个人简历

教育背景 2009.09-2014.07 中国科学院大学材料物理与化学博士 2004.09-2008.06 海南大学材料科学与工程学士 工作经历 2019.06-至今 电子科技大学基础与前沿研究院教授 2017.01-2019.05 美国洛斯阿拉莫斯国家实验室主任博士后学者 2014.10-2016.12 德国不莱梅大学博士后

研究领域

主要通过采用第一性原理（DFT，TDDFT，GW等）、半经验（如相场等）与分子动力学等方法对电子信息、能源（光伏、光催化、电催化、锂电、锂硫等）、拓扑、非线性光学晶体等功能材料进行计算机设计与性能模拟（包括对电、磁、声、光及耦合交叉性质进行静态与动态的模拟）；并在以上多个方面与实验课题组进行广的合作。

近期论文

1. Zhou, L.*; Katan, C.; Nie, W.; Tsai, H.; Pedesseau, L.; Crochet, J.; Even, J.; Mohite, A.; Tretiak, S. Neukirch, A.* Cation Alloying Delocalizes Polarons in Lead-halide Perovskites. J. Phys. Chem. Lett. 2019, in press. 2. Sun, Y.; Huang, Z.; Zhou, Z.; Wu, J.; Zhou, L.; Cheng, Y.; Liu, J.; Zhu, C.; Yu, M.; Yu, P.; et al. Band Structure Engineering of Interfacial Semiconductors Based on Atomically Thin Lead Iodide Crystals. Adv. Mater. 2019s, 1806562 3. Zhou, L.*; Zhang, Y.; Zhuo, Z.; Neukirch, A. J.; Tretiak, S.* Interlayer-Decoupled Sc-Based Mxene with High Carrier Mobility and Strong Light-Harvesting Ability. J. Phys. Chem. Lett. 2018, 9, 6915–6920. 4. Li, W.; Zhou, L.; Prezhdo, O. V.; Akimov, A. V. Spin–Orbit Interactions Greatly Accelerate Nonradiative Dynamics in Lead Halide Perovskites. ACS Energy Lett. 2018, 3, 2159–2166. 5. Zhou, L.*; Neukirch, A.; Vogel, D.; Kilin, D.; Pedesseau, L.; Carignano, M.; Mohite, A.; Even, J.; Katan, C.; Tretiak, S.* Density of States Broadening in CH3NH3PbI3 Hybrid Perovskites Understood from ab initio Molecular Dynamics Simulations. ACS Energy Lett., 2018, 3, 787–793. 6. Zhang, J.; Zhang, J.; Zhou, L.; Cheng, C.; Lian, C.; Liu, J.; Tretiak, S.; Lischner, J.; Giustino, F.; Meng, S. Universal Scaling of Intrinsic Resistivity in Two-Dimensional Metallic Borophene. Angew. Chem. Int. Ed. 2018, 57, 4585–4589. 7. Liu, P.-F.; Zhou, L.*; Tretiak, S.; Wu, L.-M.* Two-Dimensional Hexagonal M3C2 (M = Zn, Cd and Hg) Monolayers: Novel Quantum Spin Hall Insulators and Dirac Cone Materials. J. Mater. Chem. C. 2017, 5, 9181-9187. 8. Zhou, L.*; Zhuo, Z.; Kou, L.; Du, A.; Tretiak, S.* Computational Dissection of Two-Dimensional Rectangular Titanium Mononitride TiN: Auxetics and Promises for Photocatalysis. Nano Lett. 2017, 17, 4466–4472. 9. Liu, P.-F.; Zhou, L.*; Frauenheim, T.; Wu, L.-M.* Two-dimensional hydrogenated molybdenum and tungsten dinitrides MN2H2 (M= Mo, W) as novel quantum spin hall insulators with high stability. Nanoscale. 2017, 9, 1007-1013. 10. Liu, P.-F.; Zhou, L.*; Frauenheim, T.; Wu, L.-M.* Graphene-like Mg3N2 Monolayer: High Stability, Desirable Direct Band Gap and Promising Carrier Mobility. Phys. Chem. Chem. Phys. 2016,18, 30379-30384. 11. Zhou, L.*; Shao, B.; Shi, W.; Sun, Y.; Felser, C.; Yan, B.; Frauenheim, Prediction of the quantum spin Hall effect in monolayers of transition-metal carbides MC (M=Ti, Zr, Hf). 2D Mater. 2016, 3, 35022. 12. Zhou, L.*; Shi, W.; Sun, Y.; Shao, B.; Felser, C.; Yan, B.; Frauenheim, T. Rectangular Tantalum Carbide Halides TaCX (X = Cl, Br, I) monolayer: Novel Large-Gap Quantum Spin Hall Insulator. 2D Mater. 2016, 3, 35018. 13. Zhou, L.*; Hou, Z.F.; gao, B.; Frauenheim, F. Doped Graphene as Anodes with Large Capacity for Lithium-Ion Batteries. J. Mater. Chem. A. 2016, 4, 13407–13413. 14. Zhou, L.*; Zhang, J.; Zhuo, Z.; Kou, L.; Ma, W.; Shao, B.; Du, A.; Meng, S.; Frauenheim, F. Novel Excitonic Solar Cells in Phosphorene-TiO2 Heterostructures with Extraordinary Charge Separation Efficiency. J. Phys. Chem. Lett. 2016, 7, 1880–1887. 15. Dong, H.; Zhou, L.*; Frauenheim, T.; Hou, T.; Lee, S.T.; Li, Y.* SiC7 Siligraphene: Novel Donor Material with Extraordinary Sunlight Absorption. Nanoscale, 2016, 8, 6994-6999. 16. Liu, P.-F.; Zhou, L.*; Frauenheim, T.; Wu, L.-M.* New Quantum Spin Hall Insulator in Two-Dimensional MoS2 with Periodically Distributed Pores. Nanoscale, 2016, 8, 4915–4921. 17. Zhou, L.*; Kou, L.; Sun, Y.; Felser, C.; Hu, F.; Shan, G.; Smith, S. C.; Yan, B.; Frauenheim, T. New Family of Quantum Spin Hall Insulators in Two-Dimensional Transition-Metal Halide with Large Nontrivial Band Gaps. Nano Lett., 2015, 15, 7867–7872. 18. Zhou, L. J.; Hou, Z. F.; Wu, L. M.; Zhang Y.F. (2014): First-Principles Studies of Lithium Adsorption and Diffusion on Graphene with Grain Boundaries. J. Phys. Chem. C, 2014, 118, 28055–28062. 19. Yu, P.; Wu, L. M.; Zhou, L. J.; Chen, L. Deep-Ultraviolet Nonlinear Optical Crystals: Ba3P3O10X (X = Cl, Br). J. Am. Chem. Soc. 2014, 136, 480–487.