José Manuel Vicent-Luna - Publications

Affiliations: 
University Pablo de Olavide 
Area:
molecular simulation, adsorption, diffusion, computational chemistry, zeolites, metal organic frameworks, ionic liquids
Website:
https://jmviclun.github.io/

41 high-probability publications. We are testing a new system for linking publications to authors. You can help! If you notice any inaccuracies, please sign in and mark papers as correct or incorrect matches. If you identify any major omissions or other inaccuracies in the publication list, please let us know.

Year Citation  Score
2023 Madero-Castro RM, Luna-Triguero A, Sławek A, Vicent-Luna JM, Calero S. On the Use of Water and Methanol with Zeolites for Heat Transfer. Acs Sustainable Chemistry & Engineering. 11: 4317-4328. PMID 36970114 DOI: 10.1021/acssuschemeng.2c05369  0.621
2021 Luna-Triguero A, Vicent-Luna J, Jansman M, Zafeiropoulos G, Tsampas M, van de Sanden M, Akse H, Calero S. Enhancing separation efficiency in European syngas industry by using zeolites Catalysis Today. 362: 113-121. DOI: 10.1016/J.Cattod.2020.03.061  0.537
2020 Del Monte F, Lu X, Vicent-Luna JM, Jimenez R, Calero S, Roldán-Ruiz MJ, Gutiérrez MC, Ferrer ML. Aqueous cosolvent in Zwitterionic-based PILs as Electrolytes in 2.0 V Supercapacitors. Chemsuschem. PMID 32924284 DOI: 10.1002/Cssc.202002028  0.496
2020 Peng X, Vicent-Luna JM, Jin Q. Separation of CF/N, CF/N, and SF/N Mixtures in Amorphous Activated Carbons Using Molecular Simulations. Acs Applied Materials & Interfaces. 12: 20044-20055. PMID 32270994 DOI: 10.1021/acsami.0c01043  0.413
2020 Balestra SRG, Vicent-Luna JM, Calero S, Tao S, Anta JA. Efficient modelling of ion structure and dynamics in inorganic metal halide perovskites Journal of Materials Chemistry A. 8: 11824-11836. DOI: 10.1039/D0Ta03200J  0.486
2020 López-Salas N, Vicent-Luna JM, Posada E, Imberti S, Madero-Castro RM, Calero S, Ania CO, Jiménez-Riobóo RJ, Gutiérrez MC, Ferrer ML, del Monte F. Further Extending the Dilution Range of the “Solvent-in-DES” Regime upon the Replacement of Water by an Organic Solvent with Hydrogen Bond Capabilities Acs Sustainable Chemistry & Engineering. 8: 12120-12131. DOI: 10.1021/Acssuschemeng.0C03516  0.509
2020 González-Galán C, Luna-Triguero A, Vicent-Luna J, Zaderenko A, Sławek A, Sánchez-de-Armas R, Calero S. Exploiting the π-bonding for the separation of benzene and cyclohexane in zeolites Chemical Engineering Journal. 398: 125678. DOI: 10.1016/J.Cej.2020.125678  0.64
2020 Matito-Martos I, Martin-Calvo A, Ania C, Parra J, Vicent-Luna J, Calero S. Role of hydrogen bonding in the capture and storage of ammonia in zeolites Chemical Engineering Journal. 387: 124062. DOI: 10.1016/J.Cej.2020.124062  0.641
2020 Luna-Triguero A, Sławek A, Sánchez-de-Armas R, Gutiérrez-Sevillano J, Ania C, Parra J, Vicent-Luna J, Calero S. π-Complexation for olefin/paraffin separation using aluminosilicates Chemical Engineering Journal. 380: 122482. DOI: 10.1016/J.Cej.2019.122482  0.616
