Year |
Citation |
Score |
2019 |
Lopez-Lazaro C, Bachaud P, Moretti I, Ferrando N. Predicting the phase behavior of hydrogen in NaCl brines by molecular simulation for geological applications Bsgf - Earth Sciences Bulletin. 190: 7. DOI: 10.1051/Bsgf/2019008 |
0.461 |
|
2018 |
Varfolomeev MA, Nagrimanov RN, Stolov MA, Ferrando N, Lugo R, de Hemptinne J. Guaiacol and its mixtures: New data and predictive models. Part 2: Gibbs energy of solvation Fluid Phase Equilibria. 470: 91-100. DOI: 10.1016/J.Fluid.2018.04.004 |
0.445 |
|
2018 |
Pereira C, Féjean C, Betoulle S, Ferrando N, Lugo R, Hemptinne JCD, Mougin P. Guaiacol and its mixtures: New data and predictive models part 1: Phase equilibrium Fluid Phase Equilibria. 470: 75-90. DOI: 10.1016/J.Fluid.2018.01.035 |
0.511 |
|
2018 |
Ahmed S, Ferrando N, Hemptinne Jd, Simonin J, Bernard O, Baudouin O. Modeling of mixed-solvent electrolyte systems Fluid Phase Equilibria. 459: 138-157. DOI: 10.1016/J.Fluid.2017.12.002 |
0.434 |
|
2017 |
Fauve R, Guichet X, Lachet V, Ferrando N. Prediction of H2S solubility in aqueous NaCl solutions by molecular simulation Journal of Petroleum Science and Engineering. 157: 94-106. DOI: 10.1016/J.Petrol.2017.07.003 |
0.427 |
|
2016 |
Ahmed S, Ferrando N, de Hemptinne J, Simonin J, Bernard O, Baudouin O. A New PC-SAFT Model for Pure Water, Water–Hydrocarbons, and Water–Oxygenates Systems and Subsequent Modeling of VLE, VLLE, and LLE Journal of Chemical & Engineering Data. 61: 4178-4190. DOI: 10.1021/Acs.Jced.6B00565 |
0.345 |
|
2016 |
Trinh TKH, De Hemptinne JC, Lugo R, Ferrando N, Passarello JP. Hydrogen Solubility in Hydrocarbon and Oxygenated Organic Compounds Journal of Chemical and Engineering Data. 61: 19-34. DOI: 10.1021/Acs.Jced.5B00119 |
0.418 |
|
2016 |
Pereira CG, Ferrando N, Lugo R, Mougin P, Hemptinne JCd. Predictive evaluation of phase equilibria in biofuel systems using molecular thermodynamic models Journal of Supercritical Fluids. 118: 64-78. DOI: 10.1016/J.Supflu.2016.07.025 |
0.466 |
|
2014 |
Courtial X, Ferrando N, de Hemptinne J, Mougin P. Electrolyte CPA equation of state for very high temperature and pressure reservoir and basin applications Geochimica Et Cosmochimica Acta. 142: 1-14. DOI: 10.1016/J.Gca.2014.07.028 |
0.397 |
|
2014 |
Pereira CG, Grandjean L, Betoulle S, Ferrando N, Féjean C, Lugo R, Hemptinne JCd, Mougin P. Phase equilibria of systems containing aromatic oxygenated compounds with CH4, CO2, H2, H2S, CO and NH3: Experimental data and predictions Fluid Phase Equilibria. 382: 219-234. DOI: 10.1016/J.Fluid.2014.08.011 |
0.453 |
|
2013 |
Ferrando N, Gedik I, Lachet V, Pigeon L, Lugo R. Prediction of phase equilibrium and hydration free energy of carboxylic acids by Monte Carlo simulations. The Journal of Physical Chemistry. B. 117: 7123-32. PMID 23697338 DOI: 10.1021/Jp401251W |
0.47 |
|
2013 |
Yiannourakou M, Ungerer P, Leblanc B, Ferrando N, Teuler J. Overview of MedeA®-GIBBS capabilities for thermodynamic property calculation and VLE behaviour description of pure compounds and mixtures: application to polar compounds generated from ligno-cellulosic biomass Molecular Simulation. 39: 1165-1211. DOI: 10.1080/08927022.2013.830182 |
0.443 |
|
2013 |
Ferrando N, Gedik I, Lachet V, Pigeon L, Lugo R. Prediction of phase equilibrium and hydration free energy of carboxylic acids by Monte Carlo simulations Journal of Physical Chemistry B. 117: 7123-7132. DOI: 10.1021/jp401251w |
0.39 |
|
2013 |
