Classical trajectory simulations of post-transition state dynamics U Lourderaj, K Park, WL Hase International Reviews in Physical Chemistry 27 (3), 361-403, 2008 | 162 | 2008 |
A refined MS-EVB model for proton transport in aqueous environments K Park, W Lin, F Paesani The Journal of Physical Chemistry B 116 (1), 343-352, 2011 | 99 | 2011 |
Application of adaptive QM/MM methods to molecular dynamics simulations of aqueous systems K Park, AW Götz, RC Walker, F Paesani Journal of chemical theory and computation 8 (8), 2868-2877, 2012 | 67 | 2012 |
Importance of shattering fragmentation in the surface-induced dissociation of protonated octaglycine K Park, B Deb, K Song, WL Hase Journal of the American Society for Mass Spectrometry 20 (6), 939-948, 2009 | 51 | 2009 |
Use of a single trajectory to study product energy partitioning in unimolecular dissociation: Mass effects for halogenated alkanes L Sun, K Park, K Song, DW Setser, WL Hase The Journal of chemical physics 124 (6), 064313, 2006 | 50 | 2006 |
An ab initio direct dynamics simulation of protonated glycine surface-induced dissociation K Park, K Song, WL Hase International Journal of Mass Spectrometry 265 (2), 326-336, 2007 | 42 | 2007 |
Fast and slow proton transfer in ice: The role of the quasi-liquid layer and hydrogen-bond network K Park, W Lin, F Paesani The Journal of Physical Chemistry B 118 (28), 8081-8089, 2014 | 34 | 2014 |
Algorithms for Sampling a Quantum Microcanonical Ensemble of Harmonic Oscillators at Potential Minima and Conical Intersections K Park, J Engelkemier, M Persico, P Manikandan, WL Hase The Journal of Physical Chemistry A 115 (24), 6603-6609, 2011 | 33 | 2011 |
O(3P) + C2H4 Potential Energy Surface: Study at the Multireference Level AC West, JS Kretchmer, B Sellner, K Park, WL Hase, H Lischka, ... The Journal of Physical Chemistry A 113 (45), 12663-12674, 2009 | 32 | 2009 |
Direct dynamics simulation of dioxetane formation and decomposition via the singlet ·O–O–CH2–CH2· biradical: Non-RRKM dynamics R Sun, 孙睿, K Park, 박교연, WA de Jong, H Lischka, TL Windus, WL Hase The Journal of chemical physics 137 (4), 044305, 2012 | 28 | 2012 |
Singlet and triplet potential surfaces for the reaction K Park, A West, E Raheja, B Sellner, H Lischka, TL Windus, WL Hase The Journal of chemical physics 133 (18), 184306, 2010 | 22 | 2010 |
Adaptive QM/MM method in AMBER: Molecular dynamics simulations of aqueous systems K Park, F Paesani ABSTRACTS OF PAPERS OF THE AMERICAN CHEMICAL SOCIETY 244, 2012 | | 2012 |
O plus ethylene potential energy surface: Theoretical study at the MCSCF and MRMP2 levels AC West, JS Kretchmer, K Park, H Lischka, WL Hase, TL Windus ABSTRACTS OF PAPERS OF THE AMERICAN CHEMICAL SOCIETY 238, 2009 | | 2009 |