2019 Luna-Triguero A, Vicent-Luna JM, Madero Castro RM, Gómez-Álvarez P, Calero S. Acetylene Storage and Separation using Metal-Organic Frameworks with Open Metal Sites. Acs Applied Materials & Interfaces. PMID 31368697 DOI: 10.1021/Acsami.9B09010  0.649
2019 Liu A, Peng X, Jin Q, Jain SK, Vicent-Luna JM, Calero S, Zhao D. Adsorption and diffusion of benzene in Mg-MOF-74 with open metal sites. Acs Applied Materials & Interfaces. PMID 30618234 DOI: 10.1021/Acsami.8B20447  0.633
2019 López-Salas N, Vicent-Luna JM, Imberti S, Posada E, Roldán MJ, Anta JA, Balestra SRG, Madero Castro RM, Calero S, Jiménez-Riobóo RJ, Gutiérrez MC, Ferrer ML, del Monte F. Looking at the “Water-in-Deep-Eutectic-Solvent” System: A Dilution Range for High Performance Eutectics Acs Sustainable Chemistry & Engineering. 7: 17565-17573. DOI: 10.1021/Acssuschemeng.9B05096  0.524
2019 Peng X, Vicent-Luna JM, Jain SK, Jin Q, Singh JK. Computational Study of the Effect of Functional Groups on Water Adsorption in Mesoporous Carbons: Implications for Gas Adsorption Acs Applied Nano Materials. 2: 7103-7113. DOI: 10.1021/acsanm.9b01633  0.349
2019 Sławek A, Vicent-Luna JM, Ogorzały K, Valencia S, Rey F, Makowski W, Calero S. Adsorption of Alkanes in Zeolites LTA and FAU: Quasi-Equilibrated Thermodesorption Supported by Molecular Simulations The Journal of Physical Chemistry C. 123: 29665-29678. DOI: 10.1021/Acs.Jpcc.9B07907  0.648
2019 Madero-Castro RM, Vicent-Luna JM, Calero S. Adsorption of Light Alcohols in a High Hydrophobic Metal Azolate Framework The Journal of Physical Chemistry C. 123: 23987-23994. DOI: 10.1021/Acs.Jpcc.9B05508  0.504
2018 Sławek A, Grzybowska K, Vicent-Luna JM, Makowski W, Calero S. Adsorption of Cyclohexane in Pure Silica Zeolites: High-Throughput Computational Screening Validated by Experimental Data. Chemphyschem : a European Journal of Chemical Physics and Physical Chemistry. PMID 30457696 DOI: 10.1002/Cphc.201800968  0.627
2018 Becker TM, Luna-Triguero A, Vicent-Luna JM, Lin LC, Dubbeldam D, Calero S, Vlugt TJH. Potential of polarizable force fields for predicting the separation performance of small hydrocarbons in M-MOF-74. Physical Chemistry Chemical Physics : Pccp. PMID 30420977 DOI: 10.1039/C8Cp05750H  0.581
2018 Vicent-Luna JM, Gutiérrez-Sevillano JJ, Hamad S, Anta JA, Calero S. Role of Ionic Liquid [EMIM]+[SCN]- in the Adsorption and Diffusion of Gases in Metal-Organic Frameworks. Acs Applied Materials & Interfaces. PMID 30089205 DOI: 10.1021/Acsami.8B11842  0.624
2018 Luna-Triguero A, Vicent-Luna JM, Calero S. Phase Transition Induced by Gas Adsorption in Metal-Organic Frameworks. Chemistry (Weinheim An Der Bergstrasse, Germany). PMID 29672959 DOI: 10.1002/Chem.201801157  0.637
2018 Luna-Triguero A, Vicent-Luna JM, Poursaeidesfahani A, Vlugt TJH, Sánchez-de-Armas R, Gómez-Álvarez P, Calero S. Improving Olefin Purification Using Metal Organic Frameworks with Open Metal Sites. Acs Applied Materials & Interfaces. 10: 16911-16917. PMID 29671568 DOI: 10.1021/Acsami.8B04106  0.576
