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甘立勇

时间：2019-12-30 来源：作者：

甘立勇，博士，副研究员，硕士生导师

研究方向：主要从事计算凝聚态物理，低维能源材料器件性能优化与设计

1. 光、电催化（HER，ORR，OER，NRR等）

2. 二维材料相关光、电、磁等基本性质及应用

3. 离子电池

电子邮件：ganly@cqu.edu.cn

地址：重庆大学虎溪校区物理学院LE409

教育背景

➢ 2007.09～2012.07 华南理工大学物理学院博士

➢ 2003.09～2007.07 重庆大学数理学院学士

工作经历

➢ 2019.05～今重庆大学物理学院副研究员

➢ 2017.07～2019.05 华南理工大学材料科学与工程学院副研究员

➢ 2016.03～2016.09 南方科技大学物理系访问学者

➢ 2014.09～2017.07 西南交通大学超导与新能源研究开发中心副教授

➢ 2012.07～2014.07 King Abdullah University of Science of Technology博士后

科研成果

从事能源材料器件性能优化与设计的理论模拟，主要包括二维材料相关的输运性质、异相催化、光电催化、锂（钠、镁）离子电池等。至今在Adv. Funct. Mater.、ACS Nano、ACS Catal.、ACS Appl. Mater. Interfaces、J. Mater. Chem. A、J. Phys. Chem. Lett.、Phys. Rev. B等重要国际学术期刊以第一或通讯作者发表论文40多篇，被SCI他引超过1000次，主持国家自然科学基金、重点实验室开放基金各一项。担任Nat. Commun.、J. Mater. Chem. A、Nanoscale、Phys. Chem. Chem. Phys.等期刊审稿人。

科研论文（*通讯作者，^#共同第一作者）：

1. H. Yin, L.-Y. Gan*, and P. Wang*, “The Identification of Optimal Active Boron Sites for N₂ Reduction”, J. Mater. Chem. A 8, 3910 (2020).

2. B. Fu, W. Wu, L.-Y. Gan*, and Z. Zhang*, “Bulk/Surface Defects Engineered TiO2 Nanotube Photonic Crystals Coupled with Plasmonic Gold Nanoparticles for Effective in Vivo Near-Infrared Light Photoelectrochemical Detection”, Anal. Chem. 91, 14611 (2019).

3. G. Rehman, S. A. Khan, R. Ali, I. Ahmad, L.-Y. Gan*, B. Amin*, “Van der Waals Heterostructures of Blue Phosphorene and Scandium-Based MXenes Monolayers”, J. Appl. Phys. 126, 143101 (2019).

4. H.-F. Zhong, H. Yin, D.-X. Zhang, L.-Y. Gan*, and P. Wang*, “Intrinsically Synergistic Active Centers Coupled with Surface Metal Doping to Facilitate Alkaline Hydrogen Evolution Reaction”, J. Phys. Chem. C 123, 24220 (2019).

5. H. Yin, Y.-P. Qiu, H. Dai, L.-Y. Gan*, H.-B. Dai, and P. Wang*, “Pt-Embedded in Monolayer g-C₃N₄ as a Promising Single-Atom Electrocatalyst for Ammonia Synthesis”, J. Mater. Chem. A 7, 11908 (2019).

6. M. Zhuang, G.-L. Xu, L.-Y. Gan^#, Y. Dou, C.-J. Sun, X. Ou, Y. Xie, Z. Liu, Y. Cai, Y. Ding, I. H. Abidi, A. Tyagi, K.Amine*, Z. Luo*, “Sub-5 nm Edge-Rich 1T’-ReSe₂ as Bifunctional Materials for Hydrogen Evolution and Sodium-Ion Storage”, Nano Energy 58, 660 (2019).

7. H. U. Du, M. Idrees, G. Rehman, C. V. Nguyen, L.-Y. Gan*, I. Ahmad*, M. Maqbool, B. Amin*, “Electronic structure, optical and photocatalytic performance of SiC-MX₂ (M = Mo, W and X = S, Se) van der Waals heterostructures”, Phys. Chem. Chem. Phys. 20, 24168 (2018).

