Ambient carbon dioxide capture by boron-rich boron nitride nanotube H Choi, YC Park, YH Kim, YS Lee Journal of the American Chemical Society 133 (7), 2084-2087, 2011 | 169 | 2011 |
Accurate ab initio binding energies of the benzene dimer YC Park, JS Lee The Journal of Physical Chemistry A 110 (15), 5091-5095, 2006 | 140 | 2006 |
Equation of motion coupled-cluster for core excitation spectra: Two complementary approaches YC Park, A Perera, RJ Bartlett The Journal of chemical physics 151 (16), 2019 | 44 | 2019 |
Electrochemical ammonia synthesis mediated by titanocene dichloride in aqueous electrolytes under ambient conditions EY Jeong, CY Yoo, CH Jung, JH Park, YC Park, JN Kim, SG Oh, Y Woo, ... ACS Sustainable Chemistry & Engineering 5 (11), 9662-9666, 2017 | 43 | 2017 |
Two-component spin-orbit effective core potential calculations with an all-electron relativistic program DIRAC YC Park, IS Lim, YS Lee Bulletin of the Korean Chemical Society 33 (3), 803-808, 2012 | 37 | 2012 |
Spin–orbit coupling and electron correlation in relativistic configuration interaction and coupled-cluster methods I Kim, YC Park, H Kim, YS Lee Chemical Physics 395, 115-121, 2012 | 33 | 2012 |
On the relation between adiabatic time dependent density functional theory (TDDFT) and the ΔSCF-DFT method. Introducing a numerically stable ΔSCF-DFT scheme for local … YC Park, M Krykunov, T Ziegler Molecular Physics 113 (13-14), 1636-1647, 2015 | 31 | 2015 |
Rapid dye regeneration mechanism of dye-sensitized solar cells J Jeon, YC Park, SS Han, WA Goddard III, YS Lee, H Kim The journal of physical chemistry letters 5 (24), 4285-4290, 2014 | 30 | 2014 |
Nuclear motion captured by the slow electron velocity imaging technique in the tunnelling predissociation of the S1 methylamine DS Ahn, J Lee, Y Choon Park, Y Sup Lee, S Kyu Kim The Journal of Chemical Physics 136 (2), 2012 | 23 | 2012 |
Equation of motion coupled-cluster study of core excitation spectra II: Beyond the dipole approximation YC Park, A Perera, RJ Bartlett The Journal of Chemical Physics 155 (9), 2021 | 22 | 2021 |
MP2 basis set limit binding energy estimates of hydrogen-bonded complexes from extrapolation-oriented basis sets YC Park, JS Lee BULLETIN-KOREAN CHEMICAL SOCIETY 28 (3), 386, 2007 | 22 | 2007 |
Solid‐State Molecular Motions in Organic THz Generators J Kim, YC Park, JH Seok, M Jazbinsek, OP Kwon Advanced Optical Materials 9 (4), 2001521, 2021 | 17 | 2021 |
Index of multi-determinantal and multi-reference character in coupled-cluster theory RJ Bartlett, YC Park, NP Bauman, A Melnichuk, D Ranasinghe, M Ravi, ... The Journal of Chemical Physics 153 (23), 2020 | 17 | 2020 |
Low scaling EOM-CCSD and EOM-MBPT (2) method with natural transition orbitals YC Park, A Perera, RJ Bartlett The Journal of Chemical Physics 149 (18), 2018 | 17 | 2018 |
Binding energies of hydrogen-bonded clusters from extrapolation-oriented basis sets R Hwang, YC Park, JS Lee Theoretical Chemistry Accounts 115, 54-58, 2006 | 17 | 2006 |
Constricted Variational Density Functional Theory Approach to the Description of Excited States T Ziegler, M Krykunov, I Seidu, YC Park Density-Functional Methods for Excited States, 61-95, 2016 | 16 | 2016 |
First-Principles Calculation of Terahertz Absorption with Dispersion Correction of 2, 2′-Bithiophene as Model Compound J Kim, OP Kwon, M Jazbinsek, YC Park, YS Lee The Journal of Physical Chemistry C 119 (22), 12598-12607, 2015 | 15 | 2015 |
Self-consistent constricted variational theory RSCF-CV (∞)-DFT and its restrictions to obtain a numerically stable ΔSCF-DFT-like method: Theory and calculations for triplet states YC Park, F Senn, M Krykunov, T Ziegler Journal of chemical theory and computation 12 (11), 5438-5452, 2016 | 14 | 2016 |
Theoretical study of the extremely small torsional barriers of thiophenol in the ground and the first excited electronic states H Choi, YC Park, YS Lee, H An, KK Baeck Chemical Physics Letters 580, 32-36, 2013 | 12 | 2013 |
The intermediate state approach for doubly excited dark states in EOM-coupled-cluster theory M Ravi, Y Park, A Perera, RJ Bartlett The Journal of Chemical Physics 156 (20), 201102, 2022 | 10 | 2022 |