10 results on '"Le, Thong Nguyen‐Minh"'
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2. Insight into the direct conversion of methane to methanol on modified ZIF-204 from the perspective of DFT-based calculations
3. Coupling Amorphous Ni Hydroxide Nanoparticles with Single-Atom Rh on Cu Nanowire Arrays for Highly Efficient Alkaline Seawater Electrolysis
4. Functionalized Zr-MOF as an Efficient Adsorbent for Indole Removal: The Experimental and First-Principles Modeling
5. A decomposition mechanism for Mn2(DSBDC) metal–organic frameworks in the presence of water molecules
6. Hydrogen adsorption mechanism of MOF-74 metal–organic frameworks: an insight from first principles calculations
7. From the perspectives of DFT calculations, thermodynamic modeling, and kinetic Monte Carlo simulations: the interaction between hydrogen and Sc2C monolayers
8. DFT Study on the H2 Storage Properties of Sc-Decorated Covalent Organic Frameworks Based on Adamantane Units
9. Effects of structure and size of Ni nanocatalysts on hydrogen selectivity via water-gas-shift reaction—A first-principles-based kinetic study
10. SurfKin: An ab initio kinetic code for modeling surface reactions
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