Pitfalls in computational modeling of chemical reactions and how to avoid them H Ryu, J Park, HK Kim, JY Park, ST Kim, MH Baik Organometallics 37 (19), 3228-3239, 2018 | 187 | 2018 |
C–H Bond Addition across a Transient Uranium–Nitrido Moiety and Formation of a Parent Uranium Imido Complex KC Mullane, H Ryu, T Cheisson, LN Grant, JY Park, BC Manor, PJ Carroll, ... Journal of the American Chemical Society 140 (36), 11335-11340, 2018 | 60 | 2018 |
Solution-Processable, Crystalline π-Conjugated Two-Dimensional Polymers with High Charge Carrier Mobility S Jhulki, J Kim, IC Hwang, G Haider, J Park, JY Park, Y Lee, W Hwang, ... Chem 6 (8), 2035-2045, 2020 | 49 | 2020 |
Designing Redox‐Stable Cobalt–Polypyridyl Complexes for Redox Flow Batteries: Spin‐Crossover Delocalizes Excess Charge C Yang, G Nikiforidis, JY Park, J Choi, Y Luo, L Zhang, SC Wang, ... Advanced Energy Materials 8 (14), 1702897, 2018 | 48 | 2018 |
Energy refinement and analysis of structures in the QM9 database via a highly accurate quantum chemical method H Kim, JY Park, S Choi Scientific data 6 (1), 109, 2019 | 33 | 2019 |
Optical nature and binding energetics of fluorescent fluoride sensor bis (bora) calix [4] arene and design strategies of its homologues J Jin, JY Park, YS Lee The Journal of Physical Chemistry C 120 (42), 24324-24334, 2016 | 12 | 2016 |
Local intermolecular interactions for selective CO2 capture by zeolitic imidazole frameworks: energy decomposition analysis JY Park, YS Lee, Y Jung Nanotechnology for Sustainable Development, 277-288, 2014 | 11 | 2014 |
Oxidation of Cymantrene-Tagged Tamoxifen Analogues: Effect of Diphenyl Functionalization on the Redox Mechanism K Wu, B Pudasaini, JY Park, S Top, G Jaouen, MH Baik, WE Geiger Organometallics 39 (5), 679-687, 2020 | 5 | 2020 |
Oxidation of Cymantrene Analogues of Ferrocifen: Electrochemical, Spectroscopic, and Computational Studies of the Parent Complex 1, 1′-Diphenyl-2-cymantrenylbutene K Wu, JY Park, R Al-Saadon, H Nam, Y Lee, S Top, G Jaouen, MH Baik, ... Organometallics 37 (12), 1910-1918, 2018 | 5 | 2018 |
Novel Mechanism-Based Descriptors for Extreme Ultraviolet-Induced Photoacid Generation: Key Factors Affecting Extreme Ultraviolet Sensitivity JY Park, HJ Song, TC Nguyen, WJ Son, D Kim, G Song, SK Hong, H Go, ... Molecules 28 (17), 6244, 2023 | 3 | 2023 |
EUV-induced activation mechanism of photoacid generators: key factors affecting EUV sensitivity JY Park, TC Nguyen, D Kim, HJ Song, SK Hong, WJ Son, H Ahn, I Jang, ... Advances in Patterning Materials and Processes XL 12498, 134-141, 2023 | 3 | 2023 |
Computational Study of Hydrogen Chemisorption on a Multi‐Phenyl Organic Linker as a Model of Hydrogen Spillover on Metal‐Organic Frameworks# S Choi, K Jeong, JY Park, YS Lee Bulletin of the Korean Chemical Society 36 (3), 777-783, 2015 | 3 | 2015 |
Mechanism Investigation of Temperature Dependent Growth and Etching Process of GeCl4 on SiGe Surface: ab-initio Study JY Park, G Kim, JB Kim, SM Lee, S Kim, H Ko, S Lee, SH Lee, I Jang, ... 2021 International Conference on Simulation of Semiconductor Processes and …, 2021 | 1 | 2021 |
Application of redox potential in bio-organometallics chemistry (생체내 전이금속 종의 산화 환원 전위 계산) JY Park, MH Baik 화학세계 - 대한화학회, 2017 | | 2017 |
Two-component relativistic theory based composite method JY Park 한국과학기술원, 2015 | | 2015 |