在包括Advanced Materials, Angew. Chem. Int. Ed., Advanced Energy Materials, Nano Energy, Langmuir, Journal of Physical Chemistry C等国际学术刊物发表SCI收录论文30余篇，总引用4000余次，高被引文章8篇。兼职多个国际知名期刊审稿人，包括：JACS、Nano Energy、 ACS Catalysis、 Journal of Catalysis、Nanocales、 Catalysis Science and Technology、ChemSusChem、Journal of Physical Chemistry C、 MRS Advances、 Journal of Quantum Chemistry等。
1.Catalytic mechanisms and design principles for single-atom catalyst in highly efficient CO2 conversion, Advanced Energy Materials, 2019, 9 (44), 1902625.
2.Guiding principles for designing highly efficient metal-free carbon catalysts; Advanced Materials, 2019, 1805252.
3.Catalytic Origin and Universal Descriptors of Heteroatom-Doped Photocatalysts for Solar Fuel Production, Nano Energy, 2019, 63, UNSP103819.
4.Phosphorus regulated cobalt oxide@nitrogen-doped carbon nanowires for flexible quasi-solid-state supercapacitors, Small, 2019, 1906458. (DOI:10.1002/smll.201906458)
5.Full color carbon dots through surface engineering for constructing white light-emitting diodes, Journal of Materials Chemistry C, 2019, 7, 2212.
6.Graphene-covered transition metal halide as efficient and durable electrocatalysts for oxygen reduction and evolution reactions, PCCP, 2019, 21(41), 23094-23101.
7.Detrimental effects and prevention of acidic electrolytes on oxygen reduction reaction catalytic performance of heteroatom-doped graphene catalysts, Frontiers in Materials, 2019, 6, 294.
8.Catalytic activity origin and design principles of graphitic carbon nitride electrocatalysts for hydrogen evolution, Frontiers inMaterials, 2019, DOI:10.3389/fmats.2019.00016
9.Oxygen vacancy formation energies in PbTiO3/SrTiO3 superlattice, Physical Review Materials, 2018, 2, 064409.
10.Dimensional control of defect dynamics in perovskite oxide superlattice, Physical Review Materials, 2018.3.8, 2(3): 035401.
11.Design principles for covalent organic frameworks as efficient electrocatalysts in clean energy coversion and green oxidizer production, Advanced materials, 2017.5.3, 29(17): 1606635
12.Oxygen vacancy diffusion in bulk SrTiO3 from density functional theory calculations, Computational materials science, 2016. 6.1, 118: 309~315
13.Tunable one-dimensional electron gas carrier densities at nanostructured oxide interfaces; Scientific Report, 2016, 6, 25452.
14.Charge Transfer Induced Activity of Graphene for Oxygen Reduction, Nanotechnology 2016, 27(18), 185402
15.Design Principles for Single and Dual Element-doped Carbon-based Bifunctional Catalysts for Fuel Cells and Metal-air Batteries, Advanced Materials, 2015.11.18, 27(43): 6834.
16.Role of lattice defects in catalytic activities of graphene clusters for fuel cells, Physical chemistry chemical physics, 2015, 17(26): 16733~16743
17.Catalytic mechanisms of sulfur-doped graphene as efficient oxygen reduction reaction catalysts for fuel cells, Journal of physical chemistry C, 2014.2.20, 118(7): 3545~3553
18.N-doped Graphene as Catalysts for Oxygen Reduction and Oxygen Evolution Reactions: Theoretical Considerations, Journal of Catalysis 2014, 314, 66-72
19.Edge-Selectively Sulfurized Graphene Nanoplatelets as Efficient Metal-Free Electrocatalysts for Oxygen Reduction Reaction: The Electron Spin Effect, Advanced materials, 2013.11, 25(42): 6138~6145
20.Effect of Microstructure of Nitrogen-Doped Graphene on Oxygen Reduction Activity in Fuel Cells, Langmuir, 2012.5.15, 28(19): 7542~7550
21.BCN Graphene as Efficient Metal- free Electrocatalyst for Oxygen Reduction Reaction, Angewandte chemie-international edition, 2012, 51(17): 4209~4212
22.Mechanisms of oxygen reduction reaction on nitrogen-doped graphene for fuel cells, Journal of physical chemistry C, 2011.6.9, 115(22): 11170~11176