Development and validation of reduced chemical kinetic mechanisms for hydrogen-enriched ammonia/methane premixed combustion

The growing demand for carbon-free energy, driven by the urgent need to reduce greenhouse gas emissions, has intensified interest in ammonia and hydrogen as promising alternative fuels. To facilitate their gradual replacement of conventional hydrocarbons, reliable chemical kinetic mechanisms are essential. In this regard, a reduced mechanism for methane-ammonia-hydrogen blends, comprising 35 species and 233 reactions, was developed and validated against experimental data. Simulations were performed for various equivalence ratios, ammonia and hydrogen fractions, and pressures. Results demonstrate a two-stage temperature response: for x N H 3 <0.525, hydrogen raised flame temperature, but further enrichment caused a slight decline. NO exhibited a maximum at x N H 3 = 0.32 due to the competition between thermal- and fuel-NOx, consistently peaking at ϕ = 0.9 regardless of hydrogen content, while fuel-rich conditions suppressed NO formation. Reaction pathway analysis revealed that NH 3 controlled NO formation through HNO and NH intermediates, with higher hydrogen concentrations reducing the rates of key NO-forming reactions. • A reduced mechanism for CH 4 /NH 3 /H 2 flames developed and verified by experiments. • At x N H 3 = 0.32, NO peak occurs due to competing thermal and fuel NOx formation. • NO Peak occurs at ϕ = 0.9 for all H 2 contents, but fuel-rich mixtures suppress NO. • For x N H 3 <0.525, H 2 enrichment raises flame temperature, but above it drops. • CO formation is negligible and H 2 -insensitive under lean, but rises in fuel-rich.

Authors

Institutions

Publication Details

Journal
International Journal of Hydrogen Energy
Published
2025-11-21
DOI
https://doi.org/10.1016/j.ijhydene.2025.152518
Citations
2
Primary Topic
Advanced Combustion Engine Technologies
Type
article
Field-Weighted Citation Impact
1.44
Controls
|||
ALL TIME
JAN
FEB
MAR
APR
MAY
JUN
JUL
AUG
SEP
OCT
article

Development and validation of reduced chemical kinetic mechanisms for hydrogen-enriched ammonia/methane premixed combustion

Ayat Gharehghani, Mohammad Javad Nekoeianfar
2 citations
International Journal of Hydrogen Energy
Advanced Combustion Engine Technologies
1.44
article

Development and validation of reduced chemical kinetic mechanisms for hydrogen-enriched ammonia/methane premixed combustion

Ayat Gharehghani, Mohammad Javad Nekoeianfar
article en
2 citations

Abstract

The growing demand for carbon-free energy, driven by the urgent need to reduce greenhouse gas emissions, has intensified interest in ammonia and hydrogen as promising alternative fuels. To facilitate their gradual replacement of conventional hydrocarbons, reliable chemical kinetic mechanisms are essential. In this regard, a reduced mechanism for methane-ammonia-hydrogen blends, comprising 35 species and 233 reactions, was developed and validated against experimental data. Simