Roda Bounaceur

Publications

Article dans une revue (96)

Accurate prediction of ideal gas heat capacity C(T) using machine learning: data augmentation and ensemble learning for robust thermodynamic modeling Roda Bounaceur,Francisco Paes,Jean-Noël Jaubert,Romain Privat Chemical Engineering Journal Advances, 2026, 26, pp.101140. ⟨10.1016/j.ceja.2026.101140⟩ Article dans une revue hal-05561662v1
Gas-phase oxidation chemistry of the three cresol isomers Olivier Herbinet,Ismahane Meziane,Nicolas Delort,Roda Bounaceur,Hans-Heinrich Carstensenet al. Progress in Reaction Kinetics and Mechanism, 2026, 51, ⟨10.48130/prkm-0025-0027⟩ Article dans une revue hal-05490379v1
A Multimodal Learning Model based on a QSPR approach for the estimation of RON, MON and CN, for any C, H, O hydrocarbons Roda Bounaceur,Nicolas Barthélemy,Nicolas Delort,Olivier Herbinet,Frédérique Battin-Leclerc Fuel, 2025, 381, ⟨10.1016/j.fuel.2024.133438⟩ Article dans une revue hal-04774114v1
Experimental and modeling study of the laminar burning velocity of C7-C9 aromatic hydricarbons and C7-C8 aromatic oxygenates Nicolas Delort,Olivier Herbinet,Roda Bounaceur,Frédérique Battin-Leclerc Combustion and Flame, 2025, 273, pp.113915. ⟨10.1016/j.combustflame.2024.113915⟩ Article dans une revue hal-05350822v1
Automatization of theoretical kinetic data generation for tabulated TS models building -Part III: C-H and C-C β-scissions in alkyl radicals F.C. Destro,R. Fournet,G.B. de Souza,T. Fages,R. Bounaceuret al. Combustion and Flame, 2025, pp.114445. ⟨10.1016/j.combustflame.2025.114445⟩ Article dans une revue hal-05290766v1
AI-powered prediction of critical properties and boiling points: a hybrid ensemble learning and QSPR approach Roda Bounaceur,Francisco Paes,Romain Privat,Jean-Noël Jaubert Journal of Cheminformatics, 2025, 17 (132), ⟨10.1186/s13321-025-01062-9⟩ Article dans une revue hal-05230313v1
Automatization of theoretical kinetic data generation for tabulated TS models building - Part II: 1,2 to 1,5-H-shift reactions in alkyl radicals F.C. Destro,R. Fournet,R. Bounaceur,V. Warth,P.A. Glaudeet al. Combustion and Flame, In press, pp.113732. ⟨10.1016/j.combustflame.2024.113732⟩ Article dans une revue hal-04767708v1
An extensively validated C/H/O/N chemical network for hot exoplanet disequilibrium chemistry R Veillet,Olivia Venot,Baptiste Sirjean,R. Bounaceur,Pierre-Alexandre Glaudeet al. Astronomy & Astrophysics - A&A, 2024, 682, pp.A52. ⟨10.1051/0004-6361/202346680⟩ Article dans une revue hal-04730405v1
An experimental and modeling investigation of the combustion of anisole and guaiacol N. Delort,I. Meziane,M. Framinet,R. Bounaceur,Jérémy Bourgalaiset al. Fuel, 2024, 362, pp.130832. ⟨10.1016/j.fuel.2023.130832⟩ Article dans une revue hal-04400185v1
Automatization of theoretical kinetic data generation for tabulated TS models building - Part 1: Application to 1,3-H-shift reactions F.C. Destro,R. Fournet,Roda Bounaceur,V. Warth,P.A. Glaudeet al. Combustion and Flame, 2024, 270, pp.113731. ⟨10.1016/j.combustflame.2024.113731⟩ Article dans une revue hal-04767685v1
Development of an Artificial Intelligence Model to Predict Combustion Properties, With a Focus on Auto-Ignition Delay Roda Bounaceur,Romain Heymes,Pierre-Alexandre Glaude,Baptiste Sirjean,René Fournetet al. Journal of Engineering for Gas Turbines and Power, 2024, 146, pp.061011. ⟨10.1115/1.4063774⟩ Article dans une revue hal-04406508v1
A comparative study of the oxidation of toluene and the three isomers of xylene Ismahane Meziane,Nicolas Delort,Olivier Herbinet,Roda Bounaceur,Frédérique Battin-Leclerc Combustion and Flame, 2023, 257 (2), pp.113046. ⟨10.1016/j.combustflame.2023.113046⟩ Article dans une revue hal-04227772v1
Membrane Processes for Direct Carbon Dioxide Capture From Air: Possibilities and Limitations Christophe Castel,Roda Bounaceur,Eric Favre Frontiers in Chemical Engineering, 2021, 3, ⟨10.3389/fceng.2021.668867⟩ Article dans une revue hal-03239378v1
Development of a Detailed Kinetic Model for the Oxidation of n -Butane in the Liquid Phase M. Le,V. Warth,L. Giarracca,E. Moine,R. Bounaceuret al. Journal of Physical Chemistry B, 2021, 125 (25), pp.6955-6967. ⟨10.1021/acs.jpcb.1c02988⟩ Article dans une revue hal-03324875v1
Emissions from a Domestic Wood Heating Appliance: Experimental Measurements and Numerical Study Using an Equivalent Reactor Network (ERN) Approach Coupled with a Detailed Chemical Mechanism Joseph Darido,Amal Dhahak,Roda Bounaceur,Céline Le Dreff - Lorimier,Gontrand Leyssenset al. Energy & Fuels, 2021, 35, pp.18680 - 18698. ⟨10.1021/acs.energyfuels.1c01927⟩ Article dans une revue hal-03436803v1
Engineering of Membrane Gas Separation Processes: State of The Art and Prospects Christophe Castel,Roda Bounaceur,Eric Favre Journal of Membrane Science and Research, 2020, ⟨10.22079/JMSR.2020.123897.1363⟩ Article dans une revue hal-02873050v1
