Yuanjia Luo

The effect of surface vacancy on adsorption of HS on smithsonite (101) surface: A DFT study

Yuanjia Luo, Leming Ou, Guofan Zhang et al. · Colloids and Surfaces A Physicochemical and Engineering Aspects · 2021 · 42 citations

Materials Engineering, Materials Science, Surface Characterization +12

Effects of defects and impurities on the adsorption of H2O on smithsonite (101) surfaces: Insight from DFT-D and MD

Yuanjia Luo, Leming Ou, Jianhua Chen et al. · Colloids and Surfaces A Physicochemical and Engineering Aspects · 2021 · 27 citations

Materials Science, Materials Engineering, Engineering +10

Study on the enhancement mechanism of Pb ion on smithsonite sulfidation with coordination chemistry and first-principles calculations

Yuanjia Luo, Leming Ou, Jianhua Chen et al. · Applied Surface Science · 2022 · 27 citations

Materials Science, Inorganic Chemistry, Chemical Engineering +9

Understanding the wettability and natural floatability of PbS with different types of vacancy defects: A perspective from spin-polarized DFT-D and MD

Yuanjia Luo, Leming Ou, Jianhua Chen et al. · Journal of Molecular Liquids · 2022 · 20 citations

Materials Science, Ii-vi Semiconductor, Quantum Liquid +10

Atomic-level insights into the modification mechanism of Fe (III) ion on smithsonite (1 0 1) surface from DFT calculation

Yuanjia Luo, Leming Ou, Jianhua Chen et al. · Advanced Powder Technology · 2022 · 20 citations

Materials Science, Inorganic Chemistry, Modification Mechanism +13