Seunghoon Lee

Publication Activity (10 Years)

Years Active: 2019-2024
Publications (10 Years): 24

Top Topics

Density Functional Theory

Electron Transfer

Perovskite Solar Cells

Top Venues

The journal of physical chemistry letters

Journal of chemical theory and computation

The journal of physical chemistry. A

The Journal of chemical physics

This page only lists publications with an associated author ORCID identifier.

Publications

Woojin Park, Alireza Lashkaripour, Konstantin Komarov, Seunghoon Lee, Miquel Huix-Rotllant, Cheol-Ho Choi
Toward Consistent Predictions of Core/Valence Ionization Potentials and Valence Excitation Energies by MRSF-TDDFT. Journal of chemical theory and computation (2024)
Woojin Park, Alireza Lashkaripour, Konstantin Komarov, Seunghoon Lee, Miquel Huix-Rotllant, Cheol-Ho Choi
Toward Consistent Predictions of Core/Valence Ionization Potentials and Valence Excitation Energies by MRSF-TDDFT. Journal of chemical theory and computation 20 (13) (2024)
Maryam Farmani, Seunghoon Lee, Tao Zeng, Cheol-Ho Choi
Chemoexcited Formation and Radiationless Decay Dynamics of Firefly Chromophore. The journal of physical chemistry letters (2024)
Woojin Park, Konstantin Komarov, Seunghoon Lee, Cheol-Ho Choi
Mixed-Reference Spin-Flip Time-Dependent Density Functional Theory: Multireference Advantages with the Practicality of Linear Response Theory. The journal of physical chemistry letters (2023)
Konstantin Komarov, Vladimir Mironov, Seunghoon Lee, Buu Q Pham, Mark S Gordon, Cheol-Ho Choi
High-performance strategies for the recent MRSF-TDDFT in GAMESS. The Journal of chemical physics 158 (19) (2023)
Seunghoon Lee, Joonho Lee, Huanchen Zhai, Yu Tong, Alexander M Dalzell, Ashutosh Kumar, Phillip Helms, Johnnie Gray, Zhi-Hao Cui, Wenyuan Liu, Michael Kastoryano, Ryan Babbush, John Preskill, David R Reichman, Earl T Campbell, Edward F Valeev, Lin Lin, Garnet Kin-Lic Chan
Evaluating the evidence for exponential quantum advantage in ground-state quantum chemistry. Nature communications 14 (1) (2023)
Saima Sadiq, Woojin Park, Vladimir Mironov, Seunghoon Lee, Michael Filatov Gulak, Cheol-Ho Choi
Prototropically Controlled Dynamics of Cytosine Photodecay. The journal of physical chemistry letters 14 (3) (2023)
Seunghoon Lee, Huanchen Zhai, Garnet Kin-Lic Chan
An Ab Initio Correction Vector Restricted Active Space Approach to the L-Edge XAS and 2p3d RIXS Spectra of Transition Metal Complexes. Journal of chemical theory and computation (2023)
Konstantin Komarov, Woojin Park, Seunghoon Lee, Miquel Huix-Rotllant, Cheol-Ho Choi
Doubly Tuned Exchange-Correlation Functionals for Mixed-Reference Spin-Flip Time-Dependent Density Functional Theory. Journal of chemical theory and computation (2023)
Saima Sadiq, Woojin Park, Vladimir Mironov, Seunghoon Lee, Michael Filatov Gulak, Cheol-Ho Choi
Prototropically Controlled Dynamics of Cytosine Photodecay. The journal of physical chemistry letters (2023)
Huanchen Zhai, Seunghoon Lee, Zhi-Hao Cui, Lili Cao, Ulf Ryde, Garnet Kin-Lic Chan
Multireference Protonation Energetics of a Dimeric Model of Nitrogenase Iron-Sulfur Clusters. The journal of physical chemistry. A (2023)
Woojin Park, Marc Alías-Rodríguez, Daeheum Cho, Seunghoon Lee, Miquel Huix-Rotllant, Cheol-Ho Choi
Mixed-Reference Spin-Flip Time-Dependent Density Functional Theory for Accurate X-ray Absorption Spectroscopy. Journal of chemical theory and computation 18 (10) (2022)