The deep composition of Uranus and Neptune from in situ exploration and thermochemical modeling Thibault Cavalié,Olivia Venot,Yamila Miguel,Leigh N. Fletcher,Peter Wurzet al. Space Science Reviews, 2020, ⟨10.1007/s11214-020-00677-8⟩ Article dans une revue hal-02559251v1
New chemical scheme for giant planet thermochemistry Olivia Venot,Thibault Cavalié,Roda Bounaceur,Pascal Tremblin,Lothaire Brouillardet al. Astronomy & Astrophysics - A&A, 2020, 634, pp.A78. ⟨10.1051/0004-6361/201936697⟩ Article dans une revue hal-02415369v1
INFLUENCE OF H 2 S ON THE THERMAL CRACKING OF ALKYLBENZENES AT HIGH PRESSURE (70 MPA) AND MODERATE TEMPERATURE (583-623 K) V. Burklé-Vitzthum,N.C. C Leguizamon Guerra,C. Lorgeoux,D. Faure-Catteloin,R. Bounaceuret al. Journal of Analytical and Applied Pyrolysis, 2019, 140, pp.423-433. ⟨10.1016/j.jaap.2019.04.025⟩ Article dans une revue hal-02370894v1
Development of a detailed kinetic model for the combustion of biomass Amal Dhahak,Roda Bounaceur,Céline Le Dreff-Lorimier,Guillaume Schmidt,Gwenaëlle Trouveet al. Fuel, 2019, 242, pp.756-774. ⟨10.1016/j.fuel.2019.01.093⟩ Article dans une revue hal-02390760v1
Reduced chemical scheme for modelling warm to hot hydrogen-dominated atmospheres Olivia Venot,Roda Bounaceur,M. Dobrijevic,Eric Hébrard,T. Cavaliéet al. Astronomy & Astrophysics - A&A, 2019, 624, pp.A58. ⟨10.1051/0004-6361/201834861⟩ Article dans une revue hal-02051741v1
Establishing the Maximum Carbon Number for Reliable Quantitative Gas Chromatographic Analysis of Heavy Ends Hydrocarbons. Part 3. Coupled Pyrolysis-GC Modeling Diana Hernandez-Baez,Alastair Reid,Antonin Chapoy,Bahman Tohidi,Roda Bounaceur Energy & Fuels, 2019, 33 (3), pp.2045-2056. ⟨10.1021/acs.energyfuels.8b03716⟩ Article dans une revue hal-02086480v1
Simulation of Post‐Combustion CO 2 Capture, a Comparison among Absorption, Adsorption and Membranes Hélène Anselmi,Olivier Mirgaux,Roda Bounaceur,Fabrice Patisson Chemical Engineering and Technology, 2019, 42 (4), pp.797-804. ⟨10.1002/ceat.201800667⟩ Article dans une revue hal-02086479v1
Thermal cracking of n -butylbenzene at high pressure: Experimental study and kinetic modelling N.C. C Leguizamon Guerra,J.C. C Lizardo Huerta,C. Lorgeoux,R. Michels,R. Fournetet al. Journal of Analytical and Applied Pyrolysis, 2018, 133, pp.234-245. ⟨10.1016/j.jaap.2018.03.016⟩ Article dans une revue hal-02370755v1
Kinetic modeling of 1-methylnaphthalene pyrolysis at high pressure (100 bar) Roda Bounaceur,Jean-Philippe Leininger,François Lorant,Paul-Marie Marquaire,Valérie Burklé-Vitzthum Journal of Analytical and Applied Pyrolysis, 2017, 124, pp.542 - 562. ⟨10.1016/j.jaap.2017.01.027⟩ Article dans une revue hal-01523545v1
Kinetic parameters for the thermal cracking of simple hydrocarbons: From laboratory to geological time-temperature conditions V. Burklé-Vitzthum,R. Bounaceur,Raymond Michels,G. Scacchi,P.-M. Marquaire Journal of Analytical and Applied Pyrolysis, 2017, 125, pp.40-49. ⟨10.1016/j.jaap.2017.04.020⟩ Article dans une revue hal-03554606v1
Thermal cracking of 1-n-butyldecalin at high pressure (100 bar) Darwin Rakotoalimanana,Roda Bounaceur,Baptiste Sirjean,Françoise Béhar,Valérie Burklé-Vitzthumet al. Journal of Analytical and Applied Pyrolysis, 2017, 123, pp.204-215. ⟨10.1016/j.jaap.2016.12.001⟩ Article dans une revue hal-02135989v1
Evaluating the effects of CO 2 capture benchmarks on efficiency and costs of membrane systems for post-combustion capture: A parametric simulation study Lorena Giordano,Denis Roizard,Roda Bounaceur,Eric Favre International Journal of Greenhouse Gas Control, 2017, 63, pp.449-461. ⟨10.1016/j.ijggc.2017.05.002⟩ Article dans une revue hal-01984016v1
Thermal cracking of n-butylcyclohexane at high pressure (100bar) - Part 1: experimental study Darwin A. Rakotoalimanana,Françoise Béhar,Roda Bounaceur,Valérie Burklé-Vitzthum,Paul-Marie Marquaire Journal of Analytical and Applied Pyrolysis, 2016, 117, pp.1-16. ⟨10.1016/j.jaap.2015.11.009⟩ Article dans une revue istex hal-01238141v1
Influence of pressure (100Pa–100Mpa) on the pyrolysis of an alkane at moderate temperature (603K–723K): Experiments and kinetic modeling R. Bounaceur,F. Lannuzel,R. Michels,G. Scacchi,P.‐m. Marquaireet al. Journal of Analytical and Applied Pyrolysis, 2016, 122, pp.442 - 451. ⟨10.1016/j.jaap.2016.10.022⟩ Article dans une revue hal-01412810v1
Thermal cracking of n-butylcyclohexane at high pressure (100bar)—Part 2: Mechanistic modeling Darwin A. Rakotoalimanana,Roda Bounaceur,Françoise Béhar,Valérie Burklé-Vitzthum,Paul-Marie Marquaire Journal of Analytical and Applied Pyrolysis, 2016, 120, pp.174-185. ⟨10.1016/j.jaap.2016.05.003⟩ Article dans une revue istex hal-01331132v1
