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The Journal of Physical Chemistry Letters|January 18, 2023
Prototropically Controlled Dynamics of Cytosine PhotodecaySaima Sadiq, Woojin Park, Vladimir Mironov, et al.Photochemical & Photobiological Sciences : Official Journal of the European Photochemistry Association and the European Society for Photobiology|February 16, 2026
Impact of solvation on the photoisomerization mechanism of oxindole switches with electron-donating substituentsMiquel Huix-Rotllant, Abdul Qadeer, Daniel Roca-Sanjuán, et al.Journal of Chemical Theory and Computation|November 20, 2015
Analytic Gradient for Density Functional Theory Based on the Fragment Molecular Orbital MethodKurt R Brorsen, Federico Zahariev, Hiroya Nakata, et al.The Journal of Chemical Physics|April 17, 2014
Unrestricted density functional theory based on the fragment molecular orbital method for the ground and excited state calculations of large systemsHiroya Nakata, Dmitri G Fedorov, Satoshi Yokojima, et al.The Journal of Chemical Physics|May 3, 2013
Analytic second derivatives of the energy in the fragment molecular orbital methodHiroya Nakata, Takeshi Nagata, Dmitri G Fedorov, et al.Physical Chemistry Chemical Physics : PCCP|July 11, 2017
Coherent intermolecular proton transfer in the acid-base reaction of excited state pyranineWooseok Heo, Nizam Uddin, Jae Woo Park, et al.Journal of Computational Chemistry|April 22, 2025
Assessment of Free Energies From Electrostatic Embedding Density Functional Tight Binding-Based/Molecular Mechanics in Periodic Boundary ConditionsSimone Bonfrate, Woojin Park, Dulce Trejo-Zamora, et al.The Journal of Physical Chemistry Letters|March 24, 2026
Complex and Unusual Excited-State Relaxation Dynamics of 9,9'-Bifluorenylidene Revealed by Comprehensive Time-Resolved Spectroscopy and MRSF-TDDFT CalculationsChen Wang, Woojin Park, Cheol Ho Choi, et al.Journal of Chemical Theory and Computation|September 27, 2022
Mixed-Reference Spin-Flip Time-Dependent Density Functional Theory for Accurate X-ray Absorption SpectroscopyWoojin Park, Marc Alías-Rodríguez, Daeheum Cho, et al.The Journal of Chemical Physics|May 15, 2023
High-performance strategies for the recent MRSF-TDDFT in GAMESSKonstantin Komarov, Vladimir Mironov, Seunghoon Lee, et al.Pageof 14