, Feng Pan, Efthimios Kaxiras*, Jing Lu*, J. Electrochem. Soc. 167, 090527 (2020).

13.     Ohmic contact in graphene/SnSe₂ Van Der Waals heterostructures and its device performance from ab initio simulation. Hong Li*, Peipei Xu, Jiakun Liang, Fengbin Liu, Jing Luo, Jing Lu*, J. Mater. Sci. 55, 4321-4331 (2020).

14.     Ohmic contacts of monolayer Tl₂O field-effect transistors, Yuanyuan Pan, Jingrou Dai, Zihui Liu, Mingbo Wu*, Han Hu*, Jing Lu*, J. Mater. Sci. 55, 11439–11450 (2020).

15.     Device performance limits and negative capacitance of monolayer GeSe and GeTe tunneling field effect transistors, Peipei Xu, Jiakun Liang, Hong Li*, Fengbin Liu, Jun Tie, Zhiwei Jiao, Jing Luo, Jing Lu*, Rsc Adv. 10, 16071-16078 (2020).

16.     Two-dimensional single-layer PC₆ as promising anode materials for Li-ion batteries: The first-principles calculations study, Jianning Zhang, Lianqiang Xu, Chen Yang, Xiuying Zhang, Ling Ma*, Min Zhang, Jing Lu*, Appl. Surf. Sci. 510, 145493 (2020).

17.     Ultrahigh Capacity of Monolayer Dumbbell C₄N as a Promising Anode Material for Lithium-Ion Battery, Chen Yang, Xiuying Zhang, Jiachen Ma, Bowen Shi, Han Zhang, Linqiang Xu, Jie Yang, Shiqi Liu, Ruge Quhe, Feng Pan, Jing Lu*, Dapeng Yu, J. Electrochem. Soc. 167, 020538 (2020).

18.     Planar Direction-Dependent Interfacial Properties in Monolayer In₂Se₃-Metal Contacts, Chen Yang, Xiuying Zhang, Xiaotian Sun, Han Zhang, Hao Tang, Bowen Shi, Hua Pang, Linqiang Xu, Shiqi Liu, Jie Yang, Jiahuan Yan, Lin Xu, Zhiyong Zhang, Jinbo Yang, Dapeng Yu, Jing Lu*, Phys. Status Solidi B: Basic Solid State Physics 257, 1900198 (2020).

19.     Imprinting Ferromagnetism and Superconductivity in Single Atomic Layers of Molecular Superlattices, Zejun Li†, Xiuying Zhang†, Xiaoxu Zhao, Jing Li, Tun Seng Herng, Haomin Xu, Fanrong Lin, Pin Lyu, Xinnan Peng, Wei Yu, Xiao Hai, Cheng Chen, Huimin Yang, Jens Martin, Jing Lu, Xin Luo, A. H. Castro Neto, Stephen J. Pennycook, Jun Ding, Yuanping Feng, Jiong Lu*, Adv. Mater. 1907645 (2020).

20.     Designing sub-10-nm Metal-Oxide-Semiconductor Field-Effect Transistors via Ballistic Transport and Disparate Effective Mass: The Case of Two-Dimensional BiN, Wenhan Zhou, Shengli Zhang*, Shiying Guo, Yangyang Wang, Jing Lu, Xing Ming, Zhi Li, Hengze Qu, Haibo Zeng*, Phys. Rev. Appl. 13, 044066 (2020).

2019

21.     High-performance sub-10 nm monolayer Bi₂O₂Se transistors, Ruge Quhe*, Junchen Liu, Jinxiong Wu, Jie Yang, Yangyang Wang, Qiuhui Li, Tianran Li, Ying Guo, Jinbo Yang, Hailin Peng, Ming Lei* and Jing Lu*, Nanoscale, 11, 532-540 (2019). ESI Highly Cited Paper

22.     A sub-10 nm monolayer ReS₂ transistor for low-power applications, Ruge Quhe*, Jianxiu Chen and Jing Lu*, J. Mater. Chem. C, 7. 1604 (2019).

23.     Pervasive Ohmic Contacts in Bilayer Bi₂O₂Se-Metal Interfaces, Xu, Lianqiang; Liu, Shiqi; Yang, Jie; Shi, Bowen; Pan, Yuanyuan; Zhang, Xiuying; Li, Hong; Yan, Jiahuan; Li, Jingzhen; Xu, Linqiang; Yang, Jinbo; Lu, Jing*，J. Phys. Chem C 123(14), 8923-8931 (2019).

24.     Sub 10 nm Bilayer Bi₂O₂Se Transistors. Jie Yang, Ruge Quhe, Qiuhui Li, Shiqi Liu, Lianqiang Xu, Yuanyuan Pan, Han Zhang, Xiuying Zhang, Jingzhen Li, Jiahuan Yan, Bowen Shi, Hua Pang, Lin Xu, Zhiyong Zhang, Jing Lu* and Jinbo Yang*, Adv. Electron. Mater. 5, 1800720 (2019).

25.     Unusual Fermi‐Level Pinning and Ohmic Contact at Monolayer Bi₂O₂Se–Metal Interface, Shiqi Liu, Lianqiang Xu, Yuanyuan Pan, Jie Yang, Jingzhen Li, Xiuying Zhang, Lin Xu, Hua Pang, Jiahuan Yan, Bowen Shi, Xiaotian Sun, Han Zhang, Linqiang Xu, Jinbo Yang, Zhiyong Zhang, Feng Pan* and Jing Lu*, Adv. Theory Simul. 2, 1800178 (2019).

26.     Schottky Contact in Monolayer WS₂ Field‐Effect Transistors, Hao Tang, Bowen Shi, Yuanyuan Pan, Jingzhen Li, Xiuying Zhang,  Jiahuan Yan, Shiqi Liu, Jie Yang, Lianqiang Xu, Jinbo Yang, Mingbo Wu and Jing Lu*, Adv. Theory Simul. 2, 1900001 (2019).

27.     Sub-10 nm vertical tunneling transistors based on layered black phosphorene homojunction, Hong Li*, Jing Lu*, Applied Surface Science, 465 (28) 895-901 (2019).

28.     Sub-10 nm Tunneling Field Effect Transistors Based on Monolayer Group-IV Mono-Chalcogenides, Hong Li*, Peipei Xu, and Jing Lu*, Nanoscale 11, 23392 (2019).

29.     Excellent Device Performance of Sub-5-nm Monolayer Tellurene Transistors, Jiahuan Yan, Hua Pang, Lin Xu, Jie Yang, Ruge Quhe, Xiuying Zhang, Yuanyuan Pan, Bowen Shi, Shiqi Liu, Lianqiang Xu, Jinbo Yang, Feng Pan, Zhiyong Zhang, and Jing Lu*, Adv. Electron. Mater. 5, 1900226 (2019).

30.     Directly imaging the structure–property correlation of perovskites in crystalline microwires, Xiao-Wei Zhang, Zhen-Qian Yang, Jing-Zhen Li, Yu-Hao Deng, Yu-Min Hou, Yi-Fei Mao, Jing Lu*, and Ren-Min Ma*, J. Mater. Chem. A 7(21), 13305-13314 (2019).

31.     Monolayer GaS with high ion mobility and capacity as a promising anode battery material, Xiuying Zhang, Chen Yang, Yuanyuan Pan, Mouyi Weng, Linqiang Xu, Shiqi Liu, Jie Yang, Jiahuan Yan, Jingzhen Li, Bowen Shi, Jinbo Yang, Jiaxin Zheng, Feng Pan, and Jing Lu*, J. Mater. Chem. A, 7, 14042–14050 (2019).

32.     Sub‑5 nm Monolayer BiH Transistors, Meng Ye, Shiqi Liu, Han Zhang, Bowen Shi, Jingzhen Li, Xiuying Zhang, Jiahuan Yan, and Jing Lu*, ACS Appl. Elec. Mater. 1, 2103 (2019). 

33.     Computational Study of Ohmic Contact at Bilayer InSe-Metal Interfaces: Implications for Field-Effect Transistors, Lin Xu, Yuanyuan Pan, Shiqi Liu, Bowen Shi, Jie Yang, Jiahuan Yan, Hua Pang, Xiuying Zhang, Chen Yang, Jinbo Yang, Yangyang Wang, Zhiyong Zhang*, and Jing Lu*, ACS Appl. Nano mater. 2, 6898 (2019).

34.     Reexamination of the Schottky Barrier Heights in Monolayer MoS2 Field Effect Transistors, Yuanyuan Pan, Jihuan Gu, Hao Tang, Xiuying Zhang, Jingzhen Li, Bowen Shi, Jie Yang, Han Zhang, Jiahuan Yan, Shiqi Liu, Han Hu, Mingbo Wu, Jing Lu*, ACS Appl. Nano mater. 2, 4717 (2019).

35.     Adsorption and Diffusion of Lithium on Layered InSe, Xiuying Zhang, Sibai Li, Jingzhen Li, Meng Ye, Zhigang Song, Shan Jin, Bowen Shi, Yangyang Wang*, Jiaxin Zheng*, Feng Pan*, Jing Lu*, Comp. Condense Matter 21, e00404 (2019).

36.     Bilayer tellurene-metal interfaces, Hua Pang, Jiahuan Yan, Jie Yang, Shiqi Liu, Yuanyuan Pan, Xiuying Zhang, Jinbo Yang, Qihang Liu, Lianqiang Xu, Yangyang Wang, and Jing Lu*, Journal of Semiconductors 40(6), 062003-062003-10 (2019).

37.     Interfacial properties of monolayer antimonene devices, Han Zhang, Junhua Xiong, Meng Ye, Jingzhen Li, Xiuying Zhang, Ruge Quhe, Zhigang Song, Jinbo Yang, Qiaoxuan Zhang, Bowen Shi, Jiahuan Yan, Wanlin Guo, John Robertson, Yangyang Wang*, Feng Pan*, Jing Lu*, Phys. Rev. Appl. 11, 064001 (2019).

38.     Negative capacitance tunneling field effect transistors based on monolayer arsenene, antimonene, and bismuthene, Hong Li, Peipei Xu, Lin Xu, Zhiyong Zhang and Jing Lu*, Semicond. Sci. Technol. 34 085006 (2019).

39.     Anisotropic interfacial properties of monolayer GeSe—metal contacts, Ying Guo, Feng Pan, Yajie Ren, Yangyang Wang, Binbin Yao, Gaoyang Zhao and Jing Lu*, Semicond. Sci. Technol. 34, 095021 (2019).