Prediction of auto-ignition temperatures and delays for gas turbine applications Roda Bounaceur,Pierre-Alexandre Glaude,Baptiste Sirjean,René Fournet,Pierre Montagneet al. Journal of Engineering for Gas Turbines and Power, 2016, 138, pp.021505. ⟨10.1115/1.4031264⟩ Article dans une revue hal-01241520v1
Interplay of inlet temperature and humidity on energy penalty for CO2 post-combustion capture: Rigorous analysis and simulation of a single stage gas permeation process Lorena Giordano,Denis Roizard,Roda Bounaceur,Eric Favre Energy, 2016, 116, pp.517 - 525. ⟨10.1016/j.energy.2016.09.129⟩ Article dans une revue hal-01412813v1
Rigorous variable permeability modelling and process simulation for the design of polymeric membrane gas separation units: MEMSIC simulation tool Roda Bounaceur,Etienne Berger,Marc Pfister,Alvaro Andres Ramirez Santos,Eric Favre Journal of Membrane Science, 2016, 523, pp.77 - 91. ⟨10.1016/j.memsci.2016.09.011⟩ Article dans une revue hal-01412812v1
Intramolecular effects on the kinetics of unimolecular reactions of β-HOROO˙ and HOQ˙OOH radicals J. C. Lizardo-Huerta,B. Sirjean,R. Bounaceur,R. Fournet Physical Chemistry Chemical Physics, 2016, 18 (17), ⟨10.1039/c6cp00111d⟩ Article dans une revue hal-01309238v1
Pyrolysis of n- octane at very low concentration and low temperature N. Razafinarivo,R. Bounaceur,V. Burklé-Vitzthum,F. Lannuzel,R. Michelset al. Journal of Analytical and Applied Pyrolysis, 2016, 117, pp.282-289. ⟨10.1016/j.jaap.2015.11.004⟩ Article dans une revue hal-02930918v1
Data supporting the validation of a simulation model for multi-component gas separation in polymeric membranes Lorena Giordano,Denis Roizard,Roda Bounaceur,Eric Favre Data in Brief, 2016, Data in Brief, 9, pp.776-780. ⟨10.1016/j.dib.2016.10.019⟩ Article dans une revue hal-01412805v1
Measurements of Laminar Burning Velocities above Atmospheric Pressure Using the Heat Flux Method—Application to the Case of n-Pentane Patricia Dirrenberger,Hervé Le Gall,Roda Bounaceur,Pierre-Alexandre Glaude,Frédérique Battin-Leclerc Energy & Fuels, 2015, 29 (1), pp.398-404. ⟨10.1021/ef502036j⟩ Article dans une revue hal-01169274v1
The oxidation of large alkylbenzenes: An experimental and modeling study Frédérique Battin-Leclerc,Valérie Warth,Roda Bounaceur,Benoit Husson,Olivier Herbinetet al. Proceedings of the Combustion Institute, 2015, 35, pp.349 - 356. ⟨10.1016/j.proci.2014.05.087⟩ Article dans une revue hal-01099843v1
New chemical scheme for studying carbon-rich exoplanet atmospheres O. Venot,Eric Hébrard,M. Agúndez,Leen Decin,Roda Bounaceur Astronomy & Astrophysics - A&A, 2015, 577, pp.1-12. ⟨10.1051/0004-6361/201425311⟩ Article dans une revue hal-01169272v1
Pushing the limits of intensified CO2 post-combustion capture by gas–liquid absorption through a membrane contactor E. Chabanon,R. Bounaceur,Christophe Castel,Sabine Rode,D. Roizardet al. Chemical Engineering and Processing: Process Intensification, 2015, 91, pp.7 - 22. ⟨10.1016/j.cep.2015.03.002⟩ Article dans une revue hal-01921443v1
Experimental and modeling study of burning velocities for alkyl aromatic components relevant to diesel fuels Marco Mehl,Olivier Herbinet,Patricia Dirrenberger,Roda Bounaceur,Pierre-Alexandre Glaudeet al. Proceedings of the Combustion Institute, 2015, 35, pp.341 - 348. ⟨10.1016/j.proci.2014.06.064⟩ Article dans une revue hal-01099836v1
Experimental and Modeling Investigation of the Low-Temperature Oxidation of Dimethyl Ether Anne Rodriguez,Ophélie Frottier,Olivier Herbinet,René Fournet,Roda Bounaceuret al. Journal of Physical Chemistry A, 2015, 119, pp.7905-7923. ⟨10.1021/acs.jpca.5b01939⟩ Article dans une revue hal-01178238v1
An experimental and modeling study of the combustion of tetrahydrofuran Luc-Sy Tran,Marco Verdicchio,Fabiola Monge,Roberto Colino Martin,Roda Bounaceuret al. Combustion and Flame, 2015, 162 (5), pp.1899-1918. ⟨10.1016/j.combustflame.2014.12.010⟩ Article dans une revue hal-01169277v1
Kinetic modelling of char gasification by accounting for the evolution of the reactive surface area André Zoulalian,Roda Bounaceur,Anthony Dufour Chemical Engineering Science, 2015, 138, pp.280-290. ⟨10.1016/j.ces.2015.07.035⟩ Article dans une revue hal-01196324v1
Laminar burning velocity of gasolines with addition of ethanol Patricia Dirrenberger,Pierre-Alexandre Glaude,Roda Bounaceur,Hervé Le Gall,Antonio Pires da Cruzet al. Fuel, 2014, 115, pp.162-169. ⟨10.1016/j.fuel.2013.07.015⟩ Article dans une revue hal-00853563v1
Combustion and oxidation kinetics of alternative gas turbines fuels Pierre-Alexandre Glaude,Baptiste Sirjean,René Fournet,Roda Bounaceur,Matthieu Vierlinget al. Proceedings of ASME, 2014, Paper No. GT2014-25070, pp. V03AT03A001; 10 p. ⟨10.1115/GT2014-25070⟩ Article dans une revue hal-01070016v1
