H. Han and E.-G. Kim, "Dielectric Effects on Charge-Transfer and Local Excited States in Organic Persistent Room-Temperature Phosphorescence," Chemistry of Materials 31, 6925-6935 (2019).
B. Joo, H. Han, and E.-G. Kim, "Solvation-Mediated Tuning of the Range-Separated Hybrid Functional: Self-Sufficiency through Screened Exchange," Journal of Chemical Theory and Computation 14, 2823-2828 (2018).
H.-J. Park, S.H. Han, J.Y. Lee, H. Han, and E.-G. Kim, "Managing Orientation of Nitrogens in Bipyrimidine-Based Thermally Activated Delayed Fluorescent Emitters to Supress Nonradiative Mechanisms," Chemistry of Materials 30, 3215-3222 (2018).
B. Joo and E.-G. Kim, "Hole Transport in Sulflower Revisited: New Insight from the Band Structure," Synthetic Metals 221, 25-27 (2016).
B. Joo and E.-G. Kim, "Controlled Electrical Doping of Organic Semiconductors: A Combined Intra- and Intermolecular Perspective from First Principles," Physical Chemistry Chemical Physics 18, 17890-17897 (2016).
B. Joo and E.-G. Kim, "Model-Independent Determination of the Degree of Charge Transfer in Molecular and Metal Complexes," Chemical Communications 51, 15071-15074 (2015).
T. A. Papadopoulos, H. Li, E.-G. Kim, J. Liu, J. A. Cella, C. M. Heller, A. Shu, A. Kahn, A. Duggal, and J.-L. Brédas, "Impact of Functionalized Polystyrenes as the Electron Injection Layer on Gold and Aluminum Surfaces: A Combined Theoretical and Experimental Study," Israel Journal of Chemistry 54, 779-788 (2014).
E.-G. Kim and J.-L. Brédas, "The Nature of the Aluminum–Aluminum Oxide Interface: A Nanoscale Picture of the Interfacial Structure and Energy-Level Alignment," Organic Electronics 14, 569-574 (2013).
L. Zhu, Y. Yi, Y. Li, E.-G. Kim, V. Coropceanu, and J.-L. Brédas, "Prediction of Remarkable Ambipolar Charge-Transport Characteristics in Organic Mixed-Stack Charge-Transfer Crystals," Journal of the American Chemical Society 134, 2340-2347 (2012).