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Adsorption of Carbon Tetrahalides on Coronene and Graphene File

Ha, Miran , Kim, Dong Yeon , Li, Nannan , Madridesjos, Jenica Marie L. , Park, In Kee , Youn, Il Seung , Lee, Joonho , Baig, Chunggi , Filatov, Michael , Min, Seung Kyu , et al

Article Issue Date2017-07 View126
Charting the Outer Helmholtz Plane and the Role of Nitrogen Doping in the Oxygen Reduction Reaction Conducted in Alkaline Media Using Nonprecious Metal Catalysts File

Lee, Stanfield Youngwon , Chung, Dong Young , Lee, Myeong Jae , Kang, Yun Sik , Shin, Heejong , Kim, Mi-Ju , Bielawski, Christopher W. , Sung, Yung-Eun

Article Issue Date2016-11 View150
Choosing a density functional for modeling adsorptive hydrogen storage: Reference quantum mechanical calculations and a comparison of dispersion-corrected density functionals File

Kocman, Mikulas , Jurecka, Petr , Dubecky, Matus , Otyepka, Michal , Cho, Yeonchoo , Kim, Kwang S.

Article Issue Date2015-03 View163
DFT-CES2: Quantum Mechanics Based Embedding for Mean-Field QM/MM of Solid-Liquid Interfaces File File

Jang, Taehwan , Shin, Seung-Jae , Lim, Hyung-Kyu , Goddard III, William A. , Kim, Hyungjun

Article Issue Date2025-04 View8
Halogen-pi Interactions between Benzene and X-2/CX4 (X = Cl, Br): Assessment of Various Density Functionals with Respect to CCSD(T) File

Youn, Il Seung , Kim, Dong Yeon , Cho, Woo Jong , Madridejos, Jenica Marie L. , Lee, Han Myoung , Kolaski, Maciej , Lee, Joonho , Baig, Chunggi , Shin, Seung Koo , Filatov, Michael , et al

Article Issue Date2016-11 View113
Intriguing Electrostatic Potential of CO: Negative Bond-ends and Positive Bond-cylindrical-surface File File

Kim, Hahn , Doan, Van Dung , Cho, Woo Jong , Valero, Rosendo , Aliakbar Tehrani, Zahra , Madridejos, Jenica Marie L. , Kim, Kwang S.

Article Issue Date2015-11 View150
Quantum Monte Carlo Study of the Water Dimer Binding Energy and Halogen-π Interactions File

Yang, D. ChangMo , Kim, Dong Yeon , Kim, Kwang S.

Article Issue Date2019-09 View114
Shape-Controlled Guanine Self-Assemblies for Stable and Fast-Ion Solid-Electrolyte Interphases in Sustainable Li Metal Batteries File File

Kang, So-Huei , Sohn, So-Dam , Lee, Kyung Min , Cho, Seok-Kyu , Lee, Byongkyu , Lee, Ji Eun , Lee, Sang-Young , Kwak, Sang Kyu , Shin, Hyung-Joon , Yang, Changduk

Article Issue Date2026-03 View14
Spectroscopic Evidence of a Reduced Alkenylnickel Intermediate in Catalytic Markovnikov-Selective Alkyne Hydroboration File File

Lee, Jeong Woo , Kim, Gun Ha , Jeong, Seo Yeong , Jeon, Ji Hwan , Kwon, Hyejin , Kim, Yung Sam , Jung, Byunghyuck , Seo, Sangwon , Rohde, Jan-Uwe , Hong, Sung You

Article Issue Date2026-04 View8
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