Atomic-Scale
Device Simulation Lab

Presentations

2019
13 Atomic-Scale Degradation Mechanisms of Hybrid Halide Perovskites: An Ab Initio Study Khan Muhammad Ejaz, 김용훈 한국물리학회봄학술논문발표회, 2019.2019.04.26
12 Degradation Mechanisms of the Hybrid Halide Perovskites and Protection of Environmental Stability through Surface Passivation Muhammad Ejaz Khan, 김용훈 European Materials Research Society Spring Meeting, 2019.05.24
11 Quasi-Fermi level profiles across molecular junctions from multi-space constrained-search density functional theory 이주호, 여현우, 김한슬, 김용훈 European Materials Research Society Spring Meeting, 2019.05.23
10 The Synergetic Effect of Curvature and Charge Transfer Doping on Hydrogen Evolution Reaction: A First Principles Approach 노민종, 이주호, 김용훈 Asian Consortium on Computational Materials Science-10, 2019.07.26
9 Atomistic origins of low-resistance metal contacts to phase-engineered MoS2 김태형, 김용훈 Asian Consortium on Computational Materials Science-10, 2019.07.26
8 First-principles study of the effects of the electrode-molecule contact configurations on the molecule diode device characteristics 여현우, 이주호, 김한슬, 김용훈 Asian Consortium on Computational Materials Science-10, 2019.07.25
7 First-principles studies of the surfaces, interfaces, and junctions of hybrid halide perovskites 김용훈 Asian Consortium on Computational Materials Science-10, 2019.07.25
6 First-principles study of the ligand-dependent colloidal growth of CdSe nanoplatelets 류정아, 김효석, 김용훈 한국물리학회 봄학술논문발표회, 2019.04.26
5 Effects of the molecule-electrode contact configurations on the single-molecule diode performance: A finite-bias first-principles study 여현우, 이주호, 김한슬, 김용훈 한국물리학회 봄학술논문발표회, 2019.04.25
4 Atomic-Scale Degradation Mechanisms of Hybrid Halide Perovskites: An Ab Inition Study Khan Muhammad Ejaz, 김용훈 한국물리학회 봄학술논문발표회, 2019.04.26
3 First-principles determination of quasi-Fermi level profiles across molecular junctions 이주호, 여현우, 김한슬, 김용훈 한국물리학회 봄학술논문발표회, 2019.04.25
2 Stabilization of Atomically Precise Non-precious Metal Cluster on Bilayer C2N for Enhanced Catalytic Activity: A First-principles Study 노민종, 이주호, 김용훈 한국물리학회 봄학술논문발표회, 2019.04.25
1 Atomistic origins of low-resistance indium metal conatacts to MoS2: Beyond the energy band calculations 김태형, 김용훈 한국물리학회 봄학술논문발표회, 2019.04.24