Determining predictive uncertainties and global sensitivities for large parameter systems: A case study for n-butane oxidation Eric Hébrard,Alison Tomlin,Roda Bounaceur,Frédérique Battin-Leclerc Proceedings of the Combustion Institute, 2014, pp.10. ⟨10.1016/j.proci.2014.06.027⟩ Article dans une revue hal-01051996v1
Establishing the Maximum Carbon Number for Reliable Quantitative Gas Chromatographic Analysis of Heavy Ends Hydrocarbons. Part 2. Migration and Separation Gas Chromatography Modeling Diana M. Hernandez-Baez,Alastair Reid,Antonin Chapoy,Bahman Tohidi,Roda Bounaceur Energy & Fuels, 2013, 27 (4), pp.2336-2350. ⟨10.1021/ef302009n⟩ Article dans une revue hal-01169279v1
Mechanistic modeling of the thermal cracking of methylcyclohexane near atmospheric pressure, from 523 to 1273 K: Identification of aromatization pathways Roda Bounaceur,Valerie Burkle-Vitzthum,Paul-Marie Marquaire,Luc Fusetti Journal of Analytical and Applied Pyrolysis, 2013, 103, pp.240-254. ⟨10.1016/j.jaap.2013.02.012⟩ Article dans une revue istex hal-00861582v1
Kinetic study of abatement of low concentration of dibenzofuran by oxidation - Effects of co-reactants Isabelle Ziegler-Devin,Roda Bounaceur,Christelle Perrin,Ralf Wörner,Fabrice Patissonet al. The Chemical Engineering Journal, 2013, 218, pp.154-163. ⟨10.1016/j.cej.2012.12.023⟩ Article dans une revue istex hal-00808524v1
A chemical model for the atmosphere of hot Jupiters O. Venot,Eric Hébrard,M. Agúndez,M. Dobrijevic,Franck Selsiset al. Astronomy & Astrophysics - A&A, 2012, 546, id.A43, 19 pp. ⟨10.1051/0004-6361/201219310⟩ Article dans une revue hal-00764601v1
Evaluating the intensification potential of membrane contactors for gas absorption in a chemical solvent: A generic one-dimensional methodology and its application to CO2 absorption in monoethanolamine S. Rode,P.T. Nguyen,D. Roizard,R. Bounaceur,C. Castelet al. Journal of Membrane Science, 2012, 389, pp.1-16. ⟨10.1016/j.memsci.2011.09.042⟩ Article dans une revue istex hal-00678839v1
Experimental and modeling study of the oxidation of n-butylbenzene Benoit Husson,Roda Bounaceur,Kotaro Tanaka,Maude Ferrari,Olivier Herbinetet al. Combustion and Flame, 2012, 159 (4), pp.1399-1416. ⟨10.1016/j.combustflame.2011.12.006⟩ Article dans une revue hal-00726401v1
JTHERGAS: Thermodynamic estimation from 2D graphical representations of molecules E. Blurock,V. Warth,X. Grandmougin,R. Bounaceur,P.A. Glaudeet al. Energy, 2012, 43 ((1)), pp.161-171. ⟨10.1016/j.energy.2012.01.072⟩ Article dans une revue hal-00708125v1
Membrane contactors for intensified post combustion carbon dioxide capture by gas–liquid absorption in MEA: A parametric study R. Bounaceur,Christophe Castel,Sabine Rode,D. Roizard,Eric Favre Chemical Engineering Research and Design, 2012, 90 (12), pp.2325-2337. ⟨10.1016/j.cherd.2012.05.004⟩ Article dans une revue istex hal-01168991v1
Towards cleaner combustion engines through groundbreaking detailed chemical kinetic models Frédérique Battin-Leclerc,Edward Blurock,Roda Bounaceur,René Fournet,Pierre Alexandre Glaudeet al. Chemical Society Reviews, 2011, ⟨10.1039/C0CS00207K⟩ Article dans une revue hal-00602695v1
Thermal evolution of n- and iso-alkanes in oils. Part 1: Pyrolysis model for a mixture of 78 alkanes (C1-C32) including 13,206 free radical reactions V. Burklé-Vitzthum,R. Bounaceur,P.M. Marquaire,F. Montel,L. Fusetti Organic Geochemistry, 2011, 42 ((5)), pp. 439-450. ⟨10.1016/j.orggeochem.2011.03.017⟩ Article dans une revue istex hal-00606713v1
Oxidation of Small Unsaturated Methyl and Ethyl Esters H. Bennadji,L. Coniglio,F. Billaud,R. Bounaceur,V. Warthet al. International Journal of Chemical Kinetics, 2011, 43 ((4)), pp. 204-218. ⟨10.1002/kin.20536⟩ Article dans une revue istex hal-00576365v1
Establishing the Maximum Carbon Number for Reliable Quantitative Gas Chromatographic Analysis of Heavy Ends Hydrocarbons. Part 1: Low-Conversion Thermal Cracking Modeling Hernandez-Baez Diana M.,B. Tohidi,A. Chapoy,R. Bounaceur,A. Reid Energy & Fuels, 2011, ⟨10.1021/ef201372q⟩ Article dans une revue hal-00656415v1
Modelling intra-particle phenomena of biomass pyrolysis Anthony Dufour,Bajil Ouartassi,Roda Bounaceur,André Zoulalian Chemical Engineering Research and Design, 2011, 89 (10A), pp.2136-2146. ⟨10.1016/j.cherd.2011.01.005⟩ Article dans une revue istex hal-00778155v1
Measurements of Laminar Flame Velocity for Components of Natural Gas Patricia Dirrenberger,Hervé Le Gall,Roda Bounaceur,Olivier Herbinet,Pierre-Alexandre Glaudeet al. Energy & Fuels, 2011, 25 (9), pp.3875-3884. ⟨10.1021/ef200707h⟩ Article dans une revue hal-00776646v1
An extended mechanism including high pressure conditions (700 bar) for toluene pyrolysis. Frédéric Lannuzel,Roda Bounaceur,Raymond Michels,Gérard Scacchi,Paul-Marie Marquaire Journal of Analytical and Applied Pyrolysis, 2010, 87, pp.236-247. ⟨10.1016/j.jaap.2010.01.001⟩ Article dans une revue istex hal-00468341v1
