A modelling study of acetylene oxidation and pyrolysis

N Slavinskaya, A Mirzayeva, R Whitside, JH Starke… - Combustion and …, 2019 - Elsevier
This study initiates the gradual upgrade of the DLR reaction database The upgrade plan has
two main steps: an optimisation of the C 1–C 4 oxidation chemistry and a revision of the …

[HTML][HTML] An evolutionary, data-driven approach for mechanism optimization: theory and application to ammonia combustion

A Bertolino, M Fürst, A Stagni, A Frassoldati… - Combustion and …, 2021 - Elsevier
In this work, we propose a novel data-driven approach for detailed kinetic mechanisms
optimization. The approach is founded on a curve matching-based objective function and …

Mixture rules and falloff are now major uncertainties in experimentally derived rate parameters for H+ O2 (+ M)↔ HO2 (+ M)

L Lei, MP Burke - Combustion and Flame, 2020 - Elsevier
Rate constants for the title reaction for different bath gas species, M, are essential to
accurate combustion predictions. Most experimental studies of the title reaction assume the …

A joint hydrogen and syngas chemical kinetic model optimized by particle swarm optimization

H Wang, C Sun, O Haidn, A Aliya, C Manfletti… - Fuel, 2023 - Elsevier
In this work, we propose a novel data-driven framework for detailed kinetic mechanisms
optimization applying the heuristic algorithm, namely canonic Particle Swarm Optimization …

Efficient numerical methods for the optimisation of large kinetic reaction mechanisms

SK Goitom, M Papp, M Kovács, T Nagy… - … Theory and Modelling, 2022 - Taylor & Francis
Optimisation of detailed combustion mechanisms means that the corresponding kinetic
model is fitted to experimental data via optimising their important rate and thermodynamic …

A comprehensive kinetic modeling study of ethylene combustion with data uncertainty analysis

H Wang, N Slavinskaya, A Kanz, M Auyelkhankyzy… - Fuel, 2021 - Elsevier
A revision and upgrade of the ethylene (C 2 H 4) oxidation kinetic sub-mechanism were
carried as a next step in the optimization of the C< 3 chemistry, which is a base for the …

A comprehensive kinetic modeling study of hydrogen combustion with uncertainty quantification

H Wang, N Slavinskaya, O Haidn - Fuel, 2022 - Elsevier
A 19-reactions H 2 oxidation chemical kinetic model has been optimized with uncertainty
quantification. The uncertainties of the reaction rate constant (RRC) parameters have been …

Iterative model-based experimental design for efficient uncertainty minimization of chemical mechanisms

F vom Lehn, L Cai, H Pitsch - Proceedings of the Combustion Institute, 2021 - Elsevier
The uncertainties of chemical kinetic model parameters induce uncertainties in model
predictions. Automatic optimization and uncertainty minimization techniques have been …

Estimation of third body efficiencies from experimental data: Application to hydrogen combustion

A Bertolino, A Frassoldati, A Cuoci, A Parente - International Journal of …, 2023 - Elsevier
In this work, the role of H 2 O and CO 2 as diluents is investigated, in operating conditions
relevant to MILD combustion of hydrogen. Through virtual species analysis, the role of third …

[HTML][HTML] Measurements of the laminar flame speed of premixed, hydrogen-air-argon stagnation flames

A Durocher, M Meulemans, G Bourque… - Applications in Energy …, 2021 - Elsevier
As the foundation for detailed hierarchical combustion chemistry models, the accuracy of the
hydrogen oxidation mechanism is paramount to achieve truly predictive models. The recent …