40.     Nitrofullerene, a C60-based Bifunctional Additive with Smoothing and Protecting Effects for Stable Lithium Metal Anode, Zhipeng Jiang, Ziqi Zeng, Chengkai Yang, Zhilong Han, Wei Hu, Jing Lu and Jia Xie, Nano Lett. 19, 8780 (2019).

41.     Dendrite-Free Lithium Deposition via a Superfilling Mechanism for High-Performance Li-Metal Batteries, Qian Wang, Chengkai Yang, Jijin Yang, Kai Wu, Cejun Hu, Jing Lu, Wen Liu, Xiaoming Sun, Jingyi Qiu, and Henghui Zhou, Adv. Mater. 31, 1903248 (2019).

42.     Surface-Based Li+ Complex Enables Uniform Lithium Deposition for Stable Lithium Metal Anodes, Qian Wang, Chengkai Yang, Yufei Zhang, JiJin Yang, Kai Wu, Cejun Hu, Jing Lu, Wen Liu and Henghui Zhou, ACS Appl. Energy Mater. 2, 4602−4608 (2019).

43.     Tracking sodium migration in TiS2 using in situ TEM, Bo Han, Shulin Chen, Jian Zou, Ruiwen Shao, Zhipeng Dou, Chen Yang, Xiumei Ma, Jing Lu, Kaihui Liu, Dapeng YuLiping Wang, Haicheng Wang* and Peng Gao, Nanoscale, 11, 7474 (2019).

44.     Graphene Acoustic Phonon-Mediated Pseudo-Landau Levels Tailoring Probed by Scanning Tunneling Spectroscopy, Cheng Chi, Bowen Shi, Cong Liu, Yimin Kang, Li Lin, Meiling Jiang, Jing Lu, Bo Shen, Feng Lin, Hailin Peng, Zheyu Fang, Small 1905202 (2019).

2018

45.     Spontaneous valley splitting and valley pseudospin field effect transistors of monolayer VAgP₂Se₆，Zhigang Song, Xiaotian Sun, Jiaxin Zheng, Feng Pan, Yanglong Hou, Man-Hong Yung, Jinbo Yang* and Jing Lu*, Nanoscale, 10. 13986 (2018)

46.     N-type Ohmic contact and p-type Schottky contact of monolayer InSe transistors, Bowen Shi, Yangyang Wang, Jingzhen Li, Xiuying Zhang, Jiahuan Yan, Shiqi Liu, Jie Yang, Yuanyuan Pan, Han Zhang, Jinbo Yang, Feng Pan* and Jing Lu*, Phys. Chem. Chem. Phys., 20(38), 24641-24651 (2018).

47.     Sub-5 nm monolayer black phosphorene tunneling transistors, Hong Li*, Bowen Shi, Yuanyuan Pan, Jingzhen Li, Lin Xu, Lianqiang Xu, Zhiyong Zhang, Feng Pan and Jing Lu*, Nanotechnology, 29, 485202 (2018).

48.     N- and p-Type Ohmic Contacts at Monolayer Gallium Nitride-Metal Interfaces, Ying Guo, Feng Pan, Yajie Ren, Binbin Yao, Chuanghua Yang, Meng Ye, Yang Yang Wang, Jingzhen Li, Xiuying zhang, Jiahuan Yan, Jin-Bo Yang and Jing Lu*, Phys. Chem. Chem. Phys., 20(37), 24239-24249 (2018).

49.     Dependence of excited-state properties of tellurium on dimensionality: From bulk to two dimensions to one dimensions, Yuanyuan Pan, Shiyuan Gao, Li Yang*, and Jing Lu*, Phys. Rev. B 98, 085135 (2018).

50.     Simulations of Quantum Transport in Sub-5-nm Monolayer Phosphorene Transistors, Ruge Quhe, Qiuhui Li, Qiaoxuan Zhang, Yangyang Wang, Han Zhang, Jingzhen Li, Xiuying Zhang, Dongxue Chen, Kaihui Liu, Yu Ye, Lun Dai, Feng Pan, Ming Lei, and Jing Lu*, Phys. Rev. Appl. 10(2), 024022 (2018). 

51.     Sub-5 nm Monolayer Arsenene and Antimonene Transistors, Xiaotian Sun, Zhigang Song, Yangyang Wang, Youyong Li, Weizhou Wang, Jing Lu*, ACS: Applied Materials & Interfaces, 10(26), 22363 (2018).

52.     Many-body Effect and Device Performance Limit of Monolayer InSe, Yangyang Wang, Ruixiang Fei, Ruge Quhe, Jingzhen Li, Han Zhang, Xiuying Zhang, Bowen Shi, Lin Xiao, Zhigang Song, Jinbo Yang, Jun-jie Shi, Feng Pan*, and Jing Lu*, ACS Applied Materials & Interfaces, 10(27), 23344 (2018).

53.     Monolayer Tellurene—Metal Contacts, Jiahuan Yan †, Xiuying Zhang †, Yuanyuan Pan, Jingzhen Li, Bowen Shi, Shiqi Liu, Jie Yang, Zhigang Song, Han Zhang, Meng Ye, Ruge Quhe, Yangyang Wang, Jinbo Yang, Feng Pan* and Jing Lu*, Journal of Materials Chemistry C, 6, 6153-6163 (2018).

54.     Gate-tunable interfacial properties of in-plane ML MX₂ 1T’–2H heterojunctions, Shiqi Liu†, Jingzhen Li †, Bowen Shi, Xiuying Zhang, Yuanyuan Pan, Meng Ye, Ruge Quhe, Yangyang Wang, Han Zhang, Jiahuan Yan, Linqiang Xu, Ying Guo, Feng Pan* and Jing Lu*, Journal of Materials Chemistry C, 6, 5651 (2018).

55.     Ohmic contacts between monolayer WSe₂ and two-dimensional titanium carbides, Qiuhui Li†, Jie Yang†, Ruge Quhe*, Qiaoxuan Zhang, Lin Xu, Yuanyuan Pan, Ming Lei*, and Jing Lu*, Carbon, 135, 125 (2018).

56.     Three layer Phosphorene—Metal Interfaces, Xiuying Zhang†, Yuanyuan Pan†, Meng Ye, Ruge Quhe, Yangyang Wang, Ying Guo, Han Zhang, Yang Dan, Zhigang Song, Jinbo Yang Wanlin Guo, and Jing Lu*, Nano Research, 11, 707 (2018).

57.     Electrical Contacts in Monolayer Blue Phosphorene Devices, Jingzhen Li,† Xiaotian Sun,† Chengyong Xu, † Xiuying Zhang, Yuanyuan Pan, Meng Ye, Zhigang Song, Ruge Quhe, Yangyang Wang, Han Zhang, Ying Guo, Jinbo Yang, Feng Pan* and Jing Lu*, Nano Research, 11, 1834 (2018).

58.     High-performance sub-10 nm monolayer black phosphorene tunneling transistors, Hong Li*, Jun Tie, Jingzhen Li, Meng Ye, Han Zhang, Xiuying Zhang, Yuanyuan Pan, Yangyang Wang, Ruge Quhe, Feng Pan*, and Jing Lu*, Nano Research, 11, 2658 (2018).

59.     Interfacial Properties of Monolayer SnS-Metal Contacts, Sibai Li†, Weiji Xiao†, Yuanyuan Pan†, Jianshu Jie, Chao Xin, Jiaxin Zheng*, Jing Lu*, and Feng Pan*, Journal of Physical Chemistry C, 122(23),12322 (2018).

60.     Epitaxial Single-Layer MoS₂ on GaN with Enhanced Valley Helicity, Yi Wan, Jun Xiao, Jingzhen Li, Xin Fang, Kun Zhang, Lei Fu, Pan Li, Zhigang Song, Hui Zhang, Yilun Wang, Mervin Zhao, Jing Lu, Ning Tang, Guangzhao Ran, Xiang Zhang, Yu Ye* and Lun Dai*, Advanced Materials, 30, 1703888 (2018).

61.     Direct Observation of Semiconductor−Metal Phase Transition in Bilayer Tungsten Diselenide Induced by Potassium Surface Functionalization, Bo Lei†, Yuanyuan Pan†, Zehua Hu†, Jialin Zhang, Du Xiang, Yue Zheng, Rui Guo, Cheng Han, Lianhui Wang, Jing Lu, Li Yang*, and Wei Chen*, ACS Nano, 12, 2070 (2018).

62.     Enhancement of Photoluminescence and Hole Mobility in 1- to 5-Layer InSe due to the Top Valence-Band Inversion: Strain Effect, Meng Wu, Jun-jie Shi, Min Zhang, Pu Hang, Yi-min Ding, Hui Wang, Yu-lang Cen, Shu-hang Pan, Jing Lu, and Congxin Xia, Nanoscale, 10(24), 11441 (2018).

63.     SnO₂ quantum dots @ 3D sulfur-doped reduced graphene oxides as active and durable anode for lithium ion batteries, Kai Wu, Bowen Shi, Liya Qi, Yingying Mi, Binglu Zhao, Chengkai Yang, Qian Wang, Hui Tang, Jing Lu, Wen Liu*, Henghui Zhou*, Electrochim. Acta, 291, 24-30 (2018).

2017

64.     Valley Pseudospin with a Widely Tunable Bandgap in Doped Honeycomb BN Monolayer, Zhigang Song, Ziwei Li, Hong Wang. Xuedong Bai, Wenlong Wang, Honglin Du, Sunquan Liu, Changsheng Wang, Jingzhi Han, Yingchang Yang, Zheng Liu, Jing Lu*, Zheyu Fang*, and Jinbo Yang*, Nano Letters 17, 2079 (2017).

65.     Many-body Effect, Carrier Mobility, and Device Performance of Hexagonal Arsenene and Antimonene, Yangyang Wang, Pu Huang, Meng Ye, Ruge Quhe, Yuanyuan Pan, Han Zhang, Hongxia Zhong, Junjie Shi*, Jing Lu*, Chemistry of Materials 29, 2191 (2017).

66.     Can a Black Phosphorus Schottky Barrier Transistor Be Good Enough? Ruge Quhe*, Xiyou Peng, Yuanyuan Pan, Meng Ye, Yangyang Wang, Han Zhang, Shenyan Feng, Qiaoxuan Zhang, Junjie Shi, Jinbo Yang, Dapeng Yu, Ming Lei*, and Jing Lu*, ACS: Applied Materials & Interfaces 9, 3959-3966 (2017).

