| 2006-10 | An ab initio study of the energetics for interfaces between group V transition metal carbides and bcc iron | Chung, Soon-Hyo; Ha, Heon-Phil; Jung, Woo-Sang; Byun, Ji-Young |
| 2006-04 | An ab initio study of the energetics for interfaces between group V transition metal Nitrides and bcc iron | Jung, Woo-Sang; Chung, Soon-Hyo; Ha, Heon-Phil; Byun, Ji-Young |
| 2017-09-12 | beta-CuGaO2 as a Strong Candidate Material for Efficient Ferroelectric Photovoltaics | Song, Seungwoo; Kim, Donghun; Jang, Hyun Myung; Yeo, Byung Chul; Han, Sang Soo; Kim, Chang Soo; Scott, James F. |
| 2023-12 | Block sparsity promoting algorithm for efficient construction of cluster expansion models for multicomponent alloys | Thekkepat, Krishnamohan; Das, Sumanjit; Dogra, Debi Prosad; Gupta, Kapil; Lee, Seung-Cheol |
| 2015-10 | Catalytic activity for oxygen reduction reaction on platinum-based core-shell nanoparticles: all-electron density functional theory | Shin, Jungho; Choi, Jung-Hae; Cha, Pil-Ryung; Kim, Seong Keun; Kim, Inho; Lee, Seung-Cheol; Jeong, Doo Seok |
| 2018-01-31 | Density functional theory study for the enhanced sulfur tolerance of Ni catalysts by surface alloying | Hwang, Bohyun; Kwon, Hyunguk; Ko, Jeonghyun; Kim, Byung-Kook; Han, Jeong Woo |
| 2014-08-04 | Design of sustainable V-based hydrogen separation membranes based on grain boundary segregation | Ko, Won-Seok; Oh, Ju-Young; Shim, Jae-Hyeok; Suh, Jin-Yoo; Yoon, Woo Young; Lee, Byeong-Joo |
| 2017-11 | Development and application of Ni-Ti and Ni-Al-Ti2NN-MEAM interatomic potentials for Ni-base superalloys | Kim, Young-Kwang; Kim, Hong-Kyu; Jung, Woo-Sang; Lee, Byeong-Joo |
| 2021-01 | Effect of local strain energy to predict accurate phase diagram of III-V pseudobinary systems: case of Ga(As,Sb) and (In,Ga)As | Han, Gyuseung; Yeu, In Won; Park, Jaehong; Ye, Kun Hee; Lee, Seung-Cheol; Hwang, Cheol Seong; Choi, Jung-Hae |
| 2014-08-28 | Effect of surface hydroxyl coverage on platinum nanoparticles in the oxygen reduction reaction: All-electron density functional theory analysis | Shin, Jungho; Choi, Jung-Hae; Bae, Youn-Sang; Lee, Seung-Cheol |
| 2016-01-25 | Effect of thermodynamic properties on the infrared radiation behavior of Ti-based solid solutions | Lee, Jungmin; Lee, Young-Su; Kim, Jae-Hee |
| 2018-12 | Electronic and magnetic structure investigation of vanadium doped ZnO nanostructure | Bhardwaj, Richa; Singh, Jitendra Pal; Chae, Keun Hwa; Goyal, Navdeep; Gautam, Sanjeev |
| 2008-09 | Energetics for interfaces between group IV transition metal carbides and bcc iron | Jung, Woo-Sang; Lee, Seung-Cheol; Chung, Soon-Hyo |
| 2019-01-24 | Fundamental Mechanisms of Reversible Dehydrogenation of Formate on N-Doped Graphene-Supported Pd Nanoparticles | Shin, Dong Yun; Kim, Min-Su; Kwon, Jeong An; Shin, Yeon-Jeong; Yoon, Chang Won; Lim, Dong-Hee |
| 2015-03-05 | Importance of Orbital Interactions in Determining Electronic Band Structures of Organo-Lead Iodide | Kim, Jongseob; Lee, Seung-Cheol; Lee, Sung-Hoon; Hong, Ki-Ha |
