Effect of Room-Temperature Ionic Liquids on CO2 Separation by a Cu-BTC Metal–Organic Framework JM Vicent-Luna, JJ Gutiérrez-Sevillano, JA Anta, S Calero The Journal of Physical Chemistry C 117 (40), 20762-20768, 2013 | 99 | 2013 |
Molecular mechanisms for adsorption in Cu-BTC metal organic framework JJ Gutiérrez-Sevillano, JM Vicent-Luna, D Dubbeldam, S Calero The Journal of Physical Chemistry C 117 (21), 11357-11366, 2013 | 99 | 2013 |
Looking at the “water-in-deep-eutectic-solvent” system: A dilution range for high performance eutectics N López-Salas, JM Vicent-Luna, S Imberti, E Posada, MJ Roldán, JA Anta, ... ACS sustainable chemistry & engineering 7 (21), 17565-17573, 2019 | 93 | 2019 |
Solubility of the Precombustion Gases CO2, CH4, CO, H2, N2, and H2S in the Ionic Liquid [bmim][Tf2N] from Monte Carlo Simulations M Ramdin, SP Balaji, JM Vicent-Luna, JJ Gutierrez-Sevillano, S Calero, ... The Journal of Physical Chemistry C 118 (41), 23599-23604, 2014 | 82 | 2014 |
Adsorption and diffusion of benzene in Mg-MOF-74 with open metal sites A Liu, X Peng, Q Jin, SK Jain, JM Vicent-Luna, S Calero, D Zhao ACS applied materials & interfaces 11 (4), 4686-4700, 2019 | 56 | 2019 |
Storage and separation of carbon dioxide and methane in hydrated covalent organic frameworks JM Vicent-Luna, A Luna-Triguero, S Calero The Journal of Physical Chemistry C 120 (41), 23756-23762, 2016 | 51 | 2016 |
Role of hydrogen bonding in the capture and storage of ammonia in zeolites I Matito-Martos, A Martin-Calvo, CO Ania, JB Parra, JM Vicent-Luna, ... Chemical Engineering Journal 387, 124062, 2020 | 46 | 2020 |
Olefin/Paraffin separation in open metal site Cu-BTC metal–organic framework A Luna-Triguero, JM Vicent-Luna, P Gómez-Álvarez, S Calero The Journal of Physical Chemistry C 121 (5), 3126-3132, 2017 | 45 | 2017 |
Micelle formation in aqueous solutions of room temperature ionic liquids: a molecular dynamics study JM Vicent-Luna, JM Romero-Enrique, S Calero, JA Anta The Journal of Physical Chemistry B 121 (35), 8348-8358, 2017 | 44 | 2017 |
Role of Ionic Liquid [EMIM]+[SCN]− in the Adsorption and Diffusion of Gases in Metal–Organic Frameworks JM Vicent-Luna, JJ Gutierrez-Sevillano, S Hamad, J Anta, S Calero ACS applied materials & interfaces 10 (35), 29694-29704, 2018 | 43 | 2018 |
Solubilities of CO2, CH4, C2H6, and SO2 in ionic liquids and Selexol from Monte Carlo simulations M Ramdin, Q Chen, SP Balaji, JM Vicent-Luna, A Torres-Knoop, ... Journal of Computational Science 15, 74-80, 2016 | 42 | 2016 |
Atomistic Insights Into the Degradation of Inorganic Halide Perovskite CsPbI3: A Reactive Force Field Molecular Dynamics Study M Pols, JM Vicent-Luna, I Filot, ACT Van Duin, S Tao The journal of physical chemistry letters 12 (23), 5519-5525, 2021 | 41 | 2021 |
Acetylene storage and separation using metal–organic frameworks with open metal sites A Luna-Triguero, JM Vicent-Luna, RM Madero-Castro, P Gómez-Álvarez, ... ACS applied materials & interfaces 11 (34), 31499-31507, 2019 | 41 | 2019 |
Quantum and classical molecular dynamics of ionic liquid electrolytes for Na/Li‐based batteries: molecular origins of the conductivity behavior JM Vicent‐Luna, JM Ortiz‐Roldan, S Hamad, R Tena‐Zaera, S Calero, ... ChemPhysChem 17 (16), 2473-2481, 2016 | 41 | 2016 |
Efficient modelling of ion structure and dynamics in inorganic metal halide perovskites SRG Balestra, JM Vicent-Luna, S Calero, S Tao, JA Anta Journal of Materials Chemistry A 8 (23), 11824-11836, 2020 | 39 | 2020 |
Further extending the dilution range of the “solvent-in-DES” regime upon the replacement of water by an organic solvent with hydrogen bond capabilities N López-Salas, JM Vicent-Luna, E Posada, S Imberti, RM Madero-Castro, ... ACS Sustainable Chemistry & Engineering 8 (32), 12120-12131, 2020 | 37 | 2020 |
π-Complexation for olefin/paraffin separation using aluminosilicates A Luna-Triguero, A Sławek, R Sánchez-de-Armas, JJ Gutiérrez-Sevillano, ... Chemical Engineering Journal 380, 122482, 2020 | 37 | 2020 |
Improving olefin purification using metal organic frameworks with open metal sites A Luna-Triguero, JM Vicent-Luna, A Poursaeidesfahani, TJH Vlugt, ... ACS applied materials & interfaces 10 (19), 16911-16917, 2018 | 34 | 2018 |
Separation of CF4/N2, C2F6/N2, and SF6/N2 Mixtures in Amorphous Activated Carbons Using Molecular Simulations X Peng, JM Vicent-Luna, Q Jin ACS applied materials & interfaces 12 (17), 20044-20055, 2020 | 33 | 2020 |
Molecular Dynamics Analysis of Charge Transport in Ionic‐Liquid Electrolytes Containing Added Salt with Mono, Di, and Trivalent Metal Cations JM Vicent‐Luna, E Azaceta, S Hamad, JM Ortiz‐Roldán, R Tena‐Zaera, ... ChemPhysChem 19 (13), 1665-1673, 2018 | 30 | 2018 |