Modelling of Weak Acid Conversion in an EDI Cell F. Schab,L. Muhr,R. Bounaceur,M.-A. Théoleyre,G. Grevillot Separation Science and Technology, 2010, 45 (8), pp.1015-1024. ⟨10.1080/01496391003727882⟩ Article dans une revue hal-00482688v1
Adiabatic flame temperature from biofuels and fossil fuels and derived effect on NOx emissions P.A. Glaude,R. Fournet,R. Bounaceur,M. Molière Fuel Processing Technology, 2010, 91 (2), pp.229-235. ⟨10.1016/j.fuproc.2009.10.002⟩ Article dans une revue istex hal-00540772v1
Modelling of Weak Acid Conversion in an EDl Cell Frédéric Schab,L. Muhr,R. Bounaceur,Marc-André Théoleyre,Georges Grévillot Separation Science and Technology, 2010, 45 (8), pp.1015-1024. ⟨10.1080/01496391003727882⟩ Article dans une revue hal-00609849v1
Thermal and kinetic impact of CO, CO2 and H2O on the postoxidation of IC-engine exhaust gases Jörg Anderlohr,Antonio Pires da Cruz,Roda Bounaceur,Frédérique Battin-Leclerc Combustion Science and Technology, 2010, 182 (1), pp.39-59. ⟨10.1080/00102200903190844⟩ Article dans une revue hal-00799039v1
Reassessment of the Kinetic Influence of Toluene on n-Alkane Pyrolysis F. Lannuzel,R. Bounaceur,R. Michels,G. Scacchi,P.M. Marquaire Energy & Fuels, 2010, 24 (7), pp.3817-3830. ⟨10.1021/ef100253z⟩ Article dans une revue hal-00517653v1
Modeling the Laminar Flame Speed of Natural Gas and Gasoline Surrogates Roda Bounaceur,Olivier Herbinet,Pierre Alexandre Glaude,René Fournet,Frédérique Battin Leclercet al. SAE, 2010, pp.2010-01-0546. ⟨10.4271/2010-01-0546⟩ Article dans une revue hal-01169466v1
An experimental and kinetic modeling study of the autoignition of a-methylnaphthalene/air and a methylnaphthalene/n-decane/air mixtures at elevated pressures H. Wang,S.J. Warner,M.A. Oehlschlaeger,R. Bounaceur,J. Bietet al. Combustion and Flame, 2010, 157, pp. 1976-1988. ⟨10.1016/j.combustflame.2010.04.007⟩ Article dans une revue istex hal-00609624v1
New insights into secondary gas generation from oil thermal cracking. A kinetic approach using 1,2,4-trimethylbenzene. Part I: A free-radical mechanism Luc Fusetti,Françoise Behar,Roda Bounaceur,Paul-Marie Marquaire,K. Griceet al. Organic Geochemistry, 2010, 41, pp.146-167 Article dans une revue bioemco-00456092v1
Compartmental Modeling of a Structured Heat Exchanger Reactor: Conversion and Temperature Profiles Predictions M. Vafaei-Alamdari,R. Bounaceur,J.P. Leclerc,P. Tochon,F. Chopard Journal of chemical engineering of Japan, 2009, 42 (Supplément 1), pp.111-118. ⟨10.1252/jcej.08we140⟩ Article dans une revue hal-00508826v1
New insights into secondary gas generation from the thermal cracking of oil: Methylated monoaromatics. A kinetic approach using 1,2,4-trimethylbenzene. Part I: A mechanistic kinetic model Luc Fusetti,Françoise Behar,Roda Bounaceur,Paul-Marie Marquaire,K. Griceet al. Organic Geochemistry, 2009, 2010 (41), pp.146-167. ⟨10.1016/j.orggeochem.2009.10.013⟩ Article dans une revue istex bioemco-00575467v1
Influence of EGR compounds on the oxidation of an HCCI-diesel surrogate Jörg Anderlohr,A. Piperel,A. Pires da Cruz,Roda Bounaceur,Frédérique Battin-Leclercet al. Proceedings of the Combustion Institute, 2009, 32 (2), pp.2851-2859. ⟨10.1016/j.proci.2008.06.019⟩ Article dans une revue hal-00369808v1
CO2/N2 Reverse Selective Gas Separation Membranes: Technological Opportunities and Scientific Challenges Eric Favre,Denis Roizard,Roda Bounaceur,William J. Koros Industrial and engineering chemistry research, 2009, 48 (7), pp.3700-3701. ⟨10.1021/ie801923w⟩ Article dans une revue hal-01168987v1
A hybrid process combining oxygen enriched air combustion and membrane separation for post-combustion carbon dioxide capture Eric Favre,Roda Bounaceur,Denis Roizard Separation and Purification Technology, 2009, 68 (1), pp.30-36. ⟨10.1016/j.seppur.2009.04.003⟩ Article dans une revue hal-01168988v1
Reaction Mechanisms in Petroleum: From Experimentation to Upgrading and Geological Conditions Frédéric Lannuzel,Valérie Burklé-Vitzthum,Roda Bounaceur,Paul-Marie Marquaire,Raymond Michels Chemical Physics, 2009, pp.1-6 Article dans une revue hal-01169717v1
Biogas, membranes and carbon dioxide capture Eric Favre,Roda Bounaceur,Denis Roizard Journal of Membrane Science, 2009, 328 (1-2), pp.11-14. ⟨10.1016/j.memsci.2008.12.017⟩ Article dans une revue istex hal-01168989v1
Modeling of autoignition and NO sensitization for the oxidation of IC engine surrogate fuels Jörg Anderlohr,Roda Bounaceur,A. Pires da Cruz,Frédérique Battin-Leclerc Combustion and Flame, 2009, 156, pp.505-521. ⟨10.1016/j.combustflame.2008.09.009⟩ Article dans une revue hal-00369907v1
