Coordination environments tune the activity of oxygen catalysis on single atom catalysts: A computational study
Nano Research 15 (4), 3073-3081 (2022)
学术论文
Publications2022
Effective passivation with size‐matched alkyldiammonium iodide for high‐performance inverted perovskite solar cells
Advanced Functional Materials 32 (38), 2205009 (2022)
Large‐scale integration of a zinc metasilicate interface layer guiding well‐regulated Zn deposition
Advanced Materials 34 (27), 2202188 (2022)
Ligand modulation of active sites to promote electrocatalytic oxygen evolution
Advanced Materials 34 (18), 2200270 (2022)
Reversely trapping atoms from a perovskite surface for high-performance and durable fuel cell cathodes
Nature catalysis 5 (4), 300-310 (2022)
Ultrahigh stable methanol oxidation enabled by a high hydroxyl concentration on Pt clusters/MXene interfaces
Journal of the American Chemical Society 144 (34), 15529-15538 (2022)
Density functional theory for electrocatalysis
Energy & Environmental Materials 5 (1), 157-185 (2022)
Anchoring Sub‐Nanometer Pt Clusters on Crumpled Paper‐Like MXene Enables High Hydrogen Evolution Mass Activity
Advanced Functional Materials 32(17), 2110910 (2022)
Novel Two-Dimensional Metal-Based π-d Conjugated Nanosheets as Photocatalyst for Nitrogen Reduction Reaction: The First-Principle Investigation
ACS Applied Materials & Interfaces 14(4), 5384-5394 (2022)
2021
First‐principles investigations on the synergistic effect of N‐dopant and lattice‐strain for CO2 reduction to CO on graphene
International Journal of Quantum Chemistry 121 (6), e26535 (2021)
The stability analysis of the monolayer triangular borophene adsorbed on substrates: First-principles simulation
Computational Materials Science 190, 110271 (2021)
Diastereodivergent 1, 3-dipolar cycloaddition of α-fluoro-α, β-unsaturated arylketones and azomethine ylides: experimental and theoretical DFT studies
European Journal of Organic Chemistry 2021 (40), 5530-5535 (2021)
Accurate correlation energy functional for uniform electron gas from an interpolation ansatz without fitting parameters
Physical Review B 103 (4), 045130 (2021)
Revealing the Multi‐Electron Reaction Mechanism of Na3V2O2(PO4)2F Towards Improved Lithium Storage
ChemSusChem 14 (14), 2984-2991 (2021)
共 266 篇论文