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민승규
Min, Seung Kyu

민승규

Department of Chemistry(화학과)

  • Theoretical/Computational Chemistry Group for Excited State Phenomena
  • Website
Research Interests
Excited state dynamics;photosynthesis;solarcell;Light-driven molecular machine;들뜬 상태 동역학;광합성;태양전지;광유도 분자 기계 소자
Lab Description
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?
So far we have achieved several things. First, we have developed a novel efficient numerical algorithm for excited state dynamics with multiple "interacting" classical trajectories. This original method outperforms the conventional approaches in a sense that it can describe the exact nuclear dynamics in the excited states as well as the correct electronic dynamics. Currently we focus on understanding chemical dynamics on excited states (such as photosynthesis and vision process) and designing novel molecular functional devices based on our approach.
Researcher ID Research Gate ORCiD Scopus Google Scholar
Previous
Unveiling Energy Transfer Mechanisms in Nanographene-Incorporated Metal-Organic Frameworks File

Lee, Junghye , Hwang, Eunhye , Kim, Tae In , Jin, Eunji , Cho, Eunchan , Park, Young S. , Min, Seung Kyu , Kwon, Tae-Hyuk , Choe, Wonyoung

Article Issue Date2024-04 View8
Gaussian Process Regression-Based Near-Infrared d-Luciferin Analogue Design Using Mutation-Controlled Graph-Based Genetic Algorithm File

Moon, Sung Wook , Min, Seung Kyu

Article Issue Date2024-03 View14
Extension of molecules with an inverted singlet-triplet gap with conjugated branches to alter the oscillator strength File

Kim, Hwon , Scholes, Gregory D. , Min, Seung Kyu

Article Issue Date2024-02 View13
Multivariate Metal–Organic Frameworks Ranging from a Homogeneous Uniform Distribution to Heterogeneous 1D, 2D, and 3D Distributions of Mixed Building Blocks File

Seong, Junmo , Jeong, Seok , Moon, Sung Wook , Lee, Seonghwan , Lim, Jaewoong , Sharma, Amitosh , Won, Somi , Baek, Seung Bin , Min, Seung Kyu , Lah, Myoung Soo

Article Issue Date2024-01 View11
Origamic metal-organic framework toward mechanical metamaterial File File

Jin, Eunji , Lee, In Seong , Yang, ChangMo D , Moon, Dohyun , Nam, Joohan , Cho, Hyeonsoo , Kang, Eunyoung , Lee, Junghye , Noh, Hyuk-Jun , Min, Seung Kyu , et al

Article Issue Date2023-12 View13
Symmetry-Mismatched SBU Transformation in MOFs: Postsynthetic Metal Exchange from Zn to Fe and Its Effects on Gas Adsorption and Dye Selectivity File

Han, Seungwan , Kim, Dongwook , Lee, Seonghwan , Choi, Hyunkyung , Moon, Sung Wook , Sharma, Amitosh , Seong, Junmo , Lim, Jaewoong , Jeong, Seok , Baek, Seung Bin , et al

Article Issue Date2023-10 View10
Real-Space and Real-Time Propagation for Correlated Electron-Nuclear Dynamics Based on Exact Factorization File

Han, Daeho , Ha, Jong-Kwon , Min, Seung Kyu

Article Issue Date2023-04 View12
Calculation of exciton couplings based on density functional tight-binding coupled to state-interaction state-averaged ensemble-referenced Kohn-Sham approach File

Kim, Tae In , Lee, In Seong , Kim, Hwon , Min, Seung Kyu

Article Issue Date2023-01 View9
Silver sulfide nanocrystals as a biocompatible and full-spectrum photocatalyst for efficient light-driven polymerization under aqueous and ambient conditions File

Yu, Changhoon , Song, Jaejung , Kim, Tae In , Lee, Yungyeong , Kwon, Yonghwan , Kim, Jongkyoung , Park, Jeehun , Choi, Jinho , Doh, Junsang , Min, Seung Kyu , et al

Article Issue Date2023-01 View7
Atomic transistors based on seamless lateral metal-semiconductor junctions with a sub-1-nm transfer length File File

Song, Seunguk , Yoon, Aram , Ha, Jong-Kwon , Yang, Jihoon , Jang, Sora , Leblanc, Chloe , Wang, Jaewon , Sim, Yeoseon , Jariwala, Deep , Min, Seung Kyu , et al

Article Issue Date2022-08 View14
Generalized Formulation of the Density Functional Tight Binding-Based Restricted Ensemble Kohn-Sham Method with Onsite Correction to Long-Range Correction File

Lee, In Seong , Min, Seung Kyu

Article Issue Date2022-06 View7
Independent trajectory mixed quantum-classical approaches based on the exact factorization File

Ha, Jong-Kwon , Min, Seung Kyu

Article Issue Date2022-05 View11
Singlet Oxygen Generation from Polyaminoglycerol by Spin-Flip-Based Electron Transfer File File

Nam, Jung Seung , Hong, Youngjoo , Lee, Chae Gyu , Kim, Tae In , Lee, Chaiheon , Roh, Deok-Ho , Lee, In Seong , Kweon, Songa , Ahn, Gyunhyeok , Min, Seung Kyu , et al

Article Issue Date2022-04 View15
Coupled- and Independent-Trajectory Approaches Based on the Exact Factorization Using the PyUNIxMD Package File

Kim, Tae In , Ha, Jong-Kwon , Min, Seung Kyu

Article Issue Date2022-02 View6
Spatial distribution modulation of mixed building blocks in metal-organic frameworks File File

Jeong, Seok , Seong, Junmo , Moon, Sung Wook , Lim, Jaewoong , Baek, Seung Bin , Min, Seung Kyu , Lah, Myoung Soo

Article Issue Date2022-02 View6
Proton affinity and gas phase basicity of diamandoid molecules: diamantane to C131H116 File

Camacho-Mojica, Dulce C. , Ha, Jong-Kwon , Min, Seung Kyu , Vianello, Robert , Ruoff, Rodney S.

Article Issue Date2022-01 View12
Electrochemical Formation of a Covalent-Ionic Stage-1 Graphite Intercalation Compound with Trifluoroacetic Acid File

Gurzeda, Bartosz , Kim, Tae In , Arsakay, Madi , Choe, Myeonggi , Lee, Sun Hwa , Lee, Zonghoon , Min, Seung Kyu , Ruoff, Rodney S.

Article Issue Date2022-01 View14
PyUNIxMD: A Python-based excited state molecular dynamics package File

Lee, In Seong , Ha, Jong-Kwon , Han, Daeho , Kim, Tae In , Moon, Sung Wook , Min, Seung Kyu

Article Issue Date2021-09 View14
Study of the Decoherence Correction Derived from the Exact Factorization Approach for Nonadiabatic Dynamics File File

Vindel-Zandbergen, Patricia , Ibele, Lea M. , Ha, Jong-Kwon , Min, Seung Kyu , Curchod, Basile F. E. , Maitra, Neepa T.

Article Issue Date2021-07 View15
pH-Responsive Amphiphilic Polyether Micelles with Superior Stability for Smart Drug Delivery File

Son, Iloh , Lee, Yujin , Baek, Jinsu , Park, Miran , Han, Daeho , Min, Seung Kyu , Lee, Dongwon , Kim, Byeong-Su

Article Issue Date2021-05 View15
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