67.     Schottky Barriers in Bilayer Phosphorene Transistors, Yuanyuan Pan†, Yang Dan†, Yangyang Wang*, Meng Ye, Han Zhang, Ruge Quhe, Xiuying Zhang, Jingzhen Li, Wanlin Guo, Li Yang, and Jing Lu*, ACS: Applied Materials & Interfaces 9, 12694 (2017).

68.     Monolayer Bismuthene-Metal Contacts：a Theoretical Study, Ying Guo*, Feng Pan, Meng Ye, Xiaotian Sun, Yangyang Wang*, Jingzhen Li, Xiuying Zhang, Han Zhang, Yuanyuan Pan, Zhigang Song, Jinbo Yang, Jing Lu*, ACS: Applied Materials & Interfaces 9, 2318, 2017.

69.     Electrical Contacts in Monolayer Arsenene Devices, Yangyang Wang, * Meng Ye, † Mouyi Weng, Jingzhen Li, Xiuying Zhang, Han Zhang, Ying Guo, Yuanyuan Pan, Lin Xiao, Junku Liu, Feng Pan,* and Jing Lu*, ACS: Applied Materials & Interfaces 9, 2927, 2017.

70.     Black Phosphorus Transistors with van der Waals–type Electrical Contacts, Ruge Quhe, Yangyang Wang, Meng Ye, Qiaoxuan Zhang, Jie Yang, Ming Lei* and Jing Lu*, Nanoscale 9, 14047 (2017).

71.     Interfacial properties of borophene contacts with two-dimensional semiconductors, Jie Yang, Ruge Quhe*, Shenyan Feng, Zhang, Qiaoxuan Zhang, Ming Lei*, Jing Lu*, Phys Chem Chem Phys. 19, 23982 (2017).

72.     A Computational Study of Monolayer 2H WTe₂ - Metal Interfaces, Chol So†, Han Zhang†, Yangyang Wang, † Meng Ye, Yuanyuan Pan, Ruge Quhe, JingZhen Li, Xiuying Zhang, Yunsong Zhou, Jing Lu*, Phys. Status Solidi B, 1600837 (2017).

73.     Electronic properties of layered phosphorus heterostructures, Ruge Quhe,   Shenyan Feng,   Jing Lu and   Ming Lei*, Phys Chem Chem Phys. 19, 1229（2017).

74.     Electronic and Magnetic Properties Tuning of Armchair BC2N Nanoribbons by Edge Modification, Xiang Xiao, Jing Lu, Tun Tie, Hong Li*, Solid State Communications 257, 27 (2017).

75.     Half metallicity in bare BC2N Nanoribbons with zigzag edges, Xiang Xiao, Jing Lu, Tun Tie, Hong Li*, Physics Letters A 381, 1820 (2017).

76.      Electronic and Magnetic Properties of Bare Armchair BC2N Nanoribbons, Xiang Xiao, Jun Tie, Jing Lu, Hong Li*, Journal of Magnetism and Magnetic Materials 426, 641 (2017).

2016

77.     Rise of Silicene: a Competitive 2D Material, Progress in Materials Science, Jijun Zhao^*, Hongsheng Liu, Zhiming Yu, Ruge Quhe, Si Zhou, Yangyang Wang, ChengCheng Liu, Hongxia Zhong, Nannan Han, Jing Lu^*, Yugui Yao^*, Kehui Wu^* ,  Progress in Materials Science 83，24 (2016) (invited review). ESI Hot Paper, Highly Cited Paper

78.     Monolayer Phosphorene Metal Contacts, Yuanyuan Pan, Yangyang Wang, Meng Ye, Ruge Quhe, Hongxia Zhong, Zhigang Song, Xiyou Peng, Dapeng Yu, Jinbo Yang, Junjie Shi, and Jing Lu*, Chemistry of Materials 28, 2100 (2016). ESI Highly Cited Paper

79.     Does P-type Ohmic Contact Exist in WSe₂-metal Interfaces? Yangyang Wang, RuoXi Yang, Ruge Quhe, Hongxia Zhong, Linxiao Cong, Meng Ye, Zeyuan Ni, Zhigang Song, Jinbo Yang, Junjie Shi, Ju Li, and Jing Lu^*, Nanoscale 8, 1179 (2016). Highly Cited Paper

80.     Interfacial Properties of Monolayer and Bilayer MoS₂ Contacts with Metals: Beyond the Energy Band Calculations, Hongxia Zhong, # Ruge Quhe, # Yangyang Wang Zeyuan Ni, Meng Ye, Zhigang Song, Yuanyuan Pan, Jinbo Yang, Li Yang, Lei Ming, Junjie Shi* and Jing Lu*, Scientific Reports 6, 21786 (2016).  Highly Cited Paper

81.     Magnetoresistance in Co/2D MoS2/Co and Ni/2D MoS2/Ni junctions, Han Zhang, Meng Ye, Yangyang Wang, Ruge Quhe, Yuanyuan Pan, Ying Guo, Zhigang Song, Jinbo Yang, Wanlin Guo, and Jing Lu*, Phys. Chem. Chem. Phys. 18, 16367 (2016).

82.     Interfacial Properties of Monolayer MoSe₂-Metal contacts, Yuanyuan Pan, Sibai Li, Meng Ye, Ruge Quhe, Zhigang Song, Yangyang Wang, Jiaxin Zheng, Feng Pan, Jinbo Yang, and Jing Lu*, J. Phys. Chem. C 120，13063（2016）.

83.     Does the Dirac Cone of Germanene Exist on Metal Substrates? Yangyang Wang, Jingzhen Li, Junhua Xiong, Yuanyuan Pan, Meng Ye, Ying Guo, Han Zhang, Ruge Quhe*, Jing Lu*, Phys. Chem. Chem. Phys. 18, 19451 (2016).

84.     Performance Upper Limit of Sub-10 nm Monolayer MoS₂ Transistors, Zeyuan Ni, Meng Ye, Jianhua Ma, Yangyang Wang, Ruge Quhe, Jiaxin Zheng, Lun Dai, Dapeng Yu, Junjie Shi, Jinbo Yang, Satoshi Watanabe, and Jing Lu*, Advanced Electronic Materials 1600191 (2016).

85.     Interfacial Properties of Stanene-Metal Contacts, Ying Guo, Feng Pan, Meng Ye, Yangyang Wang, Yuanyuan Pan, Xiuying Zhang, Jingzhen Li, Han Zhang, Jing Lu*, 2D Materials 3, 035020 (2016).

86.     Anomalous Light Emission and Wide Photoluminescence Spectra in Graphene Quantum Dot: Quantum Confinement from Edge Microstructure, Pu Huang, Jun-jie Shi*, Min Zhang, Xin-he Jiang, Hong-xia Zhong, Yi-min Ding, Xiong Cao, Meng Wu, and Jing Lu, J. Phys. Chem. Lett. 7, 2888 (2016).

87.     Effect of edge modification on the zigzag BC₂N nanoribbons, Xiang Xiao, Hong Li, Jun Tie, Jing Lu, Chem. Phys. Lett. 658, 234 (2016).

88.     Origin of the wide band gap from 0.6 to 2.3 eV in photovoltaic material InN: quantum confinement from surface nanostructure, Pu Huang, Jun-jie Shi*, Ping Wang, Min Zhang, Yi-min Ding, Meng Wu, Jing Lu and Xin-qiang Wang, J. Mater. Chem. A 4, 17412 (2016).

89.     Insights into the inner structure of high-nickel agglomerate as high-performance lithium-ions cathods, Cheng-Kai Yang, Li-Ya Qi, Zicheng Zuo, Ru-Na Wang, Meng Ye, Jing Lu, Heng-Hui Zhou*, Journal of Power Sources 331, 487 (2016).

90.     Few-Layer Fe-3(PO₄)(2).8H(2)O: Novel H-Bonded 2D Material and Its Abnormal Electronic Properties,  Sibai Li, Ruge Quhe, Mouyi Weng, Yancong Feng,  Yunxing Zuo, Weiji Xiao, Jiaxin Zheng*, Jing Lu, Feng Pan*, J. Phys. Chem. C. 120, 26278 (2016).

2015

91.     Tunable Valley Polarization and Valley Orbital Magnetic Moment Hall Effect in Honeycomb Systems with Broken Inversion Symmetry, Zhigang Song, Ruge Quhe, Shunquan Liu，Yan Li, Ji Feng，YingchangYang, Jing Lu^*, Jinbo Yang^*, Scientific Reports 5:13906 (2015); DOI: 10.1038/srep13906 (2015).

92.     Silicene Spintronics, Yangyang Wang, Ruge Quhe, Dapeng Yu, and Jing Lu^*, Chinese Physics B 24, 087201 (2015) (invited review).

93.     Silicene Transistors, Ruge Quhe, Yangyang Wang, and Jing Lu^*, Chinese Physics B 24, 088105 (2015) (invited review).

94.     Silicene on substrates: A theoretical perspective, HongXia Zhong, RuGe Quhe, YangYang Wang, JunJie Shi, Jing Lu^*, Chinese Physics B 24, 087308 (2015) (invited review).

95.     Graphdiyne-metal contacts and graphdiyne transistors, Yuanyuan Pan, Yangyang Wang, Lu Wang, Hongxia Zhong, Ruge Quhe, Zeyuan Ni, Meng Ye, Wai-Ning Mei, Junjie Shi, Wanlin Guo, Jinbo Yang ^*, Jing Lu^*, Nanoscale 7, 2116 (2015).

96.     Silicene nanomesh, Fen Pan, Yangyang Wang, Kaili Jiang, Zeyuan Ni, Jianhua Ma, Jianxin Zheng, Ruge Quhe, Junjie Shi, Jinbo Yang, Changle Chen, Jing Lu^*, Scientific Reports 5, 9075 (2015).

97.     All-metallic Vertical Transistors Based on Stacked Dirac Materials, Yangyang Wang, Zeyuan Ni, Qihang Liu, Ruge Quhe, Jiaxin Zheng, Meng Ye, Dapeng Yu, Junjie Shi, Jinbo Yang, Ju Li, and Jing Lu^*, Advanced Functional Materials, 25, 68 (2015).    

98.     Origin of 3.45 eV Emission Line and Yellow Luminescence Band in GaN Nanowires: Surface Micro-Wire and Defect, Pu Huang, Hua Zong, Jun-jie Shi, Min Zhang, Xin-he Jiang, Hong-xia Zhong, Yi-min Ding, Ying-ping He, Jing Lu, and Xiao-dong Hu, Acs Nano 9, 9276 (2015).

