Sfoglia per Autore
Chemical kinetics of SARA fractions pyrolysis: Resins
2024-01-01 Colleoni, Elia; Guida, Paolo; Samaras, Vasilios G.; Frassoldati, Alessio; Faravelli, Tiziano; Roberts, William L.
Development of a multiphase chemical reactor network method as a tool for simulating biomass gasification in fluidized beds
2024-01-01 Berkel, Leon Loni; Debiagi, Paulo; Nicolai, Hendrik; Amjed, Muhammad Ahsan; Stagni, Alessandro; Hasse, Christian; Faravelli, Tiziano
Coupling chemical lumping to data-driven optimization for the kinetic modeling of dimethoxymethane (DMM) combustion
2024-01-01 Pegurri, Alessandro; Dinelli, Timoteo; Pratali Maffei, Luna; Faravelli, Tiziano; Stagni, Alessandro
Oxygen effects on soot formation in H2/n-heptane counterflow flames
2023-01-01 Nobili, Andrea; Zheng, Dongsheng; Pelucchi, Matteo; Cuoci, Alberto; Frassoldati, Alessio; Hui, Xin; Faravelli, Tiziano
Low- and intermediate-temperature ammonia/hydrogen oxidation in a flow reactor: Experiments and a wide-range kinetic modeling
2023-01-01 Stagni, A.; Arunthanayothin, S.; Dehue, M.; Herbinet, O.; Battin-Leclerc, F.; Brequigny, P.; Mounaim-Rousselle, C.; Faravelli, T.
A generalized partially stirred reactor model for turbulent closure
2023-01-01 Quadarella, E.; Pequin, A.; Stagni, A.; Parente, A.; Faravelli, T.; Im, H. G.
Unraveling the complexity of pyrolysates from residual fuels by Py-GCxGC-FID/SCD/TOF-MS with an innovative data processing method
2023-01-01 Colleoni, Elia; Samaras, Vasilios G.; Guida, Paolo; Frassoldati, Alessio; Faravelli, Tiziano; Roberts, William L.
Towards a lumped approach for solid plastic waste gasification: Polystyrene pyrolysis
2023-01-01 Locaspi, Andrea; Pelucchi, Matteo; Faravelli, Tiziano
Automated Kinetic Mechanism Evaluation for e-Fuels Using SciExpeM: The Case of Oxymethylene Ethers
2023-01-01 Dinelli, Timoteo; Pratali Maffei, Luna; Pegurri, Alessandro; Puri, Amedeo; Stagni, Alessandro; Faravelli, Tiziano
A comprehensive kinetic framework for solid carbon deposition and hydrogen production from the pyrolysis of light hydrocarbons streams
2023-01-01 Serse, Francesco; Ding, Zhaobin; Bracconi, Mauro; Maestri, Matteo; Nobili, Andrea; Giudici, Clarissa; Frassoldati, Alessio; Faravelli, Tiziano; Cuoci, Alberto; Pelucchi, Matteo
Automatic validation and analysis of predictive models by means of big data and data science
2023-01-01 Ramalli, E.; Dinelli, T.; Nobili, A.; Stagni, A.; Pernici, B.; Faravelli, T.
Towards a lumped approach for solid plastic waste gasification: Polyethylene and polypropylene pyrolysis
2023-01-01 Locaspi, Andrea; Pelucchi, Matteo; Mehl, Marco; Faravelli, Tiziano
Exploring fuel molecular structure effects on the pyrolysis chemistry of branched hexenes
2022-01-01 Cao, C.; Pelucchi, M.; Zhang, J.; Li, W.; Nobili, A.; Yang, J.; Zhao, L.; Li, Y.; Faravelli, T.
HȮ2 + HȮ2: High level theory and the role of singlet channels
2022-01-01 Klippenstein, S. J.; Sivaramakrishnan, R.; Burke, U.; Somers, K. P.; Curran, H. J.; Cai, L.; Pitsch, H.; Pelucchi, M.; Faravelli, T.; Glarborg, P.
New insights into the oxidation chemistry of pyrrole, an N-containing biomass tar component
2022-01-01 Chen, B.; Liu, P.; Pelucchi, M.; Guidici, C.; Maffei, L. P.; Faller, S.; Xu, Q.; Huang, J.; Zhang, F.; Huang, C.; Leonherd, K.; Wang, Z.; Mehl, M.; Roberts, W. L.; Faravelli, T.; Pitsch, H.
Special issue of thermo-chemical conversion of biomass
2022-01-01 Wang, S.; Faravelli, T.; Yang, H.
Modeling soot particles as stable radicals: a chemical kinetic study on formation and oxidation. Part I. Soot formation in ethylene laminar premixed and counterflow diffusion flames
2022-01-01 Nobili, A.; Cuoci, A.; Pejpichestakul, W.; Pelucchi, M.; Cavallotti, C.; Faravelli, T.
