Faculty Research Profile
Seung Kyu Min
학력
2005~2011: Ph. D. Physical Chemistry, Pohang University of Science and Technology
2005: B. S. Chemistry, Pohang University of Science and Technology
주요 경력
2020 ~ present: Associate Professor
2015 ~ 2020: Assistant Professor
2013~2015: Max Planck Institute of Mirostructure Physics, Halle, Germany, Post-doctoral Research Associate
2011~2013: Pohang University of
Science and Technology (POSTECH), Post-doctoral Research Associate
수상/학회/외부활동
Best Thesis award in Department of Chemistry, Pohang University of Science and Technology (2011)
Young Scientist Award, (ME&D Young Soo Kwon Award) (2011)
들뜬 상태 현상 이론/전산화학 연구실
Theoretical/Computational Chemistry Group for Excited State Phenomena
The electron-nuclear correlation plays a major role in dynamial processes like a chemical reaction with an extra energy and the light-matter interaction. Such cases are called as excited state phenomena which are actually ubiquitous in nature like vision process and photosynthesis. In our research group, we are interested in the theoretical/computational description of excited state phenomena and its applications with following questions:
(a) How can we describe correlated electron-nuclear motions correctly?
(b) How can we deal with chemical reactions in the excited states theoretically?
(c) Based on our knowledge, how can we design functional molecular devices such as energy materials, nano-electronic/photonic devices?
The electron-nuclear correlation plays a major role in dynamial processes like a chemical reaction with an extra energy and the light-matter interaction. Such cases are called as excited state phenomena which are actually ubiquitous in nature like vision process and photosynthesis. In our research group, we are interested in the theoretical/computational description of excited state phenomena and its applications with following questions:
(a) How can we describe correlated electron-nuclear motions correctly?
(b) How can we deal with chemical reactions in the excited states theoretically?
(c) Based on our knowledge, how can we design functional molecular devices such as energy materials, nano-electronic/photonic devices?
연구분야
quantum chemistry, excited state, molecular dynamics, photochemistry, machine learning
quantum chemistry, excited state, molecular dynamics, photochemistry, machine learning
연구 희망분야
optomechanical molecular machine, display, large-scale atomistic simulations
optomechanical molecular machine, display, large-scale atomistic simulations
연구주제
들뜬 상태 동역학, 광합성, 태양전지, 광유도 분자 기계 소자
Excited State Dynamics, Photosynthesis, Solarcell, Light-driven molecular machine
• 새로운 들뜬 상태 동역학 알고리즘 개발 / Development of an algorithm for excited state molecular dynamics
• 효율적인 들뜬 상태 양자 계산법 개발 / Development of an efficient method for excited state electronic structure calculations
• Description of chemical reactions with conical intersections/Conical intersection을 포함하는 화학 반응 묘사
• 다양한 기능성을 가지는 분자 소자 개발 / Design for multi-functional devices
• 기계학습 기반 양자 계산 / Machine learning-based quantum chemical calculation
Excited State Dynamics, Photosynthesis, Solarcell, Light-driven molecular machine
• Development of an algorithm for excited state molecular dynamics
• Development of an efficient method for excited state electronic structure calculations
• Description of chemical reactions with conical intersections/Conical intersection
• Design for multi-functional devices
• Machine learning-based quantum chemical calculation
국가연구개발사업 기술 분류체계
국가과학기술표준분류
NC. 화학 > NC01. 물리화학 > NC0102. 양자화학/전산화학
논문
• Jong-Kwon Ha, In Seong Lee, Seung Kyu Min*, "Surface Hopping Dynamics beyond Nonadiabatic Couplings for Quantum Coherence" J. Phys. Chem. Lett., 9, 1097 (2018)
• Seung Kyu Min*, Federica Agostini, Ivano Tavernelli, E. K. U. Gross, "Ab Initio Nonadiabatic
Dynamics with Coupled Trajectories: A Rigorous Approach to Quantum (De)Coherence" J.
Phys. Chem. Lett., 8, 3048 (2017)
• Seung Kyu Min*, Federica Agostini, E. K. U. Gross, "Coupled-trajectory quantum-classical
approach to electronic decoherence in nonadiabatic processes" Phys. Rev. Lett., 115,
073001 (2015)