Influence of the position of the double bond on the autoignition of linear alkenes at low temperature Roda Bounaceur,Valérie Warth,Baptiste Sirjean,Pierre-Alexandre Glaude,René Fournetet al. Proceedings of the Combustion Institute, 2009, 32, pp.387-394. ⟨10.1016/j.proci.2008.05.009⟩ Article dans une revue hal-00369856v1
Procedures of Optimisation of Postcombustion Reactions Leading to Abatement of Dioxin Emissions Paul-Marie Marquaire,Isabelle Ziegler-Devin,Roda Bounaceur,François Baronnet Organohalogen Compounds, 2008, 70, pp.1764-1767 Article dans une revue hal-00350484v1
Chemical impact of CO and H2 addition on the auto-ignition delay of homogeneous n-heptane/air mixtures G. Subramanian,A. Pires da Cruz,Roda Bounaceur,L. Vervisch Combustion Science and Technology, 2007, 179 (9), pp.1937-1962. ⟨10.1080/00102200701386065⟩ Article dans une revue hal-00195275v1
Kinetic modelling of a surrogate diesel fuel applied to 3D auto-ignition in HCCI engines. Roda Bounaceur,Pierre-Alexandre Glaude,René Fournet,Frédérique Battin-Leclerc,S. Jayet al. International Journal Vehicle Design, 2007, 44 (1/2), pp.124 - 142 Article dans une revue hal-00139845v1
Experimental and modeling study of the oxidation of xylenes. Frédérique Battin-Leclerc,Roda Bounaceur,Pierre-Alexandre Glaude,Najib Belmekki International Journal of Chemical Kinetics, 2006, 38, pp.284-302. ⟨10.1002/kin.20160⟩ Article dans une revue hal-00020604v1
Membrane processes for post-combustion carbon dioxide capture: A parametric study R. Bounaceur,N. Lape,D. Roizard,C. Vallieres,E. Favre Energy, 2006, 31, pp.2556-2570. ⟨10.1016/j.energy.2005.10.038⟩ Article dans une revue istex hal-00282688v1
Primary reactions of the thermal decomposition of tricyclodecane. Olivier Herbinet,Baptiste Sirjean,Roda Bounaceur,René Fournet,Frédérique Battin-Leclercet al. Journal of Physical Chemistry A, 2006, 110 (39), pp.11298-11314. ⟨10.1021/jp0623802⟩ Article dans une revue hal-00139755v1
Experimental study and modeling of the role of hydronaphthalenics on the thermal stability of hydrocarbons under laboratory and geological conditions. V. Burklé-Vitzthum,R. Michels,R. Bounaceur,P.M. Marquaire,G. Scacchi Industrial and engineering chemistry research, 2005, 44, pp.8972-8987. ⟨10.1021/ie050381v⟩ Article dans une revue istex hal-00021753v1
Experimental and modelling study of the oxidation of toluene. Roda Bounaceur,Isabelle da Costa,René Fournet,Francis Billaud,Frédérique Battin-Leclerc Int. J. Chem. Kin., 2005, 30 (37), pp.25-49. ⟨10.1002/kin.20047⟩ Article dans une revue istex hal-00200072v1
Progress toward a unified detailed kinetic model for the autoignition of alkanes from C4 to C10 between 600 et 1200 K. Frédéric Buda,Roda Bounaceur,Valérie Warth,Pierre-Alexandre Glaude,René Fournetet al. Combustion and Flame, 2005, 142, pp.170-186. ⟨10.1016/j.combustflame.2005.03.005⟩ Article dans une revue istex hal-00021363v1
Experimental and modelling investigation of the thermal decomposition of n-dodecane K.D. Dahm,P.S. Virk,R. Bounaceur,F. Battin-Leclerc,P.M. Marquaireet al. Journal of Analytical and Applied Pyrolysis, 2004, 71 (2), pp.865-881. ⟨10.1016/j.jaap.2003.11.005⟩ Article dans une revue hal-01168736v1
DETAILED MECHANISM OF DIBENZOFURAN OXIDATION Paul-Marie Marquaire,Roda Bounaceur,Francois Baronnet Organohalogen Compounds, 2003, 63, pp.377-380 Article dans une revue hal-01168746v1
Inhibiting Effect of Tetralin on the Pyrolytic Decomposition of Hexadecane. Comparison with Toluene Roda Bounaceur,Gérard Scacchi,Paul-Marie Marquaire,Florent Dominé,Olivier Brévartet al. Industrial and engineering chemistry research, 2002, 41 (19), pp.4689-4701. ⟨10.1021/ie0108853⟩ Article dans une revue istex hal-01168768v1
Modeling of hydrocarbons pyrolysis at low temperature. Automatic generation of free radicals mechanisms Roda Bounaceur,Valérie Warth,Paul-Marie Marquaire,Gérard Scacchi,Florent Dominéet al. Journal of Analytical and Applied Pyrolysis, 2002, 64 (1), pp.103-122. ⟨10.1016/S0165-2370(01)00173-5⟩ Article dans une revue istex hal-01168760v1
Up to what temperature is petroleum stable? New insights from a 5200 free radical reactions model Florent Dominé,Roda Bounaceur,Gerard Scacchi,Paul-Marie Marquaire,Daniel Dessortet al. Organic Geochemistry, 2002, 33 (12), pp.1487-1499. ⟨10.1016/S0146-6380(02)00108-0⟩ Article dans une revue hal-01168752v1
Mechanistic Modeling of the Thermal Cracking of Tetralin Roda Bounaceur,Gérard Scacchi,Paul-Marie Marquaire,Florent Dominé Industrial and engineering chemistry research, 2000, 39 (11), pp.4152-4165. ⟨10.1021/ie000276f⟩ Article dans une revue istex hal-01168770v1
Chemical lumping of mechanisms generated by computer. Application to the modelling of normal butane oxidation. Roda Bounaceur,Valérie Warth,Pierre Alexandre Glaude,Frédérique Battin Leclerc,Gérard Scacchiet al. Journal de Chimie Physique, 1996, pp.1472-1491. ⟨10.1051/jcp/1996931472⟩ Article dans une revue istex hal-01168794v1