On the influence of NO addition to dimethyl ether oxidation in a flow reactor
2022-01-01 Pelucchi, M.; Schmitt, S.; Gaiser, N.; Cuoci, A.; Frassoldati, A.; Zhang, H.; Stagni, A.; Osswald, P.; Kohse-Hoinghaus, K.; Faravelli, T.
Theoretical kinetics of HO2 + C5H5: A missing piece in cyclopentadienyl radical oxidation reactions
2022-01-01 Pratali Maffei, L.; Pelucchi, M.; Faravelli, T.; Cavallotti, C.
An experimental, theoretical and kinetic-modeling study of hydrogen sulfide pyrolysis and oxidation
2022-01-01 Stagni, Alessandro; Arunthanayothin, Suphaporn; PRATALI MAFFEI, Luna; Herbinet, Olivier; Battin-Leclerc, Fr??d??rique; Faravelli, Tiziano
On the radical behavior of large polycyclic aromatic hydrocarbons in soot formation and oxidation
2022-01-01 Nobili, A.; Pratali Maffei, L.; Baggioli, A.; Pelucchi, M.; Cuoci, A.; Cavallotti, C.; Faravelli, T.
Experimental and modeling investigation on pyrolysis of agricultural biomass residues: Khat stem and coffee husk for bio-oil application
2022-01-01 Afessa, M. M.; Debiagi, P.; Ferreiro, A. I.; Mendes, M. A. A.; Faravelli, T.; Ramayya, A. V.
Automatically generated detailed and lumped reaction mechanisms for low- and high-temperature oxidation of alkanes
2022-01-01 Brunialti, S.; Zhang, X.; Faravelli, T.; Frassoldati, A.; Mani Sarathy, S.
Rate constants for H-atom abstraction reactions from mono-aromatic hydrocarbons by H, CH3, OH and 3O2: A systematic theoretical investigation
2022-01-01 Pratali Maffei, L.; Pelucchi, M.; Buttgen, R. D.; Heufer, K. A.; Faravelli, T.; Cavallotti, C.
Soot formation from n-heptane counterflow diffusion flames: Two-dimensional and oxygen effects
2022-01-01 Zheng, D.; Nobili, A.; Cuoci, A.; Pelucchi, M.; Hui, X.; Faravelli, T.
Modeling soot particles as stable radicals: a chemical kinetic study on formation and oxidation. Part II. Soot oxidation in flow reactors and laminar flames
2022-01-01 Nobili, Andrea; Pejpichestakul, Warumporn; Pelucchi, Matteo; Cuoci, Alberto; Cavallotti, CARLO ALESSANDRO; Faravelli, Tiziano
Chemistry of nitrogen oxides (NOx) formation in flameless combustion
2022-01-01 Stagni, Alessandro; Frassoldati, Alessio; Pelucchi, Matteo; Faravelli, Tiziano
Dimethyl ether oxidation analyzed in a given flow reactor: Experimental and modeling uncertainties
2022-01-01 Stagni, A.; Schmitt, S.; Pelucchi, M.; Frassoldati, A.; Kohse-Hoinghaus, K.; Faravelli, T.
A new detailed kinetic model for surrogate fuels: C3MechV3.3
2022-01-01 Dong, Shijun; Wagnon, Scott W.; Pratali Maffei, Luna; Kukkadapu, Goutham; Nobili, Andrea; Mao, Qian; Pelucchi, Matteo; Cai, Liming; Zhang, Kuiwen; Raju, Mandhapati; Chatterjee, Tanusree; Pitz, William J.; Faravelli, Tiziano; Pitsch, Heinz; Senecal, Peter Kelly; Curran, Henry J.
Automated identification and calculation of prompt effects in kinetic mechanisms using statistical models
2022-01-01 Pratali Maffei, L.; Moore, K. B.; Georgievskii, Y.; Mulvihill, C. R.; Elliott, S. N.; Cho, J.; Sivaramakrishnan, R.; Faravelli, T.; Klippenstein, S. J.
Investigation of Oxy‐Fuel Combustion through Reactor Network and Residence Time Data
2022-01-01 Agizza, M. A.; Bagheri, G.; Burkle, S.; Faravelli, T.; Wagner, S.; Dreizler, A.
EXPERIMENTAL STUDY OF AMMONIA-HYDROGEN-METHANE COFIRING IN A TUBULAR REACTOR
2022-01-01 Gahfif, M.; Arunthanayothin, S.; Battin-Leclerc, F.; Faravelli, T.; Stagni, A.; Herbinet, O.
Theoretical and kinetic modeling study of chloromethane (CH3Cl) pyrolysis and oxidation
2021-01-01 Pelucchi, M.; Cavallotti, C.; Frassoldati, A.; Ranzi, E.; Glarborg, P.; Faravelli, T.