8. Y.-T. Du, X. Kan*, F. Yang, L.-Y. Gan*, U. Schwingenschlögl, “MXene/Graphene Heterostructures as High-Performance Electrodes for Li-Ion Batteries”, ACS Appl. Mater. Interfaces 10, 32867 (2018).

9. Y. Jin, L.-Y. Gan^#, R. Wang, J. Zhao, Y. Shan, J. Liu*, and H. Xu*, “Topological Rashba-Like Edge States in Large-Gap Quantum Spin Hall Insulators”, Phys. Rev. Mater. 2, 114207 (2018).

10. Z.-J. Chen, G.-X. Cao, L.-Y. Gan*, H. Dai, N. Xu, M.-J. Zang, H.-B. Dai, H. Wu, and P. Wang*, “Highly Dispersed Platinum on Honeycomb-Like NiO@Ni Film as a Synergistic Electrocatalyst for Hydrogen Evolution Reaction”, ACS Catal. 8, 8866 (2018).

11. Y. Ding, I. H. Abidi, R. Wu, M. Zhuang, L.-Y. Gan*, and Z. Luo*, “Stacking-Modes-Induced Chemical Reactivity Differences on CVD Trilayer Graphene”, ACS Appl. Mater. Interfaces 10, 23424 (2018).

12. M. Zang, N. Xu, G. Cao, Z. Chen, J. Cui, L.-Y. Gan*, H. Dai, X. Yang, and P. Wang*, “Cobalt Molybdenum Oxide Derived High-Performance Electrocatalyst for the Hydrogen Evolution Reaction”, ACS Catal. 8, 5062 (2018).

13. H. Yin, Y.-P. Qiu, H. Dai, L.-Y. Gan*, H.-B. Dai, and P. Wang*, “Understanding of Selective H₂ Generation from Hydrazine Decomposition on Ni(111) Surface”, J. Phys. Chem. C 122, 5443 (2018).

14. J. Wang, L.-Y. Gan, W. Zhang, Y. Peng, H. Yu, Q. Yan, X. Xia, and X. Wang*, “In Situ Formation of Molecular Ni-Fe Active Sites on Heteroatoms Doped Graphene as Heterogeneous Electrocatalyst toward Oxygen Evolution”, Sci. Adv. 4, eaap7970 (2018).

15. G. Rehman, S. A. Khan, B. Amin,* I. Ahmad,* L.-Y. Gan*, and M. Maqbool*, “Intriguing Electronic Structure and Optical Properties of Two-Dimensional van der Waals Heterostructures of Zr₂CT₂ (T = O, F) with MoSe₂ and WSe₂” J. Mater. Chem. C 6, 2830 (2018).

16. M. Zhuang, L.-Y. Gan*, M. Zou, Y. Dou, X. Ou, Z. Liu, Y. Ding, I. H. Abidi, A. Tyagi, M. Jalali, J. You, A. Cao, and Z. Lu*, “Engineered Sub-100 nm Mo_(1-x)W_xSe₂ Crystals for Efficient Hydrogen Evolution Catalysis”, J. Mater. Chem. A 6, 2900 (2018).

17. J.-H. Liu, X. Kan*, B. Amin*, L.-Y. Gan*, and Yong Zhao, “Theoretical Exploring Potential Applications of Sc-Based MXenes”, Phys. Chem. Chem. Phys. 19, 32253 (2017) Selected in 2017 HOT articles.

18. S.-L. Li, H. Yin, X. Kan*, L.-Y. Gan*, U. Schwingenschlögl* and Yong Zhao, “Potential of Transition Metal Atoms Embedded in Buckled Monolayer g-C₃N₄ as Single-Atom Catalysts”, Phys. Chem. Chem. Phys. 19, 30069 (2017).

19. Y. Xin, X. Kan, L.-Y. Gan*, and Z. Zhang*, “Heterogeneous Bimetallic Phosphide/Sulfide Nanocomposite for Efficient Solar-Energy-Driven Overall Water Splitting”, ACS Nano 11,10303 (2017).