Communication dans un congrès (26)

Advancing AI modeling for prediction of safety parameters for combustion of hydrogen/syngas/natural gas mixtures Roda Bounaceur,Pierre-Alexandre Glaude,René Fournet,Baptiste Sirjean,Pierre Montagneet al. ASME Turbo Expo 2024: Turbomachinery Technical Conference and Exposition, Jun 2024, London, United Kingdom. pp.GT2024-129044, ⟨10.1115/GT2024-129044⟩ Communication dans un congrès hal-04770164v1
In silico enzymatic production of metal-chelating peptides from pea proteins and simulation of their separation in IMAC Rachel Irankunda,Jairo Andrés Camaño Echavarría,Roda Bounaceur,Sarah El Hajj,Cédric Pariset al. International Symposium on Bioactive Peptides, Sep 2023, Niagara Falls, ON, Canada Communication dans un congrès hal-04258193v1
Automatization of theoretical kinetic data generation for tabulated TS models building Fabiola Citrangolo Destro,René Fournet,R. Bounaceur,Valérie Warth,Pierre-Alexandre Glaudeet al. 11the European Combustion Meeting (ECM 2023), Apr 2023, Rouen, France Communication dans un congrès hal-04561096v1
Observation en temps réel de la spéciation du soufre et de son partage entre les phases aqueuse et hydrocarbonée pendant des expériences de réduction thermochimique des sulfates Raymond Michels,Guillaume Barré,Laurent Truche,Valerie Burkle-Vitzthum,Roda Bounaceuret al. 27e édition de la Réunion des Sciences de la Terre, SGF, CNRS, Laboratoire de Géologie de Lyon ou l’étude de la Terre, des planètes et de l’environnement, Nov 2021, Lyon, France Communication dans un congrès hal-03435421v1
Dynamic optimization of low-pressure carburizing furnaces Fatima Matamoros Marin,Abderrazak Latifi,Pierre-Alexandre Glaude,Roda Bounaceur,Hubert Monnier 2021 23rd International Conference on Process Control (PC), Jun 2021, Strbske Pleso, France. pp.72-77, ⟨10.1109/PC52310.2021.9447496⟩ Communication dans un congrès hal-03344430v1
Modelization of the aeraulic in a wood-burning appliance Jean-Pierre Leclerc,Roda Bounaceur,Olivier Herbinet,Frédérique Battin Leclerc,Céline Le Dreffet al. Tracer8, 8th international Conference on Tracers and Tracing Methods, Feb 2019, Đà Nẵng, Vietnam Communication dans un congrès hal-02390721v1
New chemical schemes for atmospheric modelling : update of the methanol chemistry and reduced scheme Olivia Venot,Thibault Cavalié,Roda Bounaceur,Pascal Tremblin,Michel Dobrijevicet al. EPSC DPS Joint meeting, Sep 2019, Geneva, Switzerland Communication dans un congrès hal-03014886v1
Prediction of Flammability Limits of Gas Mixtures Containing Inert Gases Under Variable Temperature and Pressure Conditions Roda Bounaceur,Pierre-Alexandre Glaude,Baptiste Sirjean,René Fournet,Pierre Montagneet al. ASME Turbo Expo 2017: Turbomachinery Technical Conference and Exposition, Jun 2017, Charlotte, United States. ⟨10.1115/GT2017-64172⟩ Communication dans un congrès hal-05118279v1
Development of a model for auto-ignition delays and its use for the prediction of premix combustion reliability Roda Bounaceur,Pierre Alexandre Glaude,Baptiste Sirjean,René Fournet,Pierre Montagneet al. ASME Turbo Expo 2016: Turbomachinery Technical Conference and Exposition, 2016, Séoul, South Korea. ⟨10.1115/GT2016-57585⟩ Communication dans un congrès hal-01331112v1
Prediction of Auto-Ignition Temperatures and Delays for Gas Turbine Applications Roda Bounaceur,Pierre Alexandre Glaude,Baptiste Sirjean,René Fournet,Pierre Montagneet al. ASME Turbo Expo 2015: Turbine Technical Conference and Exposition, Jun 2015, Québec, Canada. ⟨10.1115/GT2015-42011⟩ Communication dans un congrès hal-01238146v1
Biomass Gasification Modeling: From Reactions to Processes Guillain Mauviel,Benjamin Cluet,Jessica François,Roda Bounaceur,Olivier Authieret al. ECCE10, ECAB3, EPIC5, Société Française de Génie des Procédés, European Federation of Chemical Engineering, Sep 2015, Nice, France Communication dans un congrès hal-01232617v1
The Nitrogen Chemistry in Hot Jupiters Atmosphere O. Venot,Eric Hébrard,M. Agúndez,Franck Selsis,F. Hersantet al. Nitrogen in planetary systems: the early evolution of the atmospheres of terrestrial planets, 2011, Barcelone, Spain. pp.67, ⟨10.1007/978-1-4614-5191-4_6⟩ Communication dans un congrès istex hal-00843429v1
Tutorial : Gas permeation : Module Design (M3Pro) R. Bounaceur,Bouchra Belaissaoui,E Chabanon 29eme EMS Summer School on Membranes : Dense Polymeric Membrane, Jul 2012, Nancy, France Communication dans un congrès hal-02101050v1
Photo-thermo-chemistry of hot Jupiters : application to HD 209458b O. Venot,Eric Hébrard,M. Dobrijevic,Franck Selsis,F. Hersantet al. EPSC-DPS Joint Meeting 2011, 2011, Nantes, France. pp.439 Communication dans un congrès hal-00665040v1
A new chemical model of the atmosphere of HD 209458b O. Venot,M. Dobrijevic,Franck Selsis,Eric Hébrard,R. Bounaceur European Planetary Science Congress 2010, 2010, rome, Italy. pp.265 Communication dans un congrès hal-00594206v1
Modélisation photochimique des atmosphères de la terre primitive et des exoplanètes. Eric Hébrard,O. Venot,Franck Selsis,M. Dobrijevic,Valentine Wakelamet al. Colloque du PNP. Septembre 2010 à Brest-Plouzané., 2010, Brest, France Communication dans un congrès hal-00998564v1
Reaction Mechanisms in Petroleum: From Experimentation to Upgrading and Geological Conditions Frédéric Lannuzel,Valérie Burklé-Vitzthum,Roda Bounaceur,Paul-Marie Marquaire,Raymond Michels 8th World Congress of Chemical Engineering, Aug 2009, Montréal, Canada. pp.Communication 806 Communication dans un congrès hal-00413637v1
Gas Turbines and Biodiesel : a Clarification of the Relative NOx Indices of Fame, Gasoil and Natural Gas Pierre-Alexandre Glaude,René Fournet,Roda Bounaceur,Michel Molière ASME Turbo Expo 2009, GT2009, Jun 2009, Orlando, Floride, United States. Paper GT2009-59623, 7 p Communication dans un congrès hal-00390700v1
Detailed kinetic models for the low-temperature auto ignition of gasoline surrogates Roda Bounaceur,Pierre-Alexandre Glaude,René Fournet,Valérie Warth,Frédérique Battin-Leclerc European Combustion Meeting 2009 (ECM 2009), Apr 2009, Vienne, Austria. CD Rom du congrès, 6 p Communication dans un congrès hal-00376724v1
Coupling of oxygen-enriched combustion and CO 2 capture by membrane processes L. Pillier,S. de Persis,Gilles Cabot,R. Bounaceur,Y. Liuet al. European Combustion Meeting (ECM), 2009, Vienna, Austria Communication dans un congrès hal-02017460v1
Theoretical kinetic study of the low temperature oxidation of ethanol René Fournet,Pierre-Alexandre Glaude,Roda Bounaceur,Michel Molière European Combustion Meeting 2009 (ECM 2009), Apr 2009, Vienne, Austria. CD-ROM du congrès, 6 p Communication dans un congrès hal-00376729v1
Prediction of the Composition in a Petroleum Reservoir at Geological Timescales Using Detailed Reaction Mechanisms and Informed Lumping Roda Bounaceur,Paul-Marie Marquaire,Gérard Scacchi,Gabriel Wild,Florent Dominé International Symposium of Chemical Reaction Engineering (ISCRE 20), Sep 2008, Kyoto, Japan Communication dans un congrès hal-00369869v1
Eine ungewöhnliche Anwendung der Reaktionstechnik: die Entwicklung einer Erdöl-Lagerstätte. Nutzung von intelligentem Lumping. Roda Bounaceur,Paul-Marie Marquaire,Gérard Scacchi,Gabriel Wild Emil-Kirschbaum-Kolloquium - 3. Tag der Fakultät für Chemieingenieurwesen, May 2008, Karlsruhe, Germany Communication dans un congrès hal-00369858v1
An unusual application of chemical reaction engineering: the evolution of a crude oil reservoir. Of the use of intelligent lumping. (Communication orale) Roda Bounaceur,Gérard Scacchi,Paul-Marie Marquaire,Gabriel Wild,Florent Dominéet al. 6th European Conference of Chemical Engineering, Sep 2007, Copenhague, Denmark Communication dans un congrès hal-00369863v1
Modeling of NO sensitization of IC engines surrogate fuels auto-ignition and combustion Jörg Anderlohr,A. Pires da Cruz,Roda Bounaceur,Frédérique Battin-Leclerc 21st International Colloquium on the Dynamics of Explosions and Reactive Systems, Jul 2007, Poitiers, France. pp.Congress CD ROM Communication dans un congrès hal-00370835v1
A complex chemical kinetic mechanism for the oxidation of gasoline surrogate fuels: n heptane, iso octane and toluene - Mechanism development and validation A. Pires da Cruz,C. Pera,Jörg Anderlohr,Roda Bounaceur,Frédérique Battin-Leclerc Proceedings of the European Combustion Meeting 2007, Apr 2007, Chania, Greece. pp.CD-ROM du congrès Communication dans un congrès hal-00370855v1

