We are a computational chemistry group at KAIST that focuses on solving some of today's most important energy and environmental related problems.  We aim to develop accurate and efficient models to create, in silico, materials that can be used for wide range of applications such as carbon capture, methane/hydrogen storage, and batteries.   Finally, we are not afraid to use concepts from many other disciplines (e.g. computer sciences, artificial intelligence, music, graphics) to develop unique solutions that can differentiate our group.   

3/2026:  We warmly welcome Hyunjung Kho(고현정) and Jihoon Chae(채지훈) to our lab as M.S. students and Kyungmin Nam(남경민) as Ph.D. student. Glad to have you on board.

2/2026:  We are delighted to announce that Jung Hee Woo(우준희) and Jaewoong Lee(이재웅) has joined Prof. Dong-Hwa Seo's lab at KAIST. Thank you for your hard work and congratulations!

2/2026:  We are delighted to announce that Huiwon Jang(장희원) has joined Prof. Heather Kulik's lab at MIT. Thank you for your hard work and congratulations!

2/2026:  We are delighted to announce that Honghui Kim(김홍희) has joined Prof. Sungsoo Ahn's lab at KAIST. Thank you for your hard work and congratulations!

1/2026:  We are delighted to announce that Yeonghun Kang(강영훈) has joined Sungkyunkwan University as an assistant professor. Congratulations on his achievement!

9/2025:  We are delighted to announce Yunsung Lim(임윤성) has joined Prof. Seungwoo Han's lab at Seoul National University as a Postdoctoral Researcher. Thank you for your hard work and congratulations!

7/2025:  We are proud to share that Shinyoung Kang(강신영) won the Best Poster Award at the 21st KIAS Electronic Structure Calculation Workshop. Well done and congratulations!

6/2025:  We are delighted to announce that Shinyoung Kang(강신영) received the Excellent Paper Presentation Award at the 2025 KSIEC Spring Meeting and International Conference. Congratulations on this outstanding achievement!

3/2025:  We warmly welcome Seungwoo Kim(김승우) and Eugene Paek(백유진) to our lab as M.S. students. Glad to have you on board. 

1/2025:  We are proud to announce that Jaewoong(이재웅) and Jun Hee(우준희) have won the Bronze Award in the Energy & Environment category at the Samsung HumanTech Paper Award. Congratulations on their hard work and achievement!