Dataset

DATA: hydrogen and ammonia flame speeds from different Soret diffusion models

Unstretched laminar flame speeds (sL0) of hydrogen-air and ammonia/hydrogen-air flames

Each file contains a table with the raw flame speed data presented in the paper

T. Zirwes, A. Kronenburg, "Assessment of Approximate Soret Diffusion Models for Hydrogen and Ammonia Combustion", Flow, Turbulence and Combustion (2025), https://doi.org/10.1007/s10494-025-00680-5

Each table is structured as follows:

The file name contains information about the fuel composition (either pure hydrogen, "H2", or ammonia/hydrogen at a 60/40 blend by volume, "60-NH3-40-H2"), the unburnt gas temperature (either 300K or 500K), the pressure (either 1atm or 5atm) and the reaction mechanism (Stagni et al. [1] for the ammonia-hydrogen flames and Li et al. [2], Burke et al [3] or Boivin et al [4] for pure hydrogen flames).

The columns contain:

Column 1: Equivalence ratio Column 2: sL0 from the multicomponent model without Soret diffusion (m/s) Column 3: sL0 from the multicomponent model with Soret diffusion (m/s) Column 4: sL0 from the mixture-averaged model with the Chaptman&Cowling Soret model (m/s) Column 5: sL0 from the mixture-averaged model with the Bartlett Soret model (m/s) Column 6: sL0 from the mixture-averaged model with the Hirschfelder&Warnatz Soret model activated only for H and H2 (m/s)

[1] A. Stagni, S. Arunthanayothin, M. Dehue, O. Herbinet, F. Battin-Leclerc, P. Bréquigny, C. Mounaïm-Rousselle, T. Faravelli, "Low-and intermediate temperature ammonia/hydrogen oxidation in a flow reactor: Experiments and a wide-range kinetic modeling", Chem. Eng. J. 471 (2023)

[2] J. Li, Z. Zhao, A. Kazakov, F.L. Dryer, "An updated comprehensive kinetic model of hydrogen combustion", Int. J. Chemical Kinetics 36, 566-575 (2004)

[3] M.P. Burke, M. Chaos, Y. Ju, F.L. Dryer, S.J. Klippenstein, "Comprehensive H2/O2 kinetic model for high-pressure combustion", Int. J. Chem. Kinetics 44(7), 444-474 (2012)

[4] P. Boivin, "Reduced-kinetic mechanisms for hydrogen and syngas combustion including autoignition", Phd, Universidad Carlos III de Madrid (2011)

Chemical Info

Data and Resources

Metadata Information

Field Value
DOI https://doi.org/10.18419/DARUS-5138
License URL
Source https://doi.org/10.18419/DARUS-5138
Version
Author Zirwes, Thorsten
Maintainer DaRUS
Language
MetadataPublished
Related Molecule
Field Value
No additional information available for this Dataset.
Data-Source Molecule ID Data-Source
The data in this table is sourced from UniChem at EBI.