| Temperature-dependent growth of carbon nanotubes by pyrolysis of ferrocene and acetylene in the range between 700 and 1000 C YT Lee, NS Kim, J Park, JB Han, YS Choi, H Ryu, HJ Lee Chemical physics letters 372 (5-6), 853-859, 2003 | 182 | 2003 |
| Vertically aligned carbon nanotubes grown by pyrolysis of iron, cobalt, and nickel phthalocyanines NS Kim, YT Lee, J Park, JB Han, YS Choi, SY Choi, J Choo, GH Lee The Journal of Physical Chemistry B 107 (35), 9249-9255, 2003 | 160 | 2003 |
| Nitrile and thiocyanate IR probes: Molecular dynamics simulation studies KI Oh, JH Choi, JH Lee, JB Han, H Lee, M Cho The Journal of chemical physics 128 (15), 2008 | 148 | 2008 |
| Classical and quantum mechanical/molecular mechanical molecular dynamics simulations of alanine dipeptide in water: Comparisons with IR and vibrational circular dichroism spectra K Kwac, KK Lee, JB Han, KI Oh, M Cho The Journal of chemical physics 128 (10), 2008 | 100 | 2008 |
| Explicit polarization (X-Pol) potential using ab initio molecular orbital theory and density functional theory L Song, J Han, Y Lin, W Xie, J Gao The Journal of Physical Chemistry A 113 (43), 11656-11664, 2009 | 63 | 2009 |
| Phenol-benzene complexation dynamics: Quantum chemistry calculation, molecular dynamics simulations, and two dimensional IR spectroscopy K Kwac, C Lee, Y Jung, J Han, K Kwak, J Zheng, MD Fayer, M Cho The Journal of chemical physics 125 (24), 2006 | 54 | 2006 |
| Quantum mechanical force field for water with explicit electronic polarization J Han, MJM Mazack, P Zhang, DG Truhlar, J Gao The Journal of Chemical Physics 139 (5), 2013 | 50 | 2013 |
| Site-Specific Hydrogen-Bonding Interaction between N-Acetylproline Amide and Protic Solvent Molecules: Comparisons of IR and VCD Measurements with MD … KI Oh, J Han, KK Lee, S Hahn, H Han, M Cho The Journal of Physical Chemistry A 110 (50), 13355-13365, 2006 | 31 | 2006 |
| Calculated reduction potentials of electrolyte species in lithium–sulfur batteries J Han, Y Zheng, N Guo, PB Balbuena The Journal of Physical Chemistry C 124 (38), 20654-20670, 2020 | 21 | 2020 |
| Optimization of the explicit polarization (X-Pol) potential using a hybrid density functional J Han, DG Truhlar, J Gao Theoretical chemistry accounts 131, 1-15, 2012 | 21 | 2012 |
| First-principles calculations of oxidation potentials of electrolytes in lithium–sulfur batteries and their variations with changes in environment J Han, PB Balbuena Physical Chemistry Chemical Physics 20 (27), 18811-18827, 2018 | 12 | 2018 |
| Determining the atomic charge of calcium ion requires the information of its coordination geometry in an EF-hand motif P Zhang, J Han, P Cieplak, M Cheung The Journal of Chemical Physics 154 (12), 2021 | 9 | 2021 |
| On the Interplay between Electronic Structure and Polarizable Force Fields When Calculating Solution-Phase Charge-Transfer Rates J Han, P Zhang, H Aksu, B Maiti, X Sun, E Geva, BD Dunietz, MS Cheung Journal of Chemical Theory and Computation 16 (10), 6481-6490, 2020 | 7 | 2020 |
| Computational Study on Oxidation Potential Variations of Electrolytes with Complexation in Lithium-Sulfur (Li/S) Batteries J Han, PB Balbuena Electrochemical Society Meeting Abstracts 233, 178-178, 2018 | | 2018 |
| Development of polarizable methods for molecular mechanics simulations J Han | | 2014 |
| Enzyme simulation of the MOVB method J Han, A Cembran, J Gao ABSTRACTS OF PAPERS OF THE AMERICAN CHEMICAL SOCIETY 244, 2012 | | 2012 |
| Supplementary Material for Quantum Mechanical Force Field for Water with Explicit Electronic Polarization J Han, MJM Mazack, P Zhang, DG Truhlar, J Gao | | |
Minhaeng ChoCenter for Molecular Spectroscopy and Dynamics, IBS and Department of Chemistry, Korea University在 korea.ac.kr 的电子邮件经过验证
