Mechanism of sodium adsorption on N-doped graphene nanoribbons for sodium ion battery applications: A density functional theory approach HW Lee, HS Moon, J Hur, IT Kim, MS Park, JM Yun, KH Kim, SG Lee Carbon 119, 492-501, 2017 | 78 | 2017 |
Hydrogen Bonding-Mediated Enhancement of Bioinspired Electrochemical Nitrogen Reduction on Cu2–xS Catalysts MC Kim, H Nam, J Choi, HS Kim, HW Lee, D Kim, J Kong, SS Han, ... ACS Catalysis 10 (18), 10577-10584, 2020 | 47 | 2020 |
Atomistic sodiation mechanism of a phosphorene/graphene heterostructure for sodium-ion batteries determined by first-principles calculations HW Lee, H Jung, BC Yeo, D Kim, SS Han The Journal of Physical Chemistry C 122 (36), 20653-20660, 2018 | 39 | 2018 |
Activity, selectivity, and durability of ruthenium nanoparticle catalysts for ammonia synthesis by reactive molecular dynamics simulation: The size effect SY Kim, HW Lee, SJ Pai, SS Han ACS applied materials & interfaces 10 (31), 26188-26194, 2018 | 29 | 2018 |
High-throughput computational-experimental screening protocol for the discovery of bimetallic catalysts BC Yeo, H Nam, H Nam, MC Kim, HW Lee, SC Kim, SO Won, D Kim, ... npj Computational Materials 7 (1), 137, 2021 | 24 | 2021 |
CO2-derived edge-boron-doped hierarchical porous carbon catalysts for highly effective electrochemical H2O2 production A Byeon, JW Choi, HW Lee, WC Yun, W Zhang, CK Hwang, SY Lee, ... Applied Catalysis B: Environmental 329, 122557, 2023 | 23 | 2023 |
Atomistic Simulation Protocol for Improved Design of Si–O–C Hybrid Nanostructures as Li-Ion Battery Anodes: ReaxFF Reactive Force Field BC Yeo, H Jung, HW Lee, KS Yun, H Kim, KR Lee, SS Han The Journal of Physical Chemistry C 121 (42), 23268-23275, 2017 | 16 | 2017 |
Solid-solution alloying of immiscible Pt and Au boosts catalytic performance for H2O2 direct synthesis HW Lee, H Nam, GH Han, YH Cho, BC Yeo, MC Kim, D Kim, KY Lee, ... Acta Materialia 205, 116563, 2021 | 13 | 2021 |
Atomistic Insights into H2O2 Direct Synthesis of Ni–Pt Nanoparticle Catalysts under Water Solvents by Reactive Molecular Dynamics Simulations MJ Banisalman, HW Lee, H Koh, SS Han ACS Applied Materials & Interfaces 13 (15), 17577-17585, 2021 | 10 | 2021 |
Improved description of a coordinate bond in the ReaxFF reactive force field SJ Pai, HW Lee, SS Han The Journal of Physical Chemistry Letters 10 (22), 7293-7299, 2019 | 8 | 2019 |
Atomistic origin of mechanochemical NH3 synthesis on Fe catalysts HW Lee, GU Jeong, MC Kim, D Kim, S Kim, SS Han international journal of hydrogen energy 48 (10), 3931-3941, 2023 | 5 | 2023 |
Three-in-One Strategy to Improve Both Catalytic Activity and Selectivity: Nonconcentric Pd–Au Nanoparticles HW Lee, E Jung, GH Han, MC Kim, D Kim, KY Lee, SS Han, T Yu The Journal of Physical Chemistry Letters 12 (45), 11098-11105, 2021 | 5 | 2021 |
Corrigendum to "CO2-derived edge-boron-doped hierarchical porous carbon catalysts for highly effective electrochemical H2O2 production" [Appl. Catal. B … A Byeon, JW Choi, HW Lee, WC Yun, W Zhang, CK Hwang, SY Lee, ... Applied Catalysis B: Environmental 330, 122629, 2023 | | 2023 |
Catalyst containing au-pt alloy, method for preparing thereof and methods for synthesizing of hydrogen peroxide using the same SY Lee, SS Han, HB Nam, HW Lee, SH Cho, HS Jang US Patent App. 16/217,719, 2019 | | 2019 |