20. S. A. Khan, B. Amin*, L.-Y. Gan*, and I. Ahmad*, “Strain Engineering of Electronic Structures and Photocatalytic Responses of MXenes Functionalized by Oxygen”, Phys. Chem. Chem. Phys. 19, 14738 (2017).

21. L.-Y. Gan, R. Wang, Y. J. Jin, D. B. Ling, J. Z. Zhao, W. P. Xu, J. F. Liu* and H. Xu*, “Emergence of Topological Nodal Loops in Alkaline-Earth Hexaborides XB₆ (X = Ca, Sr, and Ba) under Pressure”, Phys. Chem. Chem. Phys. 19, 8210 (2017).

22. Q. Kong, W. Feng, Q. Wang, L-Y Gan* and C. Sun*, “SiS Nanosheets as a Promising Anode Material for Li-Ion Batteries: A Computational Study”, Phys. Chem. Chem. Phys. 19, 8563 (2017).

23. L.-Y. Gan*, Y. Cheng*, U. Schwingenschlögl*, Y. Yao, Y. Zhao, X. Zhang, and W. Huang, “Edge Structures and Properties of Triangular Antidots in Single-Layer MoS₂”, Appl. Phys. Lett., 109, 091603 (2016).

24. C.-S. Guo*, Y. Zhou, X.-Q. Shi, L.-Y. Gan*, H. Jiang*, and Y. Zhao, “Robust Half-Metallic Ferromagnetism and Curvature Dependent Magnetic Coupling in Fluorinated Boron Nitride Nanotubes”, Phys. Chem. Chem. Phys. 18, 12307 (2016).

25. L.-Y. Gan, Q. Zhang, C.-S. Guo*, U. Schwingenschlögl*, and Y. Zhao, “Two-Dimensional MnO₂/Graphene Interfaces: Half-Metallicity and Quantum Anomalous Hall State”, J. Phys. Chem. C 120, 2119 (2016).

26. L.-Y. Gan*, L.-H. Zhang, Q. Zhang, C.-S. Guo*, U. Schwingenschlögl, and Y. Zhao, “Strain Tuning of the Charge Density Wave in Monolayer and Bilayer 1T-TaS₂”, Phys. Chem. Chem. Phys. 18, 3080 (2016).

27. A. Nie, L.-Y. Gan^#, Y. Cheng, X. Tao, Y. Yuan, S. Sharifi-Asl, K. He, H. Asayesh-Ardakani, V. Vasiraju, J. Lu, F. Mashayek, R. Klie, S. Vaddiraju, U. Schwingenschlögl, R. Shahbazian-Yassar*, “Ultrafast and Highly Reversible Sodium Storage in Zinc-Antimony Intermetallic Nanomaterials”, Adv. Funct. Mater. 26, 543, (2016).

28. L.-Y. Gan, S. O. Akandea and U. Schwingenschlögl*, “Anisotropic O Vacancy Formation and Diffusion in LaMnO₃”, J. Mater. Chem. A 2, 19733 (2014).

29. L.-Y. Gan, Q. Zhang, Y.-J. Zhao, Y. Cheng, and U. Schwingenschlögl*, “Atomic Distribution in the Two-Dimensional Semiconducting Transition Metal Dichalcogenide Alloys Mo_1-xW_xX₂ (X = S, Se, and Te)”, Sci. Rep. 4, 6691 (2014).

30. L.-Y. Gan, Q. Zhang, Y. Cheng, and U. Schwingenschlögl*, “Photovoltaic Heterojunctions of Fullerenes with MoS₂ and WS₂ Monolayers”, J. Phys. Chem. Lett. 5, 1445 (2014).

31. L.-Y. Gan and U. Schwingenschlögl*, “Two-Dimensional Square Ternary Cu₂MX₄ (M = Mo, W; X = S, Se) Monolayers and Nanoribbons”, Phys. Rev. B 89, 125423 (2014).