99.     Modeling of stacked 2D materials and devices, Xiaofeng Qian, Yangyang Wang, Wenbin Li, Jing Lu, and Ju Li, 2D Materials 2, 032003(2015).   

100.  Electronic Properties of Halogen-Adsorbed Graphene, Chengyong Xu, Paul A. Brown, Jing Lu, Kevin L Shuford, J. Phys. Chem. C. 119, 17271 (2015). 

101.  Phase formations and magnetic properties of single crystal nickel ferrite IJNiFe2O4 with different morphologies, Aixian Shan, ab Xue Wu, Jing Lu, Chinping Chen* and Rongming Wang, CrystEngComn 17, 1603 (2015).

2014

102.  Quantum spin Hall insulators and quantum valley Hall insulators of BiX/SbX (X = H, F, Cl, and Br) monolayers with a record bulk band gap, Zhigang Song, Cheng-Cheng Liu, Jinbo Yang*, Jingzhi Han, Meng Ye, Botao Fu, Yingchang Yang, Qian Niu, Jing Lu* & Yugui Yao *, NPG Asia Materials 6, e147 (2014). Highly Cited Paper

103.  Does the Dirac Cone Exist in Silicene on Metal Substrates? Ruge Quhe, Yakun Yuan, Jiaxin Zheng, Yangyang Wang, Zeyuan Ni, Junjie Shi, Dapeng Yu, Jinbo Yang*, Jing Lu*, Scientific Reports 4, 5476 (2014).

104.  Tunable Band Gap and Doping Type in Silicene by Surface Adsorption: towards Tunneling Transistors, Zeyuan Ni, Hongxia Zhong, Xinhe Jiang, Ruge Quhe, Guangfu Luo, Yangyang Wang, Meng Ye, Jinbo Yang,* Junjie Shi,* and Jing Lu*, Nanoscale 6, 7609 (2014).

105.  Gate-induced half-metallicity in semihydrogenated silicene, Feng Pan, Ruge Quhe, Qi Ge, Jiaxin Zheng, Zeyuan Ni, Yangyang Wang, Zhengxiang Gao, Lu Wang, and Jing Lu*, Physica E 56, 43(2014).

106.  Strong Band Hybridization between Silicene and Ag (111) Substrate, Yakun Yuan, Ruge Quhe, Jiaxin Zheng, Yangyang Wang, Zeyuan Ni, Junjie Shi, and Jing Lu*, Physica E 58, 38 (2014).

107.  Tunable band gap in germanene by surface adsorption, Meng Ye, Ruge Quhe, Jiaxin Zheng, Zeyuan Ni, Yangyang Wang, Yakun Yuan, H. Y. Geoffrey Tse, Junjie Shi, Zhengxiang Gao, and Jing Lu*, Physica E 59, 60(2014).

108.  Evidence of Type-II Band Alignment in III-nitride Semiconductors: Experimental and theoretical investigation for In_0.17Al_0.83N/GaN heterostructures, by Jiaming Wang, Fujun Xu, Xia Zhang, Wei An, Xin-Zheng Li, Jie Song, Weikun Ge, Guangshan Tian, Jing Lu, Xinqiang Wang, Ning Tang, Zhijian Yang, Wei Li, Weiying Wang, Peng Jin, Yonghai Chen, and Bo Shen, Scientific Reports 4, 6521(2014).

109.  Photochemical Behavior of Single-Walled Carbon Nanotubes in the Presence of  Propylamine，Yutaka Maeda,* Yuhei Hasuike, Kei Ohkubo, Atsushi Tashiro, Shinya Kaneko, Masayuki Kikuta, Michio Yamada, Tadashi Hasegawa, Takeshi Akasaka，Jing Zhou, Jing Lu, Shigeru Nagase,and Shunichi Fukuzumi，CHEMPHYSCHEM 15, 1821(2014).

110.  First-principle calculation and assignment for vibrational spectra of Ba(Mg1/3Nb2/3)O₃ microwave dielectric ceramic, Chuan-Ling Diao, Chun-Hai Wang, Neng-Neng Luo, Ze-Ming Qi, Tao Shao, Yu-Yin Wang, Jing Lu, Quan-Chao Wang, Xiao-Jun Kuang, Liang Fang, Feng Shi, and Xi-Ping Jing, J. Appl. Phys. 115, 114103 (2014).

111.  Band edge modulation and interband optical transition in AlN: MgAl-ON nanotubes, Huang, Pu; Shi, Jun-Jie; Zhang, Min; Jiang, Xin-he; Zhong, Hong-xia; Ding, Yi-min; Lu, Jing; Wang, Xihua, Materials Research Express 1, 025030 (2014).

112.  Enhancement of TE polarized light extraction efficiency in nanoscale (AlN)(m)/(GaN)(n) (m>n) superlattice substitution for Al-rich AlGaN disorder alloy: ultra-thin GaN layer modulation, X Jiang, J Shi, M Zhang, H Zhong, P Hang, Y Ding, T Yu, B Shen, Jing Lu, X Wang, New J　Phys 16, 113065 (2014).

2013

113.  Interfacial Properties of Bilayer and Trilayer Graphene on Metal Substrates, Jiaxin Zheng, Yangyang Wang, Lu Wang, Ruge Quhe, Zeyuan Ni, Wai-Ning Mei, Zhengxiang Gao, Dapeng Yu, Junjie Shi, and Jing Lu*, Scientific Reports 3, 2081 (2013).

114.  Tunable band gap in few-layer graphene by surface adsorption, Ruge Quhe, Jianhua Ma, Zesheng Zeng, Kechao Tang, Jiaxin Zheng, Yangyang Wang, Zeyuan Ni, Lu Wang, Zhengxiang Gao, Junjie Shi, and Jing Lu*, Scientific Reports 3, 1794 (2013).

115.  Sub-10 nm Gate Length Graphene Transistors: Operating at Terahertz Frequencies with Current Saturation, Jiaxin Zheng, Lu Wang, Ruge Quhe, Qihang Liu, Hong Li, Dapeng Yu, Wai-Ning Mei, Junjie Shi, Zhengxiang Gao, and Jing Lu*, Scientific Reports, 3, 1314 (2013).

116.  Sign-Changeable Spin-filter Efficiency in Linear Carbon Atomic Chain, Jiaxin Zheng, Chengyong Xu, Lu Wang, Qiye Zheng, Hong Li, Qihang Liu, Ruge Quhe, Zhengxiang Gao, Junjie Shi, and Jing Lu*, Physica E 48, 101 (2013).

117.  Enhanced many-body effects in one-dimensional linear atomic chains, Ruixiang Fei, Guangfu Luo, Yangyang Wang, Zhengxiang Gao, Shigeru Nagase, Dapeng Yu, and Jing Lu*, Phys. Status Solidi B 250, 8, 1636 (2013).

118.  Structural, Electronic, and Optical Properties of Bulk Graphdiyne, Guangfu Luo, Qiye Zheng, Wai-Ning Mei, Jing Lu*, Shigeru, Nagase*, J. Phys. Chem. C 117, 13072 (2013).

119.  Intrinsic Region Length Scaling of Heavily Doped Carbon Nanotube p-i-n Junctions, Zheng Li, Jiaxin Zheng, Zeyuan Ni, Ruge Quhe, Yangyang Wang, Zhengxiang Gao, and Jing Lu*, Nanoscale 6, 6999 (2013).

120.  Helicity Selective Photoreaction of Single-walled Carbon Nanotubes with Organosulfur Compounds in the Presence of Oxygen, Yutaka Maeda* Junki Higo, Yuri Amagai, Jun Matsui, Kei Ohkubo, Yusuke Yoshigoe, Masahiro, Hashimoto, Kazuhiro Eguchi, Michio Yamada, Tadashi Hasegawa, Yoshinori Sato, Jing Zhou, Jing Lu, Tokuji Miyashita, Shunichi Fukuzumi, Tatsuya Murakami, Kazuyuki Tohji, Shigeru Nagase, Takeshi, Akasaka*, J. Am. Chem. Soc. 135, 6356 (2013).

121.  Adsorption configurations of carbon monoxide on gold monolayer supported by graphene or monolayer hexagonal boron nitride: a first-principles study, Jiaxin Zheng, Lu Wang, Khabibulakh Katsiev, Yaroslav Losovyj, Elio Vescovo, D. Wayne Goodman, Peter A. Dowben, Jing Lu and Wai-Ning Mei, Eur. Phys. J. B 86, 441 (2013).

122.  Electronic structures and properties of lanthanide hexaboride nanowires, Lu Wang, Guangfu Luo, Daniel Valencia, Carlos H. Sierra Llavina, R. Sabirianov, Jing Lu, J. Q. Lu, W. N. Mei, C. L. Cheung, J. Appl. Phys. 114, 143709 (2013).

123.  First-Principle Calculation and Assignment for Vibrational Spectra of Ba(Mg1/2W1/2)O3 Microwave Dielectric Ceramic, Chuan-Ling Diao, Chun-Hai Wang, Neng-Neng Luo, Ze-Ming Qi, Tao Shao, Yu-Yin Wang, Jing Lu, Feng Shi, and Xi-Ping Jing, J. Am. Ceram. Soc. 96, 2898 (2013).

2012

124.  Tunable band gap in silicene and germanene, Zeyuan Ni, Qihang Liu, Kechao Tang, Jiaxin Zheng, Jing Zhou, Rui Qin, Zhengxiang Gao, Dapeng Yu, Jing Lu^*, Nano Letters. 12, 113 (2012). ESI Highly Cited Paper

125.  Tunable and Sizable Band Gap of Single Layer Graphene Sandwiched between Hexagonal Boron Nitride, Ruge Quhe, Jiaxin Zheng, Guangfu Luo, Qihang Liu, Rui Qin, Jing Zhou, Dapeng Yu, Shigeru Nagase, Wai-Ning Mei, Zhengxiang Gao, and Jing Lu*, NPG Asia Materials 4, e6 (2012).

126.  Tunable and sizable band gap in silicene by surface adsorption, Ruge Quhe, Ruixiang Fei, Qihang Liu, Jiaxin Zheng, Hong Li, Chengyong Xu, Zeyuan Ni, Yangyang Wang, Dapeng Yu, Zhengxiang Gao, and Jing Lu*, Scientific Reports 2, 853 (2012).

127.  Tunable Charge-transport Property of Ih–C80 Endohedral Metallofullerenes: Investigation of La₂@C₈₀, Sc₃N@C₈₀, and Sc₃C2@C₈₀, Satoru Sato, Shu Seki*, Guangfu Luo, Mitsuaki Suzuki, Jing Lu*, Shigeru Nagase* and Takeshi Akasaka*, J. Am. Chem. Soc. 134, 11681 (2012).