2018 Vicent-Luna JM, Azaceta E, Hamad S, Ortiz-Roldán JM, Tena-Zaera R, Calero S, Anta JA. Molecular Dynamics Analysis of Charge Transport in Ionic-Liquid Electrolytes Containing Added Salt with Mono, Di, and Trivalent Metal Cations. Chemphyschem : a European Journal of Chemical Physics and Physical Chemistry. PMID 29668113 DOI: 10.1002/Cphc.201701326  0.524
2018 Min JG, Luna-Triguero A, Byun Y, Balestra SRG, Vicent-Luna JM, Calero S, Hong SB, Camblor MA. Stepped Propane Adsorption in Pure-Silica ITW Zeolite. Langmuir : the Acs Journal of Surfaces and Colloids. PMID 29634906 DOI: 10.1021/Acs.Langmuir.8B00628  0.622
2018 Bermúdez-García JM, Vicent-Luna JM, Yáñez-Vilar S, Hamad S, Sánchez-Andújar M, Castro-García S, Calero S, Señarís-Rodríguez MA. Liquid self-diffusion of H2O and DMF molecules in Co-MOF-74: molecular dynamics simulations and dielectric spectroscopy studies. Physical Chemistry Chemical Physics : Pccp. 18: 19605-12. PMID 27353249 DOI: 10.1039/C6Cp02477G  0.57
2018 Sławek A, Vicent-Luna JM, Marszałek B, Gil B, Morris RE, Makowski W, Calero S. Gate-Opening Mechanism of Hydrophilic–Hydrophobic Metal–Organic Frameworks: Molecular Simulations and Quasi-Equilibrated Desorption Chemistry of Materials. 30: 5116-5127. DOI: 10.1021/Acs.Chemmater.8B01603  0.638
2017 Vicent-Luna JM, Romero-Enrique JM, Calero S, Anta JA. Micelle Formation in Aqueous Solutions of Room Temperature Ionic Liquids: A Molecular Dynamics Study. The Journal of Physical Chemistry. B. 121: 8348-8358. PMID 28771356 DOI: 10.1021/Acs.Jpcb.7B05552  0.542
2017 Sławek A, Vicent-Luna JM, Marszałek B, Makowski W, Calero S. Ordering ofn-Alkanes Adsorbed in the Micropores of AlPO4-5: A Combined Molecular Simulations and Quasi-Equilibrated Thermodesorption Study The Journal of Physical Chemistry C. 121: 25292-25302. DOI: 10.1021/Acs.Jpcc.7B08927  0.644
2017 Sławek A, Vicent-Luna JM, Marszałek B, Makowski W, Calero S. Quasi-Equilibrated Thermodesorption Combined with Molecular Simulation for Adsorption and Separation of Hexane Isomers in Zeolites MFI and MEL The Journal of Physical Chemistry C. 121: 19226-19238. DOI: 10.1021/Acs.Jpcc.7B05347  0.643
2017 Luna-Triguero A, Vicent-Luna JM, Gómez-Álvarez P, Calero S. Olefin/Paraffin Separation in Open Metal Site Cu-BTC Metal–Organic Framework The Journal of Physical Chemistry C. 121: 3126-3132. DOI: 10.1021/Acs.Jpcc.6B11808  0.64
2017 Luna-Triguero A, Vicent-Luna JM, Becker TM, Vlugt TJH, Dubbeldam D, Gómez-Álvarez P, Calero S. Effective Model for Olefin/Paraffin Separation using (Co, Fe, Mn, Ni)-MOF-74 Chemistryselect. 2: 665-672. DOI: 10.1002/SLCT.201601095  0.441
2016 Vicent-Luna JM, Ortiz-Roldan JM, Hamad S, Tena-Zaera R, Calero S, Anta JA. Quantum and Classical Molecular Dynamics of Ionic Liquid Electrolytes for Na/Li-based Batteries: Molecular Origins of the Conductivity Behavior. Chemphyschem : a European Journal of Chemical Physics and Physical Chemistry. 17: 2473-81. PMID 27171359 DOI: 10.1002/Cphc.201600285  0.518
