| Molecular simulation of thermodynamic and transport properties for the H2O+ NaCl system GA Orozco, OA Moultos, H Jiang, IG Economou, AZ Panagiotopoulos The Journal of chemical physics 141 (23), 2014 | 71 | 2014 |
| Optimization of Intermolecular Potential Parameters for the CO2/H2O Mixture GA Orozco, IG Economou, AZ Panagiotopoulos The Journal of Physical Chemistry B 118 (39), 11504-11511, 2014 | 47 | 2014 |
| Simulation and pre-feasibility analysis of the production process of α-methyl ester sulfonates (α-MES) D Martínez, G Orozco, S Rincón, I Gil Bioresource technology 101 (22), 8762-8771, 2010 | 40 | 2010 |
| Atomistic molecular dynamics Dynamics Simulations of H2O Diffusivity in Liquid and Supercritical CO2 OA Moultos, GA Orozco, IN Tsimpanogiannis, AZ Panagiotopoulos, ... Molecular Physics 113 ((17–18)), 2805–2814, 2015 | 34 | 2015 |
| A transferable force field for primary, secondary, and tertiary alkanolamines GA Orozco, V Lachet, C Nieto-Draghi, AD Mackie Journal of Chemical Theory and Computation 9 (4), 2097-2103, 2013 | 32 | 2013 |
| Transferable force field for equilibrium and transport properties in linear, branched, and bifunctional amines I. Primary amines GA Orozco, C Nieto-Draghi, AD Mackie, V Lachet The Journal of Physical Chemistry B 115 (49), 14617-14625, 2011 | 29 | 2011 |
| Transferable force field for equilibrium and transport properties in linear and branched monofunctional and multifunctional amines. II. Secondary and tertiary amines GA Orozco, C Nieto-Draghi, AD Mackie, V Lachet The Journal of Physical Chemistry B 116 (21), 6193-6202, 2012 | 23 | 2012 |
| A molecular simulation study of aqueous solutions of amines and alkanolamines: mixture properties and structural analysis GA Orozco, V Lachet, AD Mackie Molecular Simulation 40 (1-3), 123-133, 2014 | 20 | 2014 |
| Using process simulators in the study, design, and control of distillation columns for undergraduate chemical engineering courses T Castrellón, DC Botía, R Gómez, G Orozco, ID Gil Computer Applications in Engineering Education 19 (3), 621-630, 2011 | 20 | 2011 |
| Self-diffusion coefficients of amines, a molecular dynamics study LE Castro-Anaya, GA Orozco Fluid Phase Equilibria 553 (1), 113301, 2022 | 9 | 2022 |
| Equilibrium and transport properties of primary, secondary and tertiary amines by molecular simulation GA Orozco, C Nieto-Draghi, AD Mackie, V Lachet Oil & Gas Science and Technology–Revue d’IFP Energies nouvelles 69 (5), 833-849, 2014 | 9 | 2014 |
| Physical Absorption of Green House Gases in Amines: The Influence of Functionality, Structure and Cross Interactions GA Orozco, V Lachet, AD Mackie The Journal of Physical Chemistry B 120 (51), 13136–13143, 2016 | 8 | 2016 |
| Effect of kinetic models on hot spot temperature prediction for phthalic anhydride production in a multitubular packed bed reactor GA Orozco, JR Gomez, OF Sanchez, ID Gil, A Duran The Canadian Journal of Chemical Engineering 88 (2), 224-231, 2010 | 8 | 2010 |
| A systematic review of mathematical modeling for molecular distillation technologies ÁM Idárraga-Vélez, GA Orozco, ID Gil-Chaves Chemical Engineering and Processing-Process Intensification 184, 109289, 2023 | 5 | 2023 |
| Predictions of fluidities of amines by molecular simulations: TraPPE-EH vs. OPLS-AA A Rendón-Calle, GA Orozco, S Builes Fluid Phase Equilibria 464, 40-46, 2018 | 4 | 2018 |
| Blood Flow in Channel Constrictions: A Lattice-Boltzmann Consistent Comparison between Newtonian and Non-Newtonian Models GA Orozco, C. T. Gonzáles-Hidalgo, A. D. Mackie, J. C. Diaz, D. A. Roa Romero Journal of Applied Fluid Mechanics 12 (4), 1333-1345, 2019 | 3 | 2019 |
| Thermodynamics and transport properties of CBD and Δ9-THC: A first attempt using molecular dynamics LF Salas-Guerrero, C Buendia-Atencio, GA Orozco Journal of Molecular Liquids 371, 121048, 2023 | 2 | 2023 |
| Development of atomistic graphene models for H2 adsorption from experimental data and Monte Carlo simulations LF Salas-Guerrero, S Builes, GA Orozco International Journal of Hydrogen Energy 50, 1626-1633, 2024 | 1 | 2024 |
| Densities and Viscosities of Cannabis Extracts and Distillates, and Densities, Viscosities, Fusion Enthalpy, and Melting Point of Cannabidiol AM Idárraga-Vélez, ID Gil Chaves, GA Orozco Journal of Chemical & Engineering Data 68 (12), 2982-2988, 2023 | | 2023 |
| Experimental Solubility of Cannabidiol (CBD) in Different Organic Solvents LG Pulido Bonilla, GA Orozco, ID Gil Chaves, G Rodríguez Niño Industrial & Engineering Chemistry Research 62 (31), 12356-12364, 2023 | | 2023 |
Allan D. MackieUniversitat Rovira i VirgiliVerified email at urv.cat