Poster de conférence (1)

In silico screening of metal-chelating peptides present in Tilapia scales protein hydrolysates Jairo Andrés Camaño Echavarría,R. Bounaceur,José Zapata,Katalin Selmeczi,Laetitia Canabady-Rochelle First International Conference on Metal-Binding Peptides: Methodologies and Applications, Jul 2022, Nancy, France Poster de conférence hal-04259012v1

Chapitre d'ouvrage (2)

Modelling and Simulation of Low Pressure Carburizing Furnaces Fatima Matamoros,Pierre-Alexandre Glaude,Roda Bounaceur,Hubert Monnier,Abderrazak Latifi 30TH EUROPEAN SYMPOSIUM ON COMPUTER AIDED PROCESS ENGINEERING, pp.361-366, 2020, ⟨10.1016/B978-0-12-823377-1.50061-6⟩ Chapitre d'ouvrage hal-03201570v1
The Nitrogen Chemistry in Hot Jupiters Atmosphere O. Venot,Eric Hébrard,Marcelino Agúndez,M. Dobrijevic,Franck Selsiset al. The Early Evolution of the Atmospheres of Terrestrial PlanetsAstrophysics and Space Science Proceedings, 35, pp.67-83, 2013 Chapitre d'ouvrage hal-01169698v1

Brevet (1)

Procédé de contrôle de l'injection d'air frais à l'échappement d'un moteur à combustion interne Jörg Anderlohr,A. Pires da Cruz,F. Vangraefschepe,Jacques Lavy,Roda Bounaceuret al. European Union, Patent n° : brevet européen 11290197.0/2311. 2011 Brevet hal-00787637v1

Pré-publication, Document de travail (1)

Inclusion of sulfur chemistry in a validated C/H/O/N chemical network: identification of key C/S coupling pathways R. Veillet,O. Venot,B. Sirjean,F. Citrangolo Destro,R. Fournetet al. 2025 Pré-publication, Document de travail hal-05382806v1

Thèse (1)

Modélisation cinétique de l'évolution thermique des pétroles dans les gisements Roda Bounaceur Sciences de l'ingénieur [physics]. Institut National Polytechnique de Lorraine, 2001. Français. ⟨NNT : 2001INPL002N⟩ Thèse tel-01749794v1