| 2014-02 | Lattice-strain effect on oxygen vacancy formation in gadolinium-doped ceria | Ahn, Kiyong; Chung, Yong-Chae; Yoon, Kyung Joong; Son, Ji-Won; Kim, Byung-Kook; Lee, Hae-Weon; Lee, Jong-Ho |
| 2014-03-13 | Mechanistic Investigation of the Catalytic Decomposition of Ammonia (NH3) on an Fe(100) Surface: A DFT Study | Yeo, Sang Chul; Han, Sang Soo; Lee, Hyuck Mo |
| 2015-01-07 | Micro- and Mesoporous Carbide-Derived Carbon-Selenium Cathodes for High-Performance Lithium Selenium Batteries | Lee, Jung Tae; Kim, Hyea; Oschatz, Martin; Lee, Dong-Chan; Wu, Feixiang; Lin, Huan-Ting; Zdyrko, Bogdan; Cho, Won Il; Kaskel, Stefan; Yushin, Gleb |
| 2011-12-14 | Molecular Tunnel Junctions Based on pi-Conjugated Oligoacene Thiols and Dithiols between Ag, Au, and Pt Contacts: Effect of Surface Linking Group and Metal Work Function | Kim, BongSoo; Choi, Seong Ho; Zhu, X. -Y.; Frisbie, C. Daniel |
| 2021-06-09 | Penta carbides: Two-dimensional group-IV semiconductors containing C-2 dimers for nanoelectronics and photocatalytic water splitting | Kilic, Mehmet Emin; Lee, Kwang-Ryeol |
| 2012-01 | Prediction of elastic properties of precipitation-hardened aluminum cast alloys | Suh, Jin-Yoo; Lee, Young-Su; Shim, Jae-Hyeok; Park, Hoon Mo |
| 2021-02-01 | Role of Fe doping on surface morphology, electronic structure and magnetic properties of Fe doped CeO2 thin film | Kumar, Shalendra; Alharthi, Fahad A.; El Marghany, Adel; Ahmed, Faheem; Ahmad, Naushad; Chae, K. H.; Kumari, Kavita |
| 2017-04 | Role of Heteronuclear Interactions in Selective H-2 Formation from HCOOH Decomposition on Bimetallic Pd/M (M = Late Transition FCC Metal) Catalysts | Cho, Jinwon; Lee, Sangheon; Yoon, Sung Pil; Han, Jonghee; Nam, Suk Woo; Lee, Kwan-Young; Ham, Hyung Chul |
| 2020-04 | Superionic Halogen-Rich Li-Argyrodites Using In Situ Nanocrystal Nucleation and Rapid Crystal Growth | Jung, Wo Dum; Kim, Ji-Su; Choi, Sungjun; Kim, Seongmin; Jeon, Minjae; Jung, Hun-Gi; Chung, Kyung Yoon; Lee, Jong-Ho; Kim, Byung-Kook; Lee, Jong-Heun; Kim, Hyoungchul |
| 2014-04 | The Role of Intrinsic Defects in Methylammonium Lead Iodide Perovskite | Kim, Jongseob; Lee, Sung-Hoon; Lee, Jung Hoon; Hong, Ki-Ha |
| 2015-12-22 | Theoretical Evidence for Low Charging Overpotentials of Superoxide Discharge Products in Metal-Oxygen Batteries | Lee, Byungju; Kim, Jinsoo; Yoon, Gabin; Lim, Hee-Dae; Choi, In-Suk; Kang, Kisuk |
| 2023-03 | Theoretical prediction of the electronic structure, optical properties and photocatalytic performance of type-I SiS/GeC and type-II SiS/ZnO heterostructures | Ullah, S. S.; Din, H. U.; Ahmad, Sheraz; Alam, Q.; Sardar, S.; Amin, B.; Farooq, M.; Nguyen, Cuong Q.; Nguyen, Chuong V. |
| 2018-09 | Thermally Induced S-Sublattice Transition of Li3PS4 for Fast Lithium-Ion Conduction | Kim, Ji-Su; Jung, Wo Dum; Choi, Sungjun; Son, Ji-Won; Kim, Byung-Kook; Lee, Jong-Ho; Kim, Hyoungchul |
| 2019-10-09 | Thermodynamic Assessment of Coating Materials for Solid-State Li, Na, and K Batteries | Yu, Seungho; Park, Haesun; Siegel, Donald J. |
| 2013-10 | Thermodynamic stability of various phases of zinc tin oxides from ab initio calculations | Lee, Joohwi; Lee, Seung-Cheol; Hwang, Cheol Seong; Choi, Jung-Hae |