Richard R, Ferrando N, Jacquin M. Liquid–liquid equilibria for ternary systems acetic acid+n-butyl acetate+hydrocarbons at 293.15K Fluid Phase Equilibria. 356: 264-270. DOI: 10.1016/J.Fluid.2013.07.032 |
0.368 |
|
2013 |
Nala M, Auger E, Gedik I, Ferrando N, Dicko M, Paricaud P, Volle F, Passarello JP, de Hemptinne J, Tobaly P, Stringari P, Coquelet C, Ramjugernath D, Naidoo P, Lugo R. Vapour–liquid equilibrium (VLE) for the systems furan+n-hexane and furan+toluene. Measurements, data treatment and modeling using molecular models Fluid Phase Equilibria. 337: 234-245. DOI: 10.1016/J.Fluid.2012.08.005 |
0.467 |
|
2013 |
Plennevaux C, Ferrando N, Kittel J, Frégonèse M, Normand B, Cassagne T, Ropital F, Bonis M. pH prediction in concentrated aqueous solutions under high pressure of acid gases and high temperature Corrosion Science. 73: 143-149. DOI: 10.1016/J.Corsci.2013.04.002 |
0.365 |
|
2012 |
Ferrando N, Lachet V, Boutin A. Transferable force field for carboxylate esters: application to fatty acid methylic ester phase equilibria prediction. The Journal of Physical Chemistry. B. 116: 3239-48. PMID 22369235 DOI: 10.1021/Jp212060U |
0.612 |
|
2012 |
Ferrando N, de Hemptinne JC, Mougin P, Passarello JP. Prediction of the PC-SAFT associating parameters by molecular simulation. The Journal of Physical Chemistry. B. 116: 367-77. PMID 22126437 DOI: 10.1021/Jp209313A |
0.43 |
|
2012 |
El Ahmar E, Valtz A, Ferrando N, Coquelet C, Mougin P. Vapor–Liquid Equilibrium (PTxy) Measurements and Modeling for the CO–C2H4Binary System Journal of Chemical & Engineering Data. 57: 2744-2749. DOI: 10.1021/Je300599P |
0.303 |
|
2012 |
Saldana DA, Starck L, Mougin P, Rousseau B, Ferrando N, Creton B. Prediction of density and viscosity of biofuel compounds using machine learning methods Energy and Fuels. 26: 2416-2426. DOI: 10.1021/Ef3001339 |
0.357 |
|
2012 |
Rozmus J, de Hemptinne J, Ferrando N, Mougin P. Long chain multifunctional molecules with GC-PPC-SAFT: Limits of data and model Fluid Phase Equilibria. 329: 78-85. DOI: 10.1016/J.Fluid.2012.06.004 |
0.409 |
|
2011 |
Ferrando N, Lachet V, Pérez-Pellitero J, Mackie AD, Malfreyt P, Boutin A. A transferable force field to predict phase equilibria and surface tension of ethers and glycol ethers. The Journal of Physical Chemistry. B. 115: 10654-64. PMID 21800821 DOI: 10.1021/Jp203278T |
0.639 |
|
2010 |
Ferrando N, Lachet V, Boutin A. Monte Carlo simulations of mixtures involving ketones and aldehydes by a direct bubble pressure calculation. The Journal of Physical Chemistry. B. 114: 8680-8. PMID 20540589 DOI: 10.1021/Jp1031724 |
0.641 |
|
2010 |
Ferrando N, Defiolle D, Lachet V, Boutin A. Ethanoled gasoline bubble pressure determination: Experimental and Monte Carlo modeling Fluid Phase Equilibria. 299: 132-140. DOI: 10.1016/J.Fluid.2010.09.020 |
0.582 |
|
2009 |
Ferrando N, Lachet V, Teuler JM, Boutin A. Transferable force field for alcohols and polyalcohols. The Journal of Physical Chemistry. B. 113: 5985-95. PMID 19344171 DOI: 10.1021/Jp810915Z |
0.602 |
|
2009 |
Tran TKS, NguyenHuynh D, Ferrando N, Passarello J, de Hemptinne J, Tobaly P. Modeling VLE of H2+ Hydrocarbon Mixtures Using a Group Contribution SAFT with akijCorrelation Method Based on London’s Theory Energy & Fuels. 23: 2658-2665. DOI: 10.1021/Ef801101Z |
0.306 |
|
2007 |
Ferrando N, Ungerer P. Hydrogen/hydrocarbon phase equilibrium modelling with a cubic equation of state and a Monte Carlo method Fluid Phase Equilibria. 254: 211-223. DOI: 10.1016/J.Fluid.2007.03.016 |
0.393 |
|
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