Researcher Page


Kim, Woo Youn (김우연) C-1846-2011

Department of Chemistry(화학과)
Research Area
Nano, Physical, Theoretical

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Single-crystalline Co2Si nanowires directly synthesized on silicon substrate for high-performance micro-supercapacitor

Lee, Jiyoung; Yoo, Chung-Yul; Lee, Yeong A.; et al, CHEMICAL ENGINEERING JOURNAL, v.370, pp.973 - 979, 2019-08


Performance of ACE-Reaction on 26 Organic Reactions for Fully Automated Reaction Network Construction and Microkinetic Analysis

Kim, Jin Woo; Kim, Yeonjoon; Baek, Kyung Yup; et al, JOURNAL OF PHYSICAL CHEMISTRY A, v.123, no.22, pp.4796 - 4805, 2019-06


Quantum transport properties of single-crystalline Ag2Se0.5Te0.5 nanowires as a new topological material

Kim, Minjin; Kim, Jihwan; Lee, In-Ho; et al, NANOSCALE, v.11, no.12, pp.5171 - 5179, 2019-03


Study of Li Adsorption on Graphdiyne Using Hybrid DFT Calculations

Kim, Jaewook; Kang, Sungwoo; Lim, Jaechang; et al, ACS APPLIED MATERIALS & INTERFACES, v.11, no.3, pp.2677 - 2683, 2019-01


Poly(amide-imide) materials for transparent and flexible displays

Kim, Sun Dal; Lee, Byungyong; Byun, Taejoon; et al, SCIENCE ADVANCES, v.4, no.10, 2018-10


Kohn-Sham approach for fast hybrid density functional calculations in real-space numerical grid methods

Kim, Jaewook; Kang, Sungwoo; Lim, Jaechang; et al, COMPUTER PHYSICS COMMUNICATIONS, v.230, pp.21 - 26, 2018-09


On the achievement of high fidelity and scalability for large-scale diagonalizations in grid-based DFT simulations

Choi, Sunghwan; Kim, Woo Younresearcher; Yeom, Min Sun; et al, INTERNATIONAL JOURNAL OF QUANTUM CHEMISTRY, v.118, no.16, 2018-08


Feasibility of Activation Energy Prediction of Gas-Phase Reactions by Machine Learning

Choi, Sunghwan; Kim, Yeonjoon; Kim, Jin Woo; et al, CHEMISTRY-A EUROPEAN JOURNAL, v.24, no.47, pp.12354 - 12358, 2018-08


Molecular generative model based on conditional variational autoencoder for de novo molecular design

Lim, Jaechang; Ryu, Seongok; Kim, Jin Woo; et al, JOURNAL OF CHEMINFORMATICS, v.10, 2018-07


Fragment-orbital tunneling currents and electronic couplings for analysis of molecular charge-transfer systems

Hwang, Sang-Yeon; Kim, Jaewook; Kim, Woo Younresearcher, PHYSICAL CHEMISTRY CHEMICAL PHYSICS, v.20, no.14, pp.9146 - 9156, 2018-04


Efficient structural elucidation of microhydrated biomolecules through the interrogation of hydrogen bond networks

Kim, Yeonjoon; Kim, Jaewook; Baek, Kyung Yup; et al, PHYSICAL CHEMISTRY CHEMICAL PHYSICS, v.20, no.12, pp.8185 - 8191, 2018-03


Efficient prediction of reaction paths through molecular graph and reaction network analysis

Kim, Yeonjoon; Kim, Jin Woo; Kim, Zeehyo; et al, CHEMICAL SCIENCE, v.9, no.4, pp.825 - 835, 2018-01


Non-empirical atomistic dipole-interaction-model for quantum plasmon simulation of nanoparticles

Lim, Jaechang; Kang, Sungwoo; Kim, Jaewook; et al, SCIENTIFIC REPORTS, v.7, 2017-11


Effects of the locality of a potential derived from hybrid density functionals on Kohn-Sham orbitals and excited states

Kim, Jaewook; Hong, Kwang-Woo; Hwang, Sang-Yeon; et al, PHYSICAL CHEMISTRY CHEMICAL PHYSICS, v.19, no.15, pp.10177 - 10186, 2017-04


Outstanding performance of configuration interaction singles and doubles using exact exchange Kohn-Sham orbitals in real-space numerical grid method

Lim, Jaechang; Choi, Sunghwan; Kim, Jaewook; et al, JOURNAL OF CHEMICAL PHYSICS, v.145, no.22, 2016-12


Improvement of initial guess via grid-cutting for efficient grid-based density functional calculations

Lim, Jaechang; Choi, Sunghwan; Kang, Sungwoo; et al, INTERNATIONAL JOURNAL OF QUANTUM CHEMISTRY, v.116, no.19, pp.1397 - 1403, 2016-10


Performance of heterogeneous computing with graphics processing unit and many integrated core for hartree potential calculations on a numerical grid

Choi, Sunghwan; Kwon, Oh Kyoung; Kim, Jaewook; et al, JOURNAL OF COMPUTATIONAL CHEMISTRY, v.37, no.24, pp.2193 - 2201, 2016-09


Enhancing the Activity of Platinum-Based Nanocrystal Catalysts for Organic Synthesis through Electronic Structure Modification

Kim, Minjune; Kim, Yena; Kim, Yeonjoon; et al, CHEMCATCHEM, v.8, no.15, pp.2450 - 2454, 2016-08


Update to ACE-molecule: Projector augmented wave method on lagrange-sinc basis set

Kang, Sungwoo; Ryu, Seongok; Choi, Sunghwan; et al, INTERNATIONAL JOURNAL OF QUANTUM CHEMISTRY, v.116, no.8, pp.644 - 650, 2016-04


Computational searching for new stable graphyne structures and their electronic properties

Kim, Hahn; Kim, Yeonjoon; Kim, Jaewook; et al, CARBON, v.98, pp.404 - 410, 2016-03

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