32. L.-Y. Gan, Q. Zhang, Y. Cheng, and U. Schwingenschlögl*, “Two-Dimensional Ferromagnet/Semiconductor Transition Metal Dichalcogenide Contacts: p-type Schottky Barrier and Spin-Injection Control”, Phys. Rev. B 88, 5310 (2013).

33. L.-Y. Gan, Y.-J. Zhao, D. Huang, and U. Schwingenschlögl*, “First-Principles Analysis of MoS₂/Ti₂C and MoS₂/Ti₂CY₂ (Y=F and OH) All-2D Semiconductor/Metal Contacts”, Phys. Rev. B 87, 245307 (2013).

34. L.-Y. Gan, D. Huang, and U. Schwingenschlögl*, “Oxygen Adsorption and Dissociation during the Oxidation of Monolayer Ti₂C”, J. Mater. Chem. A 1, 13672 (2013).

35. L.-Y. Gan and Y.-J. Zhao*, “Inverse NiO_1-x/Cu Catalyst with High Activity towards Water-Gas Shift”, J. Phys. Chem. C 116, 16089 (2012).

36. L.-Y. Gan, R.-Y. Tian, X.-B. Yang, and Y.-J. Zhao*, “Surface Structures and Phase Transition of K Adsorption on Au(111) by Ab Initio Atomistic Thermodynamics”, J. Chem. Phys. 136, 044510 (2012).

37. L.-Y. Gan, R.-Y. Tian, X.-B. Yang, and Y.-J. Zhao*, “Catalytic Reactivity of CuNi Alloys towards H₂O and CO Dissociation for an Efficient Water Gas Shift: A DFT Study”, J. Phys. Chem. C 116, 745 (2012).

38. L.-Y. Gan, R.-Y. Tian, X.-B. Yang, and Y.-J. Zhao*, “Interaction between NO and Na, O, S, Cl on Au and Pd(111) Surfaces”, Phys. Chem. Chem. Phys. 13, 14466 (2011).

39. L.-Y. Gan, R.-Y. Tian, X.-B. Yang, and Y.-J. Zhao*, “Theoretical Study of the Influence of Na on CO Adsorption and Dissociation on Pd (111): Long-Range or Short-Range Interactions between Co-Adsorbates?”, Chem. Phys. Lett. 511, 33 (2011).

40. L.-Y. Gan, and Y.-J. Zhao*, “Charge Effect in S Enhanced CO Adsorption: A Theoretical Study of CO on Au, Ag, Cu and Pd (111) Surfaces Co-adsorbed with S, O, Cl, and Na”, J. Chem. Phys. 133, 094703 (2010).

41. L.-Y. Gan, Y.-X. Zhang, and Y.-J. Zhao*, “A Comparison of S Poisoning Effects on CO Adsorption on Pd, Au, and Bimetallic PdAu(111) Surfaces”, J. Phys. Chem. C 114, 996 (2010).

42. A. Nie, L.-Y. Gan, Y. Cheng, Q. Li., Y. Yuan, F. Mashayek, H. Wang, R. Klie, U. Schwingenschlögl, R. S. Yassar, “Twin Boundary-Assisted Lithium Ion Transport”, Nano Lett. 15, 610 (2015).

43. Q. Zhang, L.-Y. Gan, Y.-J. Zhao, Y. Cheng, and U. Schwingenschlögl*, “Spin Polarization Driven by a Charge-Density Wave in Monolayer 1T-TaS₂”, Phys. Rev. B 90, 081103 (R) (2014).

44. A. Nie, L.-Y. Gan, Y. Cheng, H. Asayesh-Ardakani, Q. Li, C. Dong, R. Tao, F. Mashayek, H.-T. Wang, U. Schwingenschlögl, R. F. Klie, R S. Yassar*, “Atomic-Scale Observation of Lithiation Reaction Front in Nanoscale SnO₂ Materials”, ACS Nano 7, 6203 (2013).

45. S.-L. Peng, L.-Y. Gan, R.-Y Tian, and Y.-J. Zhao*, “Theoretical Study of CO Adsorption and Oxidation on the Gold–Palladium Bimetal Clusters”, Comput. Theor. Chem. 977, 62-68 (2011).

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