| # | Name | Keywords | Year |
|---|---|---|---|
| 1 | Removal of H2S to produce hydrogen in the presence of CO on a transition metal-doped ZSM-12 catalyst: a DFT mechanistic study | H2S, ZSM-12 catalyst, DFT mechanistic | 2020 |
| 2 | DFT Study of Catalytic CO2 Hydrogenation over Pt-Decorated Carbon Nanocones: H2 Dissociation Combined with the Spillover Mechanism | CO2 Hydrogenation, Spillover Mechanism, Pt/dCNC catalyst, formic acid (FA), catalytic | 2019 |
| 3 | Theoretical insights into catalytic CO2 hydrogenation over single-atom (Fe or Ni) incorporated nitrogen-doped graphene | CO2 hydrogenation, DFT, Nitrogen-doped graphene, Formic acid, OXYGEN REDUCTION REACTION, SYNCHRONOUS-TRANSIT METHOD, DENSITY-FUNCTIONAL THEORY, FORMIC-ACID SYNTHESIS, CARBON-DIOXIDE, EFFICIENT CATALYS, TACTIVE-SITES, METAL, OXIDATION, ELECTROCATALYST | 2021 |
| 4 | Mechanistic insights into hydrogen production from formic acid catalyzed by Pd@N-doped graphene: The role of the nitrogen dopant | Decomposition of formic acid,N-doped graphene Catalyst, DFT, Hydrogen energy | 2023 |
| 5 | Vanadium-Doped Porous Cobalt Oxide for Its Superior Peroxidase-like Activity in Simultaneous Total Cholesterol and Glucose Determination in Whole Blood Based on a Simple Two-Dimensional Paper-Based Analytical Device | Blood; Catalyst activity; Cholesterol; Cobalt compounds; Color; Colorimetry; Glucose; Scanning; Blood samples; Cholesterol determination; Paper-based analytical devices; Peroxidase-like activities; Simple++; Tetramethylbenzidine; Total cholesterols; Two-dimensional; Vanadium doped; Whole blood; Screen printing | 2022 |
| 6 | Mechanistic insights into hydrogen production from formic acid catalyzed by Pd@N-doped graphene: The role of the nitrogen dopant | Catalyst; Decomposition of formic acid; DFT; Hydrogen energy; N-doped graphene | 2023 |
| 7 | Numerical investigation on performance improvement of CuO/TiO2 heterojunctions for applications in sunlight-driven photodetectors and photocatalysts | CuO/TiO2 heterojunctions· Photodetectors· Photocatalysts· Sunlight-driven· Self-powered device· Modeling and simulation | 2024 |
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