Assessment of a detailed biomass pyrolysis kinetic scheme in multiscale simulations of a single-particle pyrolyzer and a pilot-scale entrained flow pyrolyzer
2021-01-01 Gao, X.; Lu, L.; Shahnam, M.; Rogers, W. A.; Smith, K.; Gaston, K.; Robichaud, D.; Brennan Pecha, M.; Crowley, M.; Ciesielski, P. N.; Debiagi, P.; Faravelli, T.; Wiggins, G.; Finney, C. E. A.; Parks, J. E.
A Predictive Physico-chemical Model of Biochar Oxidation
2021-01-01 Locaspi, A.; Debiagi, P.; Pelucchi, M.; Hasse, C.; Faravelli, T.
Chemical Kinetics of Asphaltene Pyrolysis
2021-01-01 Guida, P.; Colombo, E.; Colleoni, E.; Saxena, S.; Frassoldati, A.; Roberts, W. L.; Faravelli, T.
Interface-resolved simulation of the evaporation and combustion of a fuel droplet suspended in normal gravity
2021-01-01 Saufi, A. E.; Frassoldati, A.; Faravelli, T.; Cuoci, A.
An evolutionary, data-driven approach for mechanism optimization: theory and application to ammonia combustion
2021-01-01 Bertolino, A.; Furst, M.; Stagni, A.; Frassoldati, A.; Pelucchi, M.; Cavallotti, C.; Faravelli, T.; Parente, A.
Advanced modeling approaches for CFD simulations of coal combustion and gasification
2021-01-01 Hasse, C.; Debiagi, P.; Wen, X.; Hildebrandt, K.; Vascellari, M.; Faravelli, T.
Ammonia-methane interaction in jet-stirred and flow reactors: An experimental and kinetic modeling study
2021-01-01 Arunthanayothin, S.; Stagni, A.; Song, Y.; Herbinet, O.; Faravelli, T.; Battin-Leclerc, F.
Pyrolysis and combustion chemistry of pyrrole, a reference component for bio-oil surrogates: Jet-stirred reactor experiments and kinetic modeling
2021-01-01 Pelucchi, M.; Arunthanayothin, S.; Song, Y.; Herbinet, O.; Stagni, A.; Carstensen, H. -H.; Faravelli, T.; Battin-Leclerc, F.
Master equation lumping for multi-well potential energy surfaces: A bridge between ab initio based rate constant calculations and large kinetic mechanisms
2021-01-01 Pratali Maffei, L.; Pelucchi, M.; Cavallotti, C.; Bertolino, A.; Faravelli, T.
Development and application of an efficient chemical reactor network model for oxy-fuel combustion
2021-01-01 Trespi, S.; Nicolai, H.; Debiagi, P.; Janicka, J.; Dreizler, A.; Hasse, C.; Faravelli, T.
OptiSMOKE++: A toolbox for optimization of chemical kinetic mechanisms
2021-01-01 Furst, M.; Bertolino, A.; Cuoci, A.; Faravelli, T.; Frassoldati, A.; Parente, A.
Kinetics mechanism of asphaltenes liquid-phase pyrolysis
2021-01-01 Colleoni, Elia; Guida, Paolo; Saxena, Saumitra; Roberts, William L.; Frassoldati, Alessio; Faravelli, Tiziano
Data Ecosystems for Scientific Experiments: Managing Combustion Experiments and Simulation Analyses in Chemical Engineering
2021-01-01 Ramalli, Edoardo; Scalia, Gabriele; Pernici, Barbara; Stagni, Alessandro; Cuoci, Alberto; Faravelli, Tiziano
Polycyclic Aromatic Hydrocarbons Evolution and Interactions with Soot Particles during Fuel Surrogate Combustion: A Rate Rule-Based Kinetic Model
2021-01-01 Pratali Maffei, L.; Pelucchi, M.; Faravelli, T.; Pitsch, H.; Mao, Q.; Nobili, A.
Calibration and validation of a comprehensive kinetic model of coal conversion in inert, air and oxy-fuel conditions using data from multiple test rigs
2021-01-01 Debiagi, P.; Ontyd, C.; Pielsticker, S.; Schiemann, M.; Faravelli, T.; Kneer, R.; Hasse, C.; Scherer, V.
Systematic evaluation and kinetic modeling of low heating rate sulfur release in various atmospheres
2021-01-01 Debiagi, P.; Yildiz, C.; Strohle, J.; Epple, B.; Faravelli, T.; Hasse, C.
Carrier-phase DNS of detailed NOx formation in early-stage pulverized coal combustion with fuel-bound nitrogen
2021-01-01 Shamooni, A.; Debiagi, P.; Wang, B.; Luu, T. D.; Stein, O. T.; Kronenburg, A.; Bagheri, G.; Stagni, A.; Frassoldati, A.; Faravelli, T.; Kempf, A. M.; Wen, X.; Hasse, C.
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