2016 Sławek A, Vicent-Luna JM, Marszałek B, Balestra SRG, Makowski W, Calero S. Adsorption of n-Alkanes in MFI and MEL: Quasi-Equilibrated Thermodesorption Combined with Molecular Simulations The Journal of Physical Chemistry C. 120: 25338-25350. DOI: 10.1021/Acs.Jpcc.6B06957  0.644
2016 Vicent-Luna JM, Luna-Triguero A, Calero S. Storage and Separation of Carbon Dioxide and Methane in Hydrated Covalent Organic Frameworks The Journal of Physical Chemistry C. 120: 23756-23762. DOI: 10.1021/Acs.Jpcc.6B05233  0.593
2016 Vicent-Luna JM, Ortiz-Roldan JM, Hamad S, Tena-Zaera R, Calero S, Anta JA. Inside Cover: Quantum and Classical Molecular Dynamics of Ionic Liquid Electrolytes for Na/Li-based Batteries: Molecular Origins of the Conductivity Behavior (ChemPhysChem 16/2016) Chemphyschem. 17: 2449-2449. DOI: 10.1002/Cphc.201600808  0.494
2016 Vicent-Luna JM, Dubbeldam D, Gómez-Álvarez P, Calero S. Inside Cover: Aqueous Solutions of Ionic Liquids: Microscopic Assembly (ChemPhysChem 3/2016) Chemphyschem. 17: 329-329. DOI: 10.1002/Cphc.201600059  0.483
2015 Vicent-Luna JM, Dubbeldam D, Gómez-Álvarez P, Calero S. Microscopic assembly of aqueous solutions of Ionic Liquids. Chemphyschem : a European Journal of Chemical Physics and Physical Chemistry. PMID 26641024 DOI: 10.1002/Cphc.201501022  0.55
2015 Luna-Triguero A, Vicent-Luna JM, Dubbeldam D, Gómez-Álvarez P, Calero S. Understanding and Exploiting Window Effects for Adsorption and Separations of Hydrocarbons Journal of Physical Chemistry C. 119: 19236-19243. DOI: 10.1021/Acs.Jpcc.5B05597  0.588
2015 Ramdin M, Balaji SP, Vicent-Luna JM, Torres-Knoop A, Chen Q, Dubbeldam D, Calero S, de Loos TW, Vlugt TJH. Computing bubble-points of CO2/CH4 gas mixtures in ionic liquids from Monte Carlo simulations Fluid Phase Equilibria. DOI: 10.1016/J.Fluid.2015.09.041  0.526
2014 Vicent-Luna JM, Idígoras J, Hamad S, Calero S, Anta JA. Ion Transport in Electrolytes for Dye-Sensitized Solar Cells: A Combined Experimental and Theoretical Study The Journal of Physical Chemistry C. 118: 28448-28455. DOI: 10.1021/Jp509193H  0.542
2014 Ramdin M, Balaji SP, Vicent-Luna JM, Gutiérrez-Sevillano JJ, Calero S, De Loos TW, Vlugt TJH. Solubility of the precombustion gases CO2, CH4, CO, H2, N2, and H2S in the ionic liquid [bmim][Tf2N] from Monte Carlo simulations Journal of Physical Chemistry C. 118: 23599-23604. DOI: 10.1021/Jp5080434  0.534
2013 Vicent-Luna JM, Gutiérrez-Sevillano JJ, Anta JA, Calero S. Effect of Room-Temperature Ionic Liquids on CO2 Separation by a Cu-BTC Metal–Organic Framework The Journal of Physical Chemistry C. 117: 20762-20768. DOI: 10.1021/Jp407176J  0.632
2013 Gutiérrez-Sevillano JJ, Vicent-Luna JM, Dubbeldam D, Calero S. Molecular mechanisms for adsorption in Cu-BTC metal organic framework Journal of Physical Chemistry C. 117: 11357-11366. DOI: 10.1021/Jp401017U  0.639
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