| Prediction of the critical micelle concentration of nonionic surfactants by dissipative particle dynamics simulations A Vishnyakov, MT Lee, AV Neimark The journal of physical chemistry letters 4 (5), 797-802, 2013 | 195 | 2013 |
| Calculations of critical micelle concentration by dissipative particle dynamics simulations: the role of chain rigidity MT Lee, A Vishnyakov, AV Neimark The Journal of Physical Chemistry B 117 (35), 10304-10310, 2013 | 112 | 2013 |
| Modeling aggregation of ionic surfactants using a smeared charge approximation in dissipative particle dynamics simulations R Mao, MT Lee, A Vishnyakov, AV Neimark The Journal of Physical Chemistry B 119 (35), 11673-11683, 2015 | 96 | 2015 |
| Coarse-grained model of nanoscale segregation, water diffusion, and proton transport in Nafion membranes A Vishnyakov, R Mao, MT Lee, AV Neimark The Journal of Chemical Physics 148, 024108, 2018 | 62 | 2018 |
| Prediction of mixture vapor–liquid equilibrium from the combined use of Peng–Robinson equation of state and COSMO-SAC activity coefficient model through the Wong–Sandler mixing … MT Lee, ST Lin Fluid phase equilibria 254 (1), 28-34, 2007 | 56 | 2007 |
| Coarse-grained model of water diffusion and proton conductivity in hydrated polyelectrolyte membrane MT Lee, A Vishnyakov, AV Neimark The Journal of Chemical Physics 144 (1), 2016 | 52 | 2016 |
| Parametrization of chain molecules in dissipative particle dynamics MT Lee, R Mao, A Vishnyakov, AV Neimark The Journal of Physical Chemistry B 120 (22), 4980-4991, 2016 | 49 | 2016 |
| Modeling proton dissociation and transfer using dissipative particle dynamics simulation MT Lee, A Vishnyakov, AV Neimark Journal of Chemical Theory and Computation 11 (9), 4395-4403, 2015 | 46 | 2015 |
| Exploring side-chain designs for enhanced ion conductivity of anion-exchange membranes by mesoscale simulations MT Lee The Journal of Physical Chemistry C 123 (17), 10802-10815, 2019 | 41 | 2019 |
| Designing anion exchange membranes with enhanced hydroxide ion conductivity by mesoscale simulations MT Lee The Journal of Physical Chemistry C 124 (8), 4470-4482, 2020 | 39 | 2020 |
| Solvation and chemical engineering thermodynamics ST Lin, CM Hsieh, MT Lee Journal of the Chinese Institute of Chemical Engineers 38 (5), 467-476, 2007 | 37 | 2007 |
| Water Vacancy Driven Diffusion in Clathrate Hydrates: Molecular Dynamics Simulation Study H Lo, MT Lee, ST Lin The Journal of Physical Chemistry C 121 (15), 8280–8289, 2017 | 32 | 2017 |
| Molecular modeling of organophosphorous agents and their aqueous solutions A Vishnyakov, GY Gor, MT Lee, AV Neimark The Journal of Physical Chemistry A 115 (20), 5201-5209, 2011 | 31 | 2011 |
| Interactions of phosphororganic agents with water and components of polyelectrolyte membranes MT Lee, A Vishnyakov, GY Gor, AV Neimark The Journal of Physical Chemistry B 115 (46), 13617-13623, 2011 | 27 | 2011 |
| Micellization of Rhamnolipid Biosurfactants and Their Applications in Oil Recovery: Insights from Mesoscale Simulations MT Lee The Journal of Physical Chemistry B 125 (34), 9895–9909, 2021 | 13 | 2021 |
| Designing highly conductive block copolymer-based anion exchange membranes by mesoscale simulations MT Lee The Journal of Physical Chemistry B 125 (10), 2729-2740, 2021 | 12 | 2021 |
| Interactions of sarin with polyelectrolyte membranes: A molecular dynamics simulation study MT Lee, A Vishnyakov, GY Gor, AV Neimark The Journal of Physical Chemistry B 117 (1), 365-372, 2013 | 12 | 2013 |
| Rhamnolipid biosurfactants for oil recovery: salt effects on the structural properties investigated by mesoscale simulations IC Chen, MT Lee ACS omega 7 (7), 6223-6237, 2022 | 9 | 2022 |
| Anion Exchange Membranes for Fuel Cells Based on Quaternized Polystyrene-b-poly(ethylene-co-butylene)-b-polystyrene Triblock Copolymers with Spacer-Sidechain Design QG Chen, MT Lee Polymers 14 (14), 2860, 2022 | 7 | 2022 |
| A priori predictions of critical loci from the combined use of PRSV equation of state and the COSMO-SAC model through the MHV1 mixing rule YS Tai, MT Hsieh, MT Lee, DSH Wong, ST Lin Fluid Phase Equilibria 308 (1), 25-34, 2011 | 2 | 2011 |