| A structural remedy toward bright dipolar fluorophores in aqueous media S Singha, D Kim, B Roy, S Sambasivan, H Moon, AS Rao, JY Kim, T Joo, ... Chemical science 6 (7), 4335-4342, 2015 | 159 | 2015 |
| On-the-fly CASPT2 surface-hopping dynamics JW Park, T Shiozaki Journal of chemical theory and computation 13 (8), 3676-3683, 2017 | 141 | 2017 |
| Analytical derivative coupling for multistate CASPT2 theory JW Park, T Shiozaki Journal of chemical theory and computation 13 (6), 2561-2570, 2017 | 138 | 2017 |
| Multireference electron correlation methods: Journeys along potential energy surfaces JW Park, R Al-Saadon, MK MacLeod, T Shiozaki, B Vlaisavljevich Chemical Reviews 120 (13), 5878-5909, 2020 | 126 | 2020 |
| Electric field keeps chromophore planar and produces high yield fluorescence in green fluorescent protein JW Park, YM Rhee Journal of the American Chemical Society 138 (41), 13619-13629, 2016 | 85 | 2016 |
| All-atom semiclassical dynamics study of quantum coherence in photosynthetic Fenna–Matthews–Olson complex HW Kim, A Kelly, JW Park, YM Rhee Journal of the American Chemical Society 134 (28), 11640-11651, 2012 | 81 | 2012 |
| Experimental and theoretical determination of the accurate CH/π interaction energies in benzene–alkane clusters: correlation between interaction energy and polarizability A Fujii, H Hayashi, T Kazama, N Mikami, S Tsuzuki Physical Chemistry Chemical Physics 13 (31), 14131-14141, 2011 | 59 | 2011 |
| Molecular-shape-dependent luminescent behavior of dye aggregates: bent versus linear benzocoumarins H Moon, QP Xuan, D Kim, Y Kim, JW Park, CH Lee, HJ Kim, A Kawamata, ... Crystal growth & design 14 (12), 6613-6619, 2014 | 42 | 2014 |
| Imaginary shift in CASPT2 nuclear gradient and derivative coupling theory JW Park, R Al-Saadon, NE Strand, T Shiozaki Journal of Chemical Theory and Computation 15 (7), 4088-4098, 2019 | 38 | 2019 |
| Effect of chromophore potential model on the description of exciton–phonon interactions CW Kim, JW Park, YM Rhee The Journal of Physical Chemistry Letters 6 (15), 2875-2880, 2015 | 34 | 2015 |
| Emission shaping in fluorescent proteins: role of electrostatics and π-stacking JW Park, YM Rhee Physical Chemistry Chemical Physics 18 (5), 3944-3955, 2016 | 30 | 2016 |
| Analytical Gradient Theory for Quasidegenerate N-Electron Valence State Perturbation Theory (QD-NEVPT2) JW Park Journal of chemical theory and computation 16 (1), 326-339, 2019 | 29 | 2019 |
| Single-state single-reference and multistate multireference zeroth-order Hamiltonians in MS-CASPT2 and conical intersections JW Park Journal of chemical theory and computation 15 (7), 3960-3973, 2019 | 28 | 2019 |
| Condensed phase molecular dynamics using interpolated potential energy surfaces with application to the resolvation process of coumarin 153 JW Park, HW Kim, C Song, YM Rhee The Journal of chemical physics 135 (1), 2011 | 27 | 2011 |
| Analytical Gradient Theory for Strongly Contracted (SC) and Partially Contracted (PC) N-Electron Valence State Perturbation Theory (NEVPT2) JW Park Journal of Chemical Theory and Computation 15 (10), 5417-5425, 2019 | 26 | 2019 |
| On the accuracy of retinal protonated Schiff base models JW Park, T Shiozaki Molecular Physics 116 (19-20), 2583-2590, 2018 | 25 | 2018 |
| Coherent intermolecular proton transfer in the acid–base reaction of excited state pyranine W Heo, N Uddin, JW Park, YM Rhee, CH Choi, T Joo Physical Chemistry Chemical Physics 19 (28), 18243-18251, 2017 | 24 | 2017 |
| Interpolated Mechanics–Molecular Mechanics Study of Internal Rotation Dynamics of the Chromophore Unit in Blue Fluorescent Protein and Its Variants JW Park, YM Rhee The Journal of Physical Chemistry B 116, 11137, 2012 | 21 | 2012 |
| Second-order orbital optimization with large active spaces using adaptive sampling configuration interaction (ASCI) and its application to molecular geometry optimization JW Park Journal of Chemical Theory and Computation 17 (3), 1522-1534, 2021 | 18 | 2021 |
| Towards the realization of ab initio dynamics at the speed of molecular mechanics: simulations with interpolated diabatic Hamiltonian JW Park, YM Rhee ChemPhysChem 15 (15), 3183-3193, 2014 | 14 | 2014 |