Surface hopping dynamics beyond nonadiabatic couplings for quantum coherence JK Ha, IS Lee, SK Min The journal of physical chemistry letters 9 (5), 1097-1104, 2018 | 97 | 2018 |
Study of the decoherence correction derived from the exact factorization approach for nonadiabatic dynamics P Vindel-Zandbergen, LM Ibele, JK Ha, SK Min, BFE Curchod, NT Maitra Journal of Chemical Theory and Computation 17 (7), 3852-3862, 2021 | 31 | 2021 |
PyUNIxMD: A Python‐based excited state molecular dynamics package IS Lee, JK Ha, D Han, TI Kim, SW Moon, SK Min Journal of Computational Chemistry 42 (24), 1755-1766, 2021 | 29 | 2021 |
Atomic transistors based on seamless lateral metal-semiconductor junctions with a sub-1-nm transfer length S Song, A Yoon, JK Ha, J Yang, S Jang, C Leblanc, J Wang, Y Sim, ... Nature Communications 13 (1), 4916, 2022 | 25 | 2022 |
Independent trajectory mixed quantum-classical approaches based on the exact factorization JK Ha, SK Min The Journal of Chemical Physics 156 (17), 2022 | 14 | 2022 |
Machine learning-assisted excited state molecular dynamics with the state-interaction state-averaged spin-restricted ensemble-referenced Kohn–Sham approach JK Ha, K Kim, SK Min Journal of Chemical Theory and Computation 17 (2), 694-702, 2021 | 14 | 2021 |
Coupled-and independent-trajectory approaches based on the exact factorization using the PyUNIxMD package TI Kim, JK Ha, SK Min New Horizons in Computational Chemistry Software, 153-179, 2022 | 9 | 2022 |
Real-space and real-time propagation for correlated electron–nuclear dynamics based on exact factorization D Han, JK Ha, SK Min Journal of Chemical Theory and Computation 19 (8), 2186-2197, 2023 | 3 | 2023 |
Proton affinity and gas phase basicity of diamandoid molecules: diamantane to C 131 H 116 DC Camacho-Mojica, JK Ha, SK Min, R Vianello, RS Ruoff Physical Chemistry Chemical Physics 24 (5), 3470-3477, 2022 | 3 | 2022 |
Defect-free acrylic polymers with a near-Poisson distribution prepared via catalyst-free visible-light-driven radical polymerization MS Kwon, C Yu, JK Ha, J Ahn, J Lee, J Choi, T Chang, SK Min | | 2023 |
Development of Efficient Correlated Electron-Nuclear Dynamics Based on Exact Factorization and Machine Learning J Ha Ulsan National Institute of Science and Technology, 2022 | | 2022 |