| Hydrogen generation via ammonia decomposition on highly efficient and stable Ru-free catalysts: approaching complete conversion at 450° C H Tabassum, S Mukherjee, J Chen, D Holiharimanana, S Karakalos, ... Energy & Environmental Science 15 (10), 4190-4200, 2022 | 57 | 2022 |
| DFT Study of Methane Activation and Coupling on the (0001) and (112̅0) Surfaces of α-WC T Zhang, D Holiharimanana, X Yang, Q Ge The Journal of Physical Chemistry C 124 (49), 26722-26729, 2020 | 11 | 2020 |
| Graphdiyne/main-group metal elements sandwich structure as a promising single atom electrocatalyst for nitrogen reduction: A theoretical investigation L Yang, M Li, D Holiharimanana, T Gao, Z Liu, S Liu, H Sun Molecular Catalysis 551, 113665, 2023 | 3 | 2023 |
| Reversible lewisite adsorption/desorption on the transition-metal-doped graphene: first-principle calculations Z Liu, H Liu, D Holiharimanana, H Wang, H Sun Research on Chemical Intermediates 49 (7), 2875-2887, 2023 | 2 | 2023 |
| Renewable adsorption/desorption of sarin on TM-doped CNTs: First principle calculations R Zhang, Z Liu, D Holiharimanana, H Sun Surface Science 736, 122338, 2023 | 1 | 2023 |
| Catalytic Reduction of N2O by CO on Single-Atom Catalysts Au/C2N and Cu/C2N: A First-Principles Study S Su, J Ma, Z Liu, D Holiharimanana, H Sun Catalysts 13 (3), 578, 2023 | 1 | 2023 |
| Heterostructure design on honeycomb borophene/Mo2C: A novel strategy for nitrogen fixation T Gao, M Li, D Holiharimanana, Z Liu, Z Wang, H Sun Molecular Catalysis 564, 114280, 2024 | | 2024 |
| Density Functional Theory and Kinetic Study of Catalytic Methane Conversion and Ammonia Decomposition DF Holiharimanana Southern Illinois University at Carbondale, 2023 | | 2023 |
