| 2016-08-31 | A comparative first-principles study of the lithiation, sodiation, and magnesiation of black phosphorus for Li-, Na-, and Mg-ion batteries | Hembram, K. P. S. S.; Jung, Hyun; Yeo, Byung Chul; Pai, Sung Jin; Lee, Heon Ju; Lee, Kwang-Ryeol; Han, Sang Soo |
| 2016-05-23 | Adsorption of Carbon Dioxide on Unsaturated Metal Sites in M-2(dobpdc) Frameworks with Exceptional Structural Stability and Relation between Lewis Acidity and Adsorption Enthalpy | Yoo, Ga Young; Lee, Woo Ram; Jo, Hyuna; Park, Joonho; Song, Jeong Hwa; Lim, Kwang Soo; Moon, Dohyun; Jung, Hyun; Lim, Juhyung; Han, Sang Soo; Jung, Yousung; Hong, Chang Seop |
| 2015-02-19 | Atomistic Observation of the Lithiation and Delithiation Behaviors of Silicon Nanowires Using Reactive Molecular Dynamics Simulations | Jung, Hyun; Lee, Minho; Yeo, Byung Chul; Lee, Kwang-Ryeol; Han, Sang Soo |
| 2017-10-26 | Atomistic Simulation Protocol for Improved Design of Si-O-C Hybrid Nanostructures as Li-Ion Battery Anodes: ReaxFF Reactive Force Field | Yeo, Byung Chul; Jung, Hyun; Lee, Hong Woo; Yun, Kang-Seop; Kim, Hyungjun; Lee, Kwang-Ryeol; Han, Sang Soo |
| 2018-09-13 | Atomistic Sodiation Mechanism of a Phosphorene/Graphene Heterostructure for Sodium-Ion Batteries Determined by First-Principles Calculations | Lee, Hong Woo; Jung, Hyun; Yeo, Byung Chul; Kim, Donghun; Han, Sang Soo |
| 2016-12 | Atomistics of the lithiation of oxidized silicon (SiOx) nanowires in reactive molecular dynamics simulations | Jung, Hyun; Yeo, Byung Chul; Lee, Kwang-Ryeol; Han, Sang Soo |
| 2017-02-08 | Fine-Tuning of the Carbon Dioxide Capture Capability of Diamine-Grafted Metal-Organic Framework Adsorbents Through Amine Functionalization | Jo, Hyuna; Lee, Woo Ram; Kim, Nam Woo; Jung, Hyun; Lim, Kwang Soo; Kim, Jeong Eun; Kang, Dong Won; Lee, Hanyeong; Hiremath, Vishwanath; Seo, Jeong Gil; Jin, Hailian; Moon, Dohyun; Han, Sang Soo; Hong, Chang Seop |
| 2015-07-09 | Unraveling the Atomistic Sodiation Mechanism of Black Phosphorus for Sodium Ion Batteries by First-Principles Calculations | Hembrarn, K. P. S. S.; Jung, Hyun; Yeo, Byung Chul; Pai, Sung Jin; Kim, Seungchul; Lee, Kwang-Ryeol; Han, Sang Soo |