128.  Co–crystal of Paramagnetic Endohedral Metallofullerene La@C₈₂ and Nickel Porphyrin with High Electronic Mobility, Satoru Sato*, Hidefumi Nikawa, Shu Seki, Lu Wang, Guangfu Luo, Jing Lu*, Masayuki Haranaka, Takahiro Tsuchiya, Shigeru Nagase* and Takeshi Akasaka*, Angewandte Chemie 7, 1589 (2012).

129.    Tuning Electronic Structure of Bilayer MoS₂ by Vertical Electric Field: A First-Principles Investigation, Qihang Liu, Linze Li, Yafei Li, Zhengxiang Gao, Zhongfang Chen* and Jing Lu*, J. Phys. Chem. C. 116, 21556 (2012).

130.  Giant magnetoresistance in silicene nanoribbons, Chengyong Xu, Guangfu Luo, Qihang Liu, Jiaxin Zheng, Zhimeng Zhang, Shigeru Nagase, Zhengxiang Gao, and Jing Lu*, Nanoscale 4,3111 (2012).

131.  Structural and Electronic Properties of Bilayer and Trilayer Graphdiyne, Qiye Zheng, Guangfu Luo, Qihang Liu, Ruge Quhe, Jiaxin Zheng, Kechao Tang, Zhengxiang Gao, Shigeru Nagase, and Jing Lu*, Nanoscale 4,3990 (2012).

132.  Electromechanical Switch in Metallic Graphene Nanoribbons via Twisting, Hong Li, Nabil Al-Aqtash, Lu Wang, Rui Qin, Qihang Liu, Wai-Ning Mei, R.F. Sabirianov, Zhengxiang Gao, and Jing Lu*, Physica E 44, 2021 (2012).

133.  High Performance Silicene Nanoribbon Field Effect Transistors with Current Saturation, Hong Li, Lu Wang, Qihang Liu, Jiaxin Zheng, Wai-Ning Mei, Zhengxiang Gao, Junjie Shi, and Jing Lu*, The European Physical Journal B 85, 274 (2012).

134.  Half-Metallic Silicene and Germanene Nanoribbons: towards High-Performance Spintronics Device, Yangyang Wang, Jiaxin Zheng, Zeyuan Ni, Ruixiang Fei, Qihang Liu, Ruge Quhe, Chengyong Xu, Jing Zhou, Zhengxiang Gao, and Jing Lu*, Nano 7, 1250037 (2012).

135.  Electronic and transport properties of a biased multilayer hexagonal boron nitride, Kechao Tang, Zeyuan Ni, Qihang Liu­, Ruge Quhe, Qiye Zheng­, Jiaxin Zheng, Ruixiang Fei, Zhengxiang Gao, and Jing Lu*, The European Physical Journal B 85, 301 (2012).

136.  Electrically Controlled Electron Transfer and Resistance Switching in Graphene Oxide Noncovalently Functionalized with Dye, Benlin Hu, Ruge Quhe, Cao Chen, Fei Zhuge, Xiaojian Zhu, Shanshan Peng, Xinxin Chen, Liang Pan, Yuanzhao Wu, Wenge Zheng, Qing Yan, Jing Lu, and Run-Wei Li*, J. Mater. Chem. 22, 16422 (2012).

137.  Electron Transport through Single Endohedral Ce@C₈₂ Metallofullerenes, Manabu Kiguchi*, Satoshi, Kaneko, Lu Wang, Jing Lu, Shigeru Nagase*, Satoru Sato, Michio Yamada, Zdenek Slanina, Takeshi Akasaka*, Phys. Rev. B, 86, 155406 (2012).

138.  Interaction of single-walled carbon nanotubes with amine, Yutaka Maeda, Michio Yamada, Tadashi, Hasegawa, Takeshi Akasaka, Jing Lu, Shigeru Nagase, Nano 7, 130001 (2012).

2011

139.  Functionalized Graphene for High Performance Two-dimensional Spintronics Devices, Linze Li, Rui Qin, Hong Li, Lili Yu, Qihang Liu, Guangfu Luo, Zhengxiang Gao, and Jing Lu*, ACS NANO 4, 2061 (2011).

140.  Semi-metallic Single-component Crystal of Soluble La@C₈₂ Derivative with High Electron Mobility, Satoru Sato, Shu Seki, Yoshihito Honsho, Guangfu Luo, Lu Wang, Jing Lu, Hidefumi Nikawa, Masayuki Haranaka, Takahiro Tsuchiya, Shigeru Nagase and Takeshi Akasaka*, J. Am. Chem. Soc. 133, 2766 (2011).

141.  Polarized Nonresonant Raman Spectra of Graphene Nanoribbons, Guangfu Luo, Lu Wang, Hong Li, Rui Qin, Jing Zhou, Linze Li, Zhengxiang Gao, Wai-Ning Mei, Jing Lu*, and Shigeru Nagase*, J. Phys. Chem. C. 115, 24463 (2011).

142.  Structure, Electronic, and Transport Properties of Transition Metal Intercalated Graphene and Graphene-Hexagonal-Boron-Nitride Bilayer, Jing Zhou, Lu Wang, Rui Qin, Jiaxin Zheng, Wai Ning Mei, * P. A. Dowben, Shigeru Nagase, Zhengxiang Gao, and Jing Lu*, J. Phys. Chem. C. 114, 15347 (2011).

143.  Tuning Graphene Nanoribbon Field Effect Transistors via Controlling Doping Level, Lu Wang, Jiaxin Zheng, Jing Zhou, Rui Qin, Hong Li, Wai-Ning Mei, Shigeru Nagase, and Jing Lu*, Theoretical Chemistry Accounts 130, 483 (2011).

144.  Sign-changeable spin-filter efficiency and giant magnetoresistance in seamless graphene nanoribbon junctions，Chengyong Xu, Linze Li, Hong Li, Rui Qin, Jiaxin Zheng, Zhengxiang Gao,and Jing Lu*, Comp. Mater. Sci. 50，2886 (2011).

145.  Electric-Field-Induced Energy Gap in Few-Layer Graphene, Kechao Tang, Rui Qin, Jing Zhou, Heruge Qu, Jiaxin Zheng, Ruixiang Fei, Hong Li, Qiye Zheng, Zhengxiang Gao, and Jing Lu*, J. Phys. Chem. C 115, 9458 (2011).

146.  Half Metallicity in BC₂N Nanoribbons: Stability, Electronic Struc-tures, and Magnetism, Lin Lai and Jing Lu*, Nanoscale 3, 2583 (2011).

147.  Negative Differential Resistance in Parallel Single-walled Carbon Nanotube Contacts Qihang Liu, Rui Qin, Jing Zhou, Hong Li, Chengyong Xu, Lin Lai, Guangfu Luo, Jing Lu*, Shimin Hou, Enge Wang, and Zhengxiang Gao, Phys. Rev. B 83, 155442 (2011).

148.  All-Metallic High Performance Field Effect Transistor Based on Telescoping Carbon Nanotubes: An ab Initio Study, Qihang Liu, Lili Yu, Hong Li, Rui Qin, Zhou Jing, Jiaxin Zheng, Zhengxiang Gao, and Jing Lu*, J. Phys. Chem. C 115, 6933 (2011).

149.  Quasiparticle Energies and Excitonic Effects of Graphdiyne: Theory and Experiment, Guangfu Luo, Xuemin Qian, Huibiao Liu, Rui Qin, Jing Zhou, Linze Li, Zhengxiang Gao, Enge Wang, Wai-Ning Mei, Jing Lu*, Yuliang Li* and Shigeru Nagase*, Phys. Rev. B 84，075439 (2011).

150.  Family-Dependent Rectification Characteristics in Ultra-Short Graphene Nanoribbon p-n Junctions, Jiaxin Zheng, Xin Yan, Lili Yu, Hong Li, Rui Qin, Guangfu Luo, Zhengxiang Gao, Dapeng Yu, and Jing Lu*, J. Phys. Chem. C 115, 8547 (2011).

151.  Negative rectification and negative differential resistance in nanoscale single-walled carbon nanotube p-n junctions, Lili Yu, Xin Yan, Hong Li, Rui Qin, Guangfu Luo, Chengyong Xu, Jiaxin Zheng, Qihang Liu, Jing Lu*, Zhengxiang Gao, and Xuefeng Wang, Theoretical Chemistry Accounts 130, 353 (2011).

152.  Structural, Electronic and Magnetic Properties of Ultra-narrow NbSe₂ Nanoribbons, Kai Ji, Lili Yu, Jing Lu*, Hong Li, Guangfu Luo, Jing Zhou, Rui Qin, Qihang Liu, Lin Lai, and Zhengxiang Gao, J. Nanosci Nanotech 11, 2075 (2011). 

153.  Ultra-narrow WS₂ Nanoribbons Encapsulated in Carbon Nanotubes, Zhiyong Wang, Keke Zhao, Hong Li, Zheng Liu, Zujin Shi,* Jing Lu*, Kazu Suenaga,* Soon-Kil Joung, Toshiya Okazaki, Zhaoxia Jin,Zhennan Gu, Zhengxiang Gao, and Sumio Iijima, J Materials Chemistry 21, 171(2011).

154.  Preparation and characterization of transparent and conductive thin films of single-walled carbon nanotubes, Yutaka Maeda, Kazuki Komoriya, Katsuya Sode, Junki Higo, Takayuki Nakamura, Michio Yamada, Tadashi Hasegawa, Takeshi Akasaka*, Takeshi Saito, Jing Lu and Shigeru Nagase, Nanoscale 3, 1904 (2011).

155.  Gd-doping effect on performance of HfO2 based resistive switching memory devices using implantation approach, H. Zhang, L. Liu, B. Gao, Y. Qiu, X. Liu, J. Lu, R.Q. Han, J. Kang, B. Yu, Appl. Phys. Lett. 98, 042105 (2011).

2010

156.  Mixed Low-dimensional Nanomaterial: 2D MoS₂ Inorganic Nanoribbons Encapsulated in Quasi-1D Carbon Nanotubes, Zhiyong Wang, Hong Li, Zheng Liu, Zujin Shi*, Jing Lu*, Kazu Suenaga*, Soon-Kil Joung, Toshiya Okazaki, Zhennan Gu, Jing Zhou, Zhengxiang Gao, Guangping Li, Stefano Sanvito, Enge Wang, and Sumio Iijima, J. Am. Chem. Soc.132, 13840 (2010).

