| 81 |
A density functional theory study of CO2 hydrogenation to methanol over Pd/TiO2 catalyst: The role of interfacial site
Ou ZL, Ran JY, Niu JT, Qin CL, He W, Yang L
International Journal of Hydrogen Energy, 45(11), 6328, 2020 |
| 82 |
Elucidating reaction equations of TiFx (x=4,3,2) catalysts for hydrogen storage applications
Jebasty RM, Vidya R
International Journal of Hydrogen Energy, 45(4), 2818, 2020 |
| 83 |
Decomposition mechanisms and the role of transition metal impurities in the kinetics of Ca(BH4)(2)center dot 2NH(3)
Huang ZN, Wang YQ, Zheng L, Wang D, Yang FS, Wu Z, Wu L, Zhang ZX
International Journal of Hydrogen Energy, 45(4), 2999, 2020 |
| 84 |
First-principles study of potassium-doped PC61BM for hydrogen storage
Lin DQ, Wang LX, Li HN
International Journal of Hydrogen Energy, 45(4), 3028, 2020 |
| 85 |
The optimal adsorption pathway of H-2 molecules on Ti-Acetylene/ethylene compounds: A DFT study
Wang JF, Rong YF, Han T, Ma LJ, Jia JF, Wu HS
International Journal of Hydrogen Energy, 45(3), 2105, 2020 |
| 86 |
Density functional theory calculations of iron - vanadium carbide interfaces and the effect of hydrogen
Restrepo SE, Di Stefano D, Mrovec M, Paxton AT
International Journal of Hydrogen Energy, 45(3), 2382, 2020 |
| 87 |
A density functional theory study on the conversion of polycyclic aromatic hydrocarbons in hydrogen plasma
Chen L, Cheng DG, Chen F, Zhan XL
International Journal of Hydrogen Energy, 45(1), 309, 2020 |
| 88 |
A comparative experimental and density functional study of glucose adsorption and electrooxidation on the Au-graphene and Pt-graphene electrodes
Caglar A, Duzenli D, Onal I, Tersevin I, Sahin O, Kivrak H
International Journal of Hydrogen Energy, 45(1), 490, 2020 |
| 89 |
Hydrogen trapping efficiency of Li decorated porous boron fullerene B-38: The first-principles study
Tang CM, Liu HL, Yao HB, Fu L
International Journal of Hydrogen Energy, 45(41), 21646, 2020 |
| 90 |
Theoretical insights into the origin of highly efficient photocatalyst NiO/NaTaO3 for overall water splitting
Wang MM, Ma YX, Fo YM, Lyu Y, Zhou X
International Journal of Hydrogen Energy, 45(38), 19357, 2020 |
