栏目导航
Navigation
栏目导航
Navigation
乐家波 副研究员
副研究员,硕士生导师。2014年获得华东理工大学应用化学学士学位,2017年在英国阿伯丁大学获得博士学位,2018-2020年于厦门大学从事博士后研究,2020年底加入中科院宁波材料所任“春蕾”副研究员。已以第一或通讯作者在Nat. Mater.、Phys. Rev. Lett.、Sci. Adv.、JACS Au等学术期刊上发表了15篇论文, 发表英文专著一章。
研究方向
电化学界面理论模拟、(光)电催化第一性原理计算
论文专利
[1] J. Le, M. Iannuzzi, A. Cuesta, and J. Cheng*, “Determining potentials of zero charge of metal electrodes versus the standard hydrogen electrode from based on density-functional-theory-based molecular dynamics,” Phys. Rev. Lett. 2017, 119, 016801.
[2] C. Li#, J. Le#, Y. Wang, S. Chen, Z. Yang, J. Li*, J. Cheng* and Z. Tian, “In situ probing electrified interfacial water structures at atomically flat surfaces,” Nat. Mater. 2019, 18, 697.
[3] J. Le, Q. Fan, J. Li and J. Cheng*, “Molecular origin of negative component of Helmholtz capacitance at electrified Pt(111)/water interface,” Sci. Adv. 2020, 6, eabb1219.
[4] J. Le, A. Chen, L. Li, J. Xiong, J. Lan, Y. Liu, M. Iannuzzi, J. Cheng*, “Modeling Electrified Pt(111)-Had /Water Interfaces from Ab Initio Molecular Dynamics”, JACS Au 2021, 1, 569.
[5] X. Li, A. Chen, X. Yang, J. Zhu, J. Le*, J. Cheng*, “Linear Correlation between Water Adsorption Energies and Volta Potential Differences for Metal/water Interfaces”, J. Phys. Chem. Lett. 2021, 12, 7299.
[6] J. Le, Q. Fan, L. Perez-Martinez, A. Cuesta, and J. Cheng*, “Theoretical insight into the vibrational spectra of metal-water interfaces from density functional theory based molecular dynamics,” Phys. Chem. Chem. Phys. 2018, 20, 11554.
[7] J. Le, A. Cuesta, and J. Cheng*, “The structure of metal-water interface at the potential of zero charge from density functional theory-based molecular dynamics,” J. Electroanal. Chem. 2018, 819, 87.
[8] J. Le, and J. Cheng*, “Modeling electrochemical interfaces from ab initio molecular dynamics: water adsorption on metal surfaces at potential of zero charge,” Curr. Opin. Electrochem. 2020, 19, 129.
[9] J. Le, and J. Cheng*, “Modeling electrified metal/water interfaces from ab initio molecular dynamics: Structure and Helmholtz capacitance,” Curr. Opin. Electrochem. 2021, 27, 100693.
[10] Y. Wang#, J. Le#, W. Li, J. Wei, P. Radjenovic, H. Zhang, X. Zhou*, J. Cheng*, Z. Tian, and J. Li, “In situ Spectroscopic Insight into the Origin of the Enhanced Performance of Bimetallic nanocatalysts towards ORR,” Angew. Chem. Int. Ed. 2019, 58, 16062.
研究项目
国家基金委青年项目、中国博士后基金特别资助、中国博士后基金面上项目。
相关信息
邮箱:lejiabo@nimte.ac.cn
传真:0574-86685043
办公室:新能源所北815