| Molecular Dynamics Simulation of n-Alkanes and CO2 Confined by Calcite Nanopores MS Santos, LFM Franco, M Castier, IG Economou Energy & Fuels 32 (2), 1934-1941, 2018 | 124 | 2018 |
| Molecular thermodynamics of micellization: micelle size distributions and geometry transitions MS Santos, FW Tavares, EC Biscaia Jr Brazilian Journal of Chemical Engineering 33, 515-523, 2016 | 46 | 2016 |
| Quantifying Pore Width Effects on Diffusivity via a Novel 3D Stochastic Approach with Input from Atomistic Molecular Dynamics Simulations M Apostolopoulou, MS Santos, M Hamza, T Bui, IG Economou, ... Journal of chemical theory and computation 15 (12), 6907-6922, 2019 | 27 | 2019 |
| The Contribution of the Ion–Ion and Ion–Solvent Interactions in a Molecular Thermodynamic Treatment of Electrolyte Solutions S Kournopoulos, MS Santos, S Ravipati, AJ Haslam, G Jackson, ... The Journal of Physical Chemistry B 126 (47), 9821-9839, 2022 | 17 | 2022 |
| Molecular dynamics simulation of electrolyte solutions confined by calcite mesopores MS Santos, M Castier, IG Economou Fluid Phase Equilibria 487, 24-32, 2019 | 17 | 2019 |
| A modified Poisson-Boltzmann equation applied to protein adsorption M de Souza Gama, MS Santos, ER de Almeida Lima, FW Tavares, ... Journal of Chromatography A 1531, 74-82, 2018 | 14 | 2018 |
| Monte Carlo Molecular Simulation Study of Carbon Dioxide Sequestration into Dry and Wet Calcite Pores Containing Methane S Ravipati, MS Santos, IG Economou, A Galindo, G Jackson, AJ Haslam Energy & Fuels 35 (14), 11393-11402, 2021 | 13 | 2021 |
| Effect of ion structure on the physicochemical properties and gas absorption of surface active ionic liquids J Ávila, D Lozano-Martín, MS Santos, Y Zhang, H Li, A Pádua, R Atkin, ... Physical Chemistry Chemical Physics 25 (9), 6808-6816, 2023 | 10 | 2023 |
| Effect of electrostatic correlations on micelle formation MS Santos, EC Biscaia Jr, FW Tavares Colloids and Surfaces A: Physicochemical and Engineering Aspects 533, 169-178, 2017 | 9 | 2017 |
| Role of Catalyst Support's Physicochemical Properties on Catalytic Transfer Hydrogenation over Palladium Catalysts G Fraga, MS Santos, M Konarova, MD Hasan, B Laycock, N Batalha, ... ChemCatChem 13, 2021 | 6 | 2021 |
| Molecular Understanding of Enhanced Hydrocarbon Recovery Processes: Role of Local Self-Diffusion Coefficients of Complex Mixtures MS Santos, M Hamza, LFM Franco, M Castier, IG Economou Energy & Fuels 36 (15), 8301-8310, 2022 | 5 | 2022 |
| Effect of Surface Chemistry on the Electrical Double Layer in a Long-Chain Ionic Liquid L Bou Tannous, M Simoes Santos, Z Gong, PH Haumesser, A Benayad, ... Langmuir, 2023 | 4 | 2023 |
| Real Electrolyte Solutions in the Functionalized Mean Spherical Approximation: A Density Functional Theory for Simple Electrolyte Solutions EA Soares, NS Vernin, MS Santos, FW Tavares The Journal of Physical Chemistry B 126 (32), 6095-6101, 2022 | 4 | 2022 |
| Structural and transport properties of the molten salt NaCl-KCl-UCl3 using the polarizable ion model MS Santos, M Salanne, T Kooyman, D Lambertin Journal of Nuclear Materials, 155125, 2024 | 2 | 2024 |
| Molecular dynamics simulations for the prediction of thermophysical properties of plutonium-based molten salts G Pireddu, MS Santos, D Lambertin, T Kooyman Journal of Nuclear Materials, 155124, 2024 | 1 | 2024 |
| Ionic liquids at interfaces with 2D and porous materials A Pádua, Z Gong, MS Santos, LB Tannous, A Steinberger, R Clark, ... Ionic Liquids and Materials–ILMAT 7, 2023 | | 2023 |
| IDEAL COMMUNITIES IG Economou, MS Santos, M Hamza, LFM Franco, M Castier CEP, 2023 | | 2023 |
| Mean-Field and Modified Poisson–Boltzmann Approaches for Modeling Electrochemical Energy Storage Systems MS Santos Multiscale Modeling of Electrochemical Reactions and Processes, 5-1-5-16, 2021 | | 2021 |
| Molecular Dynamics Simulation As an Aid for Enhanced Oil and Gas Recovery in Tight and Shale Reservoirs IG Economou, MS Santos, M Hamza, LFM Franco, M Castier AIChE Annual Meeting, 2018 | | 2018 |
| TERMODINÂMICA DE MICELIZAÇÃO: DISTRIBUIÇÕES DE TAMANHO E TRANSIÇÃO ENTRE GEOMETRIAS MS SANTOS, FW TAVARES, EC BISCAIA JR Blucher Chemical Engineering Proceedings 1 (2), 15973-15980, 2015 | | 2015 |
Ioannis G. EconomouProfessor of Chemical Engineering, Texas A&M University at Qatar, DohaVerified email at qatar.tamu.edu