Woojin Park, Michael Filatov Gulak, Saima Sadiq, Igor Gerasimov, Seunghoon Lee, Taiha Joo, Cheol-Ho Choi
A Plausible Mechanism of Uracil Photohydration Involves an Unusual Intermediate. The journal of physical chemistry letters 13 (30) (2022)
Yong Su Baek, Seunghoon Lee, Michael Filatov Gulak, Cheol-Ho Choi
Optimization of Three State Conical Intersections by Adaptive Penalty Function Algorithm in Connection with the Mixed-Reference Spin-Flip Time-Dependent Density Functional Theory Method (MRSF-TDDFT). The journal of physical chemistry. A 125 (9) (2021)
Woojin Park, Jun Shen, Seunghoon Lee, Piotr Piecuch, Michael Filatov Gulak, Cheol-Ho Choi
Internal Conversion between Bright (11Bu+) and Dark (21Ag-) States in s-trans-Butadiene and s-trans-Hexatriene. The journal of physical chemistry letters 12 (39) (2021)
Vladimir A Pomogaev, Seunghoon Lee, Sason Shaik, Michael Filatov Gulak, Cheol-Ho Choi
Exploring Dyson's Orbitals and Their Electron Binding Energies for Conceptualizing Excited States from Response Methodology. The journal of physical chemistry letters 12 (40) (2021)
Seunghoon Lee, Yevhen Horbatenko, Michael Filatov Gulak, Cheol-Ho Choi
Fast and Accurate Computation of Nonadiabatic Coupling Matrix Elements Using the Truncated Leibniz Formula and Mixed-Reference Spin-Flip Time-Dependent Density Functional Theory. The journal of physical chemistry letters 12 (19) (2021)
Michael Filatov Gulak, Seunghoon Lee, Cheol-Ho Choi
Description of Sudden Polarization in the Excited Electronic States with an Ensemble Density Functional Theory Method. Journal of chemical theory and computation 17 (8) (2021)
Seunghoon Lee, Huanchen Zhai, Sandeep Sharma, C J Umrigar, Garnet Kin-Lic Chan
Externally Corrected CCSD with Renormalized Perturbative Triples (R-ecCCSD(T)) and the Density Matrix Renormalization Group and Selected Configuration Interaction External Sources. Journal of chemical theory and computation 17 (6) (2021)
Woojin Park, Seunghoon Lee, Miquel Huix-Rotllant, Michael Filatov Gulak, Cheol-Ho Choi
Impact of the Dynamic Electron Correlation on the Unusually Long Excited-State Lifetime of Thymine. The journal of physical chemistry letters 12 (18) (2021)
Michael Filatov Gulak, Seunghoon Lee, Hiroya Nakata, Cheol-Ho Choi
Signatures of Conical Intersection Dynamics in the Time-Resolved Photoelectron Spectrum of Furan: Theoretical Modeling with an Ensemble Density Functional Theory Method. International journal of molecular sciences 22 (8) (2021)
Ekadashi Pradhan, Seunghoon Lee, Cheol-Ho Choi, Tao Zeng
Diboron- and Diaza-Doped Anthracenes and Phenanthrenes: Their Electronic Structures for Being Singlet Fission Chromophores. The journal of physical chemistry. A 124 (40) (2020)
Janus J Eriksen, Tyler A Anderson, J Emiliano Deustua, Khaldoon Ghanem, Diptarka Hait, Mark R Hoffmann, Seunghoon Lee, Daniel S Levine, Ilias Magoulas, Jun Shen, Norman M Tubman, K Birgitta Whaley, Enhua Xu, Yuan Yao, Ning Zhang, Ali Alavi, Garnet Kin-Lic Chan, Martin Head-Gordon, Wenjian Liu, Piotr Piecuch, Sandeep Sharma, Seiichiro L Ten-No, C J Umrigar, Jürgen Gauss
The Ground State Electronic Energy of Benzene. The journal of physical chemistry letters 11 (20) (2020)
Yevhen Horbatenko, Seunghoon Lee, Michael Filatov Gulak, Cheol-Ho Choi
Performance Analysis and Optimization of Mixed-Reference Spin-Flip Time-Dependent Density Functional Theory (MRSF-TDDFT) for Vertical Excitation Energies and Singlet-Triplet Energy Gaps. The journal of physical chemistry. A 123 (37) (2019)