157.  Functionalized Metallic Single-Walled Carbon Nanotubes as High Performance Single-Molecule Organic Field Effect Transistor: an ab Initio study, Hong Li, Xin Yan, Guangfu Luo, Rui Qin, Qihang Liu, Lili Yu, Chengyong Xu, Jiaxin Zheng, Jing Zhou, Jing Lu*, Zhengxiang Gao, Shigeru Nagase, and Wai Ning Mei, J. Phys. Chem. C 114, 15816 (2010)  Highlighted by Nature Asia Materials

158.  Half-Metallic Sandwich Organometallic Molecular Wires with Negative Differential Resistance and Sign-Changeable High Spin-filter Efficiency, Lu Wang, Xingfa Gao, Xin Yan, Jing Lu*, Zhengxiang Gao, Shigeru Nagase* and Stefano Sanvito, J. Phys. Chem. C 114, 21893 (2010).

159.  Structural, Electronic and Transport Properties of Gd/Eu Atomic Chains Encapsulated in Single-walled Carbon Nanotubes, Jing Zhou, Xin Yan, Guangfu Luo, Rui Qin, Hong Li, Jing Lu*, Wai Ning Mei, * and Zhengxiang Gao, J. Phys. Chem. C 114, 15347(2010).

160.  Room-temperature giant magnetoresistance over one billion percent in bare graphene nanoribbon device Rui Qin, Jing Lu*, Lin Lai, Jing Zhou, Hong Li, Qihang Liu, Guangfu Luo, Lina Zhao, Zhengxiang Gao, Wai Ning Mei, and Guangping Li, Phys. Rev. B 81, 233403 (2010).

161.  Electron localization and emission mechanism in wurtzite (Al, In, Ga)N alloys, Qihang Liu, Jing Lu*, Zhengxiang Gao, Lin Lai, Rui Rin, Hong Li, Jing Zhou, Guangping Li, Physica Status Solidi B 247, 109 (2010).

162.  Polarized Vibrational Infrared Absorption of Graphene Nanoribbons, Guangfu Luo, Jing Lu*, Wai-Ning Mei, Lu Wang, Lin Lai, Jing Zhou, Rui Qin, Hong Li, and Zhengxiang Gao, J. Phys. Chem. C 114, 6959 (2010).

163.  Electronic structure and stability of Ultranarrow Single-layer SnS2 Nanoribbons: a First-Principles Study, Linze Li, Hong Li, Jing Zhou, Jing Lu*, Rui Qin, Zhengxiang Gao, and Wai Ning Mei, J. Compu. Theore. Nanoscience 7, 2100(2010).

164.  Selection of Single-Walled Carbon Nanotubes According to both Their Diameter and Chirality via Nanotweezers, Jing Zhou, Hong Li, Jing Lu*, Guangfu Luo, Lin Lai, Rui Qin, Lu Wang, Shigeru Nagase, Zhengxiang Gao* Wai Ning Mei, Guangping Li, Dapeng Yu, and Stefano Sanvito, Nano Research 3, 296 (2010).

165.  Separation of metallic single-walled carbon nanotubes using various amines, Y. Maeda, K. Komoriya, K. Sode, M. Kanda, M. Yamada, T. Hasegawa, T. Akasaka, J. Lu, S. Nagase, Physica Status Solidi B 247,2641 (2010).

166.  Insights into the local electronic structure of semiconducting boron carbides in the vicinity of transition metal dopants, Guangfu Luo, Jing Lu, Jing Liu, Wai-Ning Mei, Peter A, Dowben, Materials Science and Engineering B 175, 1 (2010).

167.  Ionic doping effect in ZrO₂ resistive switching memory, H. W. Zhang, B. Gao, S. Yu, L. Zeng, L. F. Liu, X.Y. Liu, Y. Wang, J. Lu, R.Q. Han, J.F. Kang*, Appl. Phys. Lett 96, 123502 (2010).

168.  Two-Step Alkylation of Single-Walled Carbon Nanotubes: Substituent Effect on Sidewall Functionalization, Yutaka Maeda, Takaaki Kato, Tadashi Hasegawa, Masahiro Kako, Takeshi Akasaka, Jing Lu, and Shigeru Nagase, Organic Lett 12, 996 (2010).

169.  First-principles study of the formation mechanisms of nitrogen molecule in annealed ZnO，Jingyun Gao, Rui Qin, Guangfu Luo, Jing Lu, Y Leprince-Wang, Hengqiang Ye, Zhimin Liao, Qing Zhao*, Dapeng Yu*. Phys. Lett. A. 374, 3546, (2010)

2009

170.  Electronic type- and diameter-dependent reduction of single-walled carbon nanotubes induced by adsorption of electron donor molecules, Jing Zhou, Yutaka Maeda, Jing Lu*, Atsushi Tashiro, Tadashi Hasegawa, Guangfu Luo, Lu Wang, Lin Lai, Takeshi Akasaka*, Shigeru Nagase,* Zhengxiang Gao,* Rui Qin, Wai Ning Mei, Guangping Li, Dapeng Yu, Small 5, 244 (2009).

171.  A facile, low-cost and scalable method of selective etching semiconducting single-walled carbon nanotubes by a gas reaction, Y. Liu*, H. Zhang, L. Cao, D. Wei, Dr. Y. Wang, H. Kajiura*, Dr. Y. Li, K. Noda, G. Luo, L. Wang, J. Zhou, J. Lu*, Z. Gao, Advanced Materials 21, 813 (2009).

172.  Magnetism in carbon nanoscrolls: quasi-half-metal and half-metal in pristine hydrocarbon, Lin Lai, Jing Lu*, Lu Wang, Guangfu Luo, Jing Zhou, Rui Qin, Yu Chen, Hong Li, Zhengxiang Gao,Guangping Li, Wai Ning Mei, Yutaka Maeda, Takeshi Akasaka, and Stefano Sanvito, Nano Research, 2, 844(2009).  

173.  Origin of p-Type Doping in Zinc Oxide Nanowires Induced by Phosphorus Doping: A First Principles Study, Rui Qin, JX Zheng, J. Lu*, Lu. Wang, L. Lai, GF. Luo, J. Zhou, H.Li, ZX. Gao*, GP. Li, WN, Mei, J. Phys. Chem. C 113, 9541 (2009).

174.  Optical Absorption Spectra of Charge-Doped Single-Walled Carbon Nanotubes from First-Principles Calculations, GF. Luo, J. Lu*, WN, Mei, L. Lai, J. Zhou, Rui Qin, H. Li, ZX. Gao, J. Phys. Chem.C 113, 7058 (2009).

175.  Adsorption of Nucleic Acid Bases and Amino Acids on Single-Walled Carbon and Boron Nitride Nanotubes: A First-Principles Study， Jiaxin Zheng, Lu Wang, Jing Lu*, Wei Song, Guangfu Luo, Jing Zhou, Rui Qin, Hong Li, Zhengxiang Gao, Lin Lai, Guangping Li, Wai Ning Mei, Journal of Nanoscience and Nanotechnology, 9, 6376 (2009).

176.  Study on the Dispersion of Charged Single-Wall Carbon Nanotube Bundles by First Principles Calculation, Wenshuo Liu, Lu Wang, Lin Lai, Guangfu Luo, Jing Lu*, Zhengxiang Gao, Journal of Nanoscience and Nanotechnology, 9, 5170 (2009).

177.  Magnetic properties of fully- and half-bare boron nitride nanoribbons, Lin Lai, Jing Lu*, Lu Wang, Guangfu Luo, Jing Zhou, Rui Qin, Zhengxiang Gao*, Wai Ning Mei, J. Phys. Chem. C 113， 2273 (2009).

178.  Stability, Electronic Structure, and Optical Property of Surface Passivated Silicon Nanowires: Density Functional Calculation, Chen, RY,  Wang, L,  Lai, L, J. Lu*  Luo, GF,  Zhou, J , Gao, ZX, J. Nanosci. Nanotech., 9, 1754 (2009).

179.  Tuning of Electronic Properties of Single-Walled Carbon Nanotubes under Homogenous Conditions, Y. Maeda, A. Sagara, M. Hashimoto, Y. Hirashima, K. Sode, T. Hasegawa, M. Kanda, MO. Ishitsuka, T. Tsuchiya, T. Akasaka, T. Okazaki, H. Kataura, J. Lu, S.Nagase, S. Takeuchi, ChemPhysChem. 10, 926 (2009).

180.  XRD and Raman Studies on the Ordering/Disordering of Ba(Mg1/3Ta2/3)O-3, CH, Wang, XP Jing, Lu Wang, Jing Lu, J. Amer. Ceramic Soc. 92, 1547 (2009).

181.  Effects of Ionic Doping on the Behaviors of Oxygen Vacancies in HfO₂ and ZrO₂: A First Principles Study. Haowei Zhang, Bin Gao, Shimeng Yu, Lin Lai, Lang Zeng, Bing Sun, Lifeng Liu, Xiaoyan Liu, Jing Lu, Ruqi Han, Jinfeng Kang*, 2009 International Conference on Simulation of Semiconductor Processes and Devices, 1-4 (2009).

182.  Magnetic properties of undoped Cu2O fine powders with magnetic impurities and/or cation vacancies, Chinping Chen*, Lin He, Lin Lai, Hua Zhang, Jing Lu, Lin Guo*, Yadong Li, Journal of Physics: Condensed Matter 21 (14), 145601, (2009).

183.  Electronic and mechanical coupling in bent ZnO nanowires, Xiaobing Han, Liangzhi Kou, Xiaoli Lang, Jianbai Xia, Ning Wang, Rui Qin, Jing Lu, Jun Xu, Zhimin Liao, Xinzheng Zhang, Xudong Shan, Xuefeng Song, Jingyun Gao, Wanlin Guo*, and Dapeng Yu*, Advanced Materials, 21, 4937 (2009).

2008

184.  Novel One-Dimensional Organometallic Half Metals: Vanadium-Cyclopentadienyl, Vanadium-Cyclopentadienyl-Benzene, and Vanadium-Anthracene Wires: Lu Wang, Zixing Cai, Junyu Wang, Jing Lu*, Guangfu Luo, Lin Lai, Jing Zhou, Rui Qin, Zhengxiang Gao*, Dapeng Yu, Guangping Li, Wai Ning Mei, and Stefano Sanvito, Nano Lett. 8, 3640 (2008).

185.  First-principles calculation of 13C NMR chemical shifts of infinite single-walled carbon nanotubes：New data for large-diameter and four helical nanotubes, Lin Lai, Jing Lu*, Wei Song, Ming Ni, Lu Wang, Guangfu Luo, Jing Zhou, Wai Ning Mei, Zhengxiang Gao*, Dapeng Yu, J. Phys. Chem. C 112, 16417 (2008).

186.  Tuning of Hole Doping Level of Iodine-Encapsulated Single-Walled Carbon Nanotubes by Temperature Adjusting, Zhiyong Wang, Lu Wang, Zujin Shi,* Jing Lu* and Zhennan Gu， Zhengxiang Gao, Chem. Comm. 29, 3429 (2008)

187.  Selective adsorption of cations on single-walled carbon nanotubes：a density functional theory study, Dan Wang, Jing Lu*, Lin Lai, Lu Wang, Guangfu Luo, Jing Zhou, Guangping Li, Wai Ning Mei, Shigeru Nagase, Yutaka Maeda, Takeshi Akasaka, Zhengxiang Gao, *Yunsong Zhou, Comp. Mater. Sci. 43, 886 (2008).

188.  Preparation of transparent and conductive thin films of metallic single-walled carbon nanotubes, Y. Maeda, A. Hashimoto, S. Kaneko, M. Kanda, T. Hasegawa, T. Tsuchiya, T. Akasak, Y. Naitoh, T. Shimizu, H. Tokumoto, Jing Lu, S. Nagase, J. Mater. Chem. 18, 4180 (2008).

189.  Simple purification and selective enrichment of metallic SWCNTs produced using the arc-discharge method, Y. Maeda, Y. Takano, A. Sagara, M. Hashimoto, M. Kanda, S. Kimura, Y. Lian, T. Nakahodo, T. Tsuchiya, T. Wakahara, T. Akasaka, T. Hasegawa, S. Kazaoui, M. Minami, Jing Lu, S. Nagase, Carbon, 46, 1563 (2008).

190.  Photoluminescence and energy transfer of phosphor series Ba₂-zSrzCaMo1-yWyO₆: Eu, Li for white light UVLED applications, S. Ye, C. H. Wang, Z. S. Liu, J. Lu, X. P. Jing, Appl. Phys. B 91, 551 (2008).

191.  Far infrared reflection spectrum and IR-active modes of MgTiO₃, C.H. Wang, X.J. Kuang, X.P. Jing, Jing Lu, X. Lu, J. Shao, J. Appl. Phys. 103, 074105(2008).

192.  Assignment of Raman-active vibrational modes of MgTiO₃, C.H. Wang, X.P. Jing, W. Feng, Jing Lu, J. Appl. Phys. 104, 034112 (2008).

193.  Electronic and magnetic properties of endohedrally doped fullerene Mn@C₆₀: a total energy study，Guangping Li , R. F. Sabirianov, Jing Lu, X. C. Zeng and W. N. Mei, J. Chem. Phys. 128, 074304(2008).

194.  C(60)(OH)(n)- Assisted dispersion of single-walled carbon nanotubes ,Maeda, Yutaka, Kato, Takaaki, Higo, Junki, Hasegawa, Tadashi, Kitano, Takahiro, Tsuchiya, Takahiro, Akasaka, Takeshi, Okazaki, Toshiya, Lu, Jing, Nagase, Shigeru, Nano, 3(6), pp 455-459, (2008).

2007

195.  Static and Optical Transverse and Longitudinal Screened Polarizabilities of Boron Nitride Nanotubes, Lu Wang, Jing Lu*, Lin Lai, Zhengxiang Gao* and Wai Ning Mei, J. Phys. Chem. C 111，3285 (2007).

196.  Why are Semiconducing Single-wall Carbon Nanotubes Abnormally Separated from Their Metallic Counterparts, Jing Lu*, Lin Lai, Guangfu Luo, Jing Zhou, Rui Qin, Lu Wang, Mingwei Jing, Wai Ning Mei, Guangping Li, Shigeru Nagase, Yutaka Maeda, Takeshi Akasaka, Zhengxiang Gao, Dapeng Yu, Small 3, 1566 (2007).

197.  Structural and electronic properties of nanoscrolls rolled up by single graphene sheet, Yu Chen, Jing Lu*, Zhengxiang Gao, J. Phys. Chem. C 111, 1625 (2007).

198.  Optical Absorption Spectra and Polarizabilities of Silicon Carbide Nanotubes: A First Principles Study, Lu Wang, Jing Lu*, Guangfu Luo, Wei Song, Lin Lai, Mingwei Jing, Rui Qin, Jing Zhou, Zhengxiang Gao* and Wai Ning Mei, J. Phys. Chem. C 111, 18864 (2007).

199.  First-principles study of the hydrogen-passivated single-crystalline silicon nanotubes: electronic and optical properties, Ming Ni, Guangfu Luo, Jing Lu*, Lin Lai, Lu Wang, Mingwei Jing, Wei Song, Zhengxiang Gao*, Guangping Li, Wai Ning Mei, Dapeng Yu, Nanotechnologe 18, 505707 (2007)

200.  Effects of hole doping on selectivity of naphthalene towards single-wall carbon nanotubes, Dan Wang, Jing Lu*, Ming Ni, Lin Lai, W. N. Mei, S. Nagase, Y. Maeda, T. Akasaka, Zhengxiang Gao, Yunsong Zhou, Comp. Mater. Sci. 40, 354 (2007).

201.  Structural and Electronic Properties of One Dimensional KxC60 Crystal Encapsulated in Carbon Nanotube, W Song, Jing Lu*, ZX Gao, M Ni, LH Guan, ZJ Shi, ZN Gu, S Nagase, DP Yu, HQYe, XW Zhang, International Journal of Modern Physics B 21, 1705 (2007).

202.  Extraction of metallic nanotubes of Zeolite-supported single-walled carbon nanotubes synthesized from alcohol, Y. Maeda, S. Hashimoto, T. Hasegawa, M. Kanda, T. Tsuchiya, T. Wakahara, T. Akasaka, Y. Miyauchi, S. Maruyama, Jing Lu, S. Nagase, Nano 2, 221 (2007).

203.  Correlation effects and electronic structure of Gd@C₆₀, R. F. Sabirianov, W. N. Mei, Jing Lu, Y. Gao, R.D. Bolskar, P. Jeppson, Ning Wu, A.N. Caruso, P.A. Dowben, J. Phys. Condens. Matter 19, 082201 (Fast Track Communication) (2007).

2006

204.  Selective interaction of large or charge-transfer aromatic molecules with metallic single-wall carbon nanotubes: critical role of the molecular size and orientation, Jing Lu*, Shigeru Nagase*, Xinwei Zhang, Dan Wang, Ming Ni, Yutaka Maeda, Takatsugu Wakahara, Tsukasa Nakahodo, Takahiro Tsuchiya, Takeshi Akasaka*, Zhengxiang Gao, Dapeng Yu, Hengqiang Ye, W. N. Mei, Yunsong Zhou, J. Am. Chem. Soc., 128, 5114 (2006).

205.  Dispersion and Separation of Small Single-Walled Carbon Nanotubes, Yutaka Maeda, Makoto Kanda, Masahiro Hashimoto, Tadashi Hasegawa, Shin-ichi Kimura, Yongfu Lian, Takatsugu Wakahara, Takeshi Akasaka, Said Kazaoui, Nobutsugu Minami, Toshiya Okazaki, Yuhei Hayamizu, Kenji Hata, Jing Lu, Shigeru Nagase, J. Am. Chem. Soc. 128, 12239 (2006).

206.  Structural and magnetic properties of Gd₃N@C₈₀, Jing Lu*, R. E. Sabirianov, W. N. Mei, Y. Gao, C. G. Duan, X. C. Zeng, J. Phys. Chem. B (Letter) 110, 23637 (2006).

207.  Structural and electronic properties of fluorinated boron nitride nanotubes, Lin Lai, Wei Song, Jing Lu*, Zhengxiang Gao, Shigeru Nagase, Ming Ni, W. N. Mei, Jianjun Liu, Dapeng Yu, Hengqiang Ye, J. Phys.Chem. B. 110, 14092 (2006).

208.  Anisotropic and Passivation Dependent Quantum Confinement Effects in Germanium Nanowires: A Comparison with Silicon Nanowires, Mingwei Jing, Ming Ni, Wei Song, Jing Lu*, Zhengxiang Gao, Lin Lai, Wai Ning Mei, Dapeng Yu, Hengqiang Ye, Lu Wang, J. Phys. Chem. B 110, 18332 (2006).

209.  Structural and electronic properties of Gd@C₆₀: All-electron relativistic total-energy study, Jing Lu*, W.N. Mei a,Yi Gao, Xiaocheng Zeng,Mingwei Jing,Guangping Li, Renat Sabirianov, Zhengxiang Gao, Liping You , Jun Xu ,Dapeng Yu , Hengqiang Ye, Chem. Phys. Lett. 425, 82 (2006)

210.  Evolution of the electronic properties of metallic single-wall carbon nanotubes with the degree of CCl2 covalent functionalization, Jing Lu*, Dan Wang, Shigeru Nagase, Ming Ni, Xinwei Zhang, Yutaka Maeda, Takatsugu Wakahara, Tsukasa Nakahodo, Takahiro Tsuchiya, Takeshi Akasaka, Zhengxiang Gao, Dapeng Yu, Hengqiang Ye, Yunsong Zhou, W. N. Mei, J. Phys. Chem. B, 110,5655 (2006).

211.  Preparation of Single-Walled Carbon Nanotube-Organosilicon Hybrids and Their Enhanced Field Emission Properties, Yutaka Maeda, Yoshinori Sato, Masahiro Kako, Takatsugu Wakahara, Takeshi Akasaka, Jing Lu, Shigeru Nagase, Yumiko Kobori, Tadashi Hasegawa, Kenichi Motomiya, Kazuyuki Tohji, Atsuo Kasuya, Dan Wang, Dapeng Yu, Zhengxiang Gao, Rushan Han, and Hengqiang Ye, Chem. Material, 18, 4205 (2006).

2005

212.  Interplay of single-wall carbon nanotubes and encapsulated La@C₈₂, La₂@C₈₀, and Sc₃N@C₈₀, Jing Lu*, Shigeru Nagase*, Dapeng Yu, Hengqiang Ye, Rushan Han, Zhengxiang Gao, Shuang Zhang, and Lianmao Peng, Physical Review B 71, 235417 (2005).

213.  Adsorption configuration of NH₃ on single-wall carbon nanotubes, Jing Lu*, Shigeru Nagase*, Dapeng Yu, Hengqiang Ye, Rushan Han, Zhengxiang Gao, Chem. Phys. Lett. 405, 90 (2005).

214.  Structural evolution of [2+1] cycloaddition derivatives of single- wall carbon nanotubes: from open structure to closed three-membered ring structure with increasing tube diameter, Jing Lu*, Shigeru Nagase*, Xinwei Zhang, Yutaka Maeda, Takatsugu Wakahara, Tsukasa Nakahodo, Takahiro Tsuchiya, Takeshi Akasaka, Dapeng Yu, Zhengxiang Gao, Rushan Han, Hengqiang Ye, J. Mol. Struc. (Theochem), 725, 255 (2005).

215.  Encapsulations of La@C₈₂ and La₂@C₈₀ inside single-walled boron nitride nanotubes Wei Song, Ming Ni, Jing Lu*, Zhengxiang Gao*, Shigeru Nagase, Dapeng Yu, Hengqiang Ye, Xinwei Zhang, J. Mol. Struc. (Theochem), 730, 119 (2005).

216.  Electronic Structures of Semiconducting Double-Walled Carbon Nanotubes: important effect of interlay interaction, Wei Song, Ming Ni, Jing Lu*, Zhengxiang Gao*, Shigeru Nagase, Dapeng Yu, Hengqiang Ye, Xinwei Zhang, Chem. Phys. Lett.414, 429 (2005).

217.  Large-Scale Separation of Metallic and Semiconducting Single-Walled Carbon Nanotubes, Yutaka Maeda, Shin-ichi Kimura, Makoto Kanda, Yuya Hirashima, Tadashi Hasegawa, Takatsugu Wakahara, Yongfu Lian, Tsukasa Nakahodo, Takahiro Tsuchiya, Takeshi Akasaka, Jing Lu, Xinwei Zhang, Zhengxiang Gao, Dapeng Yu,Shigeru Nagase, Said Kazaoui, Nobutsugu Minami, Tetsuo Shimizu, Hiroshi Tokumoto, Riichiro Saito, Journal of the American Chemical Society 127, 10287 (2005).

218.  Physical origin of the ferromagnetic ordering above room temperature in GaMnN nanowires, Y. P. Song, P. W. Wang, H. Q. Lin, G. S. Tian, J. Lu, Z. Wang, Y. Zhang, D. P. Yu*, J. Phys.: Condens. Matter 17 (33), 5073-5085, (2005).

2004

219.  Amphoteric and controllable doping of carbon nanotubes by encapsulation of organic and organometallic molecules, Jing Lu*, Shigeru Nagase*, Dapeng Yu, Hengqiang Ye, Rushan Han, Zhengxiang Gao, Shuang Zhang, Lianmao Peng, Physical Review Letters 93, 116804 (2004).

220.  A new approach to simulate the depolymerization process of a two- dimensional hexagonal C60 polymer, Jing Lu*, Shigeru Nagase*, Shuang Zhang, Lianmao Peng, Chem. Phys. Lett. 398, 484 (2004).

221.  Counterion-driven spontaneous polymerization of the linear C60_n- chains in the fcc fullerides and its magic number behavior, Jing Lu*, Shigeru Nagase*, Shuang Zhang, and Lianmao Peng, Chem. Phys. Lett. 395, 199 (2004).

222.  Energetic, geometric and electronic evolutions of single-wall nanotube cabon ropes with K intercalation concentration, Jing Lu*, Shigeru Nagase*, Shuang Zhang, and Lianmao Peng, Phyical Review B 69, 205304 (2004).

2003

223.  Structural and electronic properties of metal-encapsulated silicon clusters in a large size range, Jing Lu* and Nagase*, Physical Review Letters 90, 115506 (2003).

224.  Strongly size-dependent electronic properties in C₆₀-encapsulated zigzag nanotubes and lower size limit of carbon nano peapods, Jing Lu*, Shigeru Nagase*, Shuang Zhang, and Lianmao Peng, Phyical Review B 68， Rapid Communication, 121402 (2003).

225.  Theoretical identification of carbon clusters C₂₀: prevalence of the monocyclic isomer and existences of the smallest fullerene and bowl isomer, Jing Lu*, Suyong Re, Yoongkee Choe, Shigeru Nagase*, Yunsong Zhou, Rushan Han, Lianmao Peng, Xinwei Zhang, and Xiangeng Zhao, Physical Review B 67, 125415 (2003).

226.  Metal-doped germanium clusters MGens at the sizes of n=12 and 10: divergence of growth patterns from the MSin clusters, Jing Lu*, Shigeru Nagase*, 372 (3), 394-398 (2003).

2002

227.  Density functional theory studies of beryllium-doped endohedral fullerene Be@C₆₀: on center displacement of beryllium inside the C₆₀ cage，Jing Lu*, Yunsong Zhou, Xinwei Zhang, Xiangeng Zhao， Chem. Phys. Lett. 352, 8 (2002).

2001

228.  Structural and electronic properties of endohedral and exohedral complexes of silicon with C₆₀，Jing Lu, Yunsong Zhou, Shuang Zhang, Xinwei Zhang, Xiangeng Zhao, Chem. Phys. Lett. 343, 39 (2001).

229.   Structural and electronic properties of heterofullerene C₅₉P，Jing Lu，Yunsong Zhou,Yin Luo, Yuanhe Huang, Xinwei Zhang, Xiangeng Zhao, Molecular Physics 99, 1203 (2001).

230.   Structural and electronic properties of endohedral phosphorus fullerene P@C₆₀: an off-center displacement of P inside the cage，Jing Lu, Yunsong Zhou, Xinwei Zhang, Xiangeng Zhao, Molecular Physics 99, 1199 (2001).

231.   Structural and electronic properties of oxygen-doped heterofullerene: Is the O-C single bond shorter than the C-C single bond?, Jing Lu, Yin Luo, Yuanhe Huang, Xinwei Zhang, Xiangeng Zhao, Solid State Communication 118, 247 (2001).

232.   Semiempirical calculations on heterofullerene C₅₉Si: Structural and electronic localization, Jing Lu, Yin Luo, Yuanhe Huang, Xinwei Zhang, Xiangeng Zhao, Solid State Communication 118, 309 (2001).

2000

233.  Strong metal-cage hybridization in endohedral La@C₈₂, Y@C₈₂, and Sc@C₈₂, Jing Lu, Xinwei Zhang, Xiangeng Zhao, S. Nagase and K. Kobayashi, Chem. Phys. Lett. 332, 219 (2000).

234.   Metal-cage hybridization in endohedral La@C₆₀, Y@C₆₀, and Sc@C₆₀, Jing Lu, Xinwei Zhang and Xiangeng Zhao, Chem. Phys. Lett. 332, 51 (2000).

235.   Relativistic electronic structure calculations on endohedral Gd@C₆₀, La@C₆₀, Gd@C₇₄ and La@C₇₄, Jing Lu, Xinwei Zhang, Xiangeng Zhao, Applied Physics A 70, 461 (2000).

236.   Electronic properties of heterofullerenes C₅₉X (X=Si, O, and Be), Jing Lu, Xinwei Zhang, Xiangeng Zhao, Mod. Phys. Lett. B 14, 23 (2000).

1999

237.  Electronic structures of endohedral N@C₆₀, O@C₆₀ and F@C₆₀, Jing Lu, Xinwei Zhang, Xiangeng Zhao, Chem. Phys. Lett. 312, 85 (1999).

238.   Electronic structures of endohedral Ca@C₆₀, Sc@C₆₀ and Y@C₆₀, Jing Lu, Xinwei Zhang, Xiangeng Zhao, Solid State Communication 110, 565 (1999).

239.   Electronic structures of endohedral Sr@C₆₀, Ba@C₆₀, Fe@C₆₀ and Y@C₆₀, Jing Lu, Xinwei Zhang, Xiangeng Zhao, Mod. Phys. Lett. B 13, 97 (1999).

1998

240.  Valence-band electronic structure of the simple-cubic C₆₀, Jing Lu, Xinwei Zhang, Xiangeng Zhao and Liyuan Zhang, Solid State Communication 108, 89 (1998).

241.  Effects of the tangentially directed C-σ orbital on the conduction-band electronic structure of the simple-cubic Na₂CsC₆₀, Jing Lu, Xinwei Zhang, Xiangeng Zhao, and Liyuan Zhang, Int. J. Mod. Phys. B 12, 1985 (1998).

242.   Effects of molecular orientational disorder on the electronic structure of K₃C₆₀: with the inclusion of the tangentially directed C-σ orbital, Jing Lu, Xinwei Zhang, Xiangeng Zhao, and Liyuan Zhang, Int. J. Mod. Phys. B 12, 3521 (1998).

243.  Lattice constant dependence of the electronic structure of simple-cubic Na₂MC₆₀ (M =Cs, Rb), Jing Lu, and Liyuan Zhang, Solid State Communication 105, 99 (1998).

1997

244.  Determination of the mixing potential V between the bipolaron and the itinerant electron and possible two component interaction superconductivity based on a low N(EF) for doped fullerenes, Jing Lu, Xiaobing Feng, and Liyuan Zhang, Physica C 279, 209 (1997).

245.  Application of the recursion method to the electronic structure of Na₂CsC₆₀ and K₆C₆₀, Jing Lu, and Liyuan Zhang, Mod. Phys. Lett. B 11, 659 (1997).

246.  Electronic structure of Hg_0.8Pb_0.2Ba₂Ca₂Cu₃O 8+δ: The role of Pb doping, oxygen doping and high pressure, Jing Lu, Li-yuan Zhang, Xue-jun Hao, Acta Phys.Sin. (overseas Edition) 6, 40-51 (1997).

1996

247.   Effects of orientational disorder on the electronic structure of K₃C₆₀, Jing Lu, Liyuan Zhang, and Ziliang Cao, Mod. Phys. Lett. B 10, 1417 (1996).

248.   Numerical application of the recursion method to the electronic structure of C₆₀, Jing Lu, and Liyuan Zhang, Mod. Phys. Lett. B 10, 1133 (1996).

249.  Two-component superconductivity for doped fullerenes, Jing Lu and Liyuan Zhang, Mod. Phys. Lett. B 10, 823 (1996).

250.  Effects of Pairing Correlations on the Korringa Relation in Doped Fullerenes, Jing Lu, Li-yuan Zhang, Xiao-bing Feng, Chin. Phys. Lett. 13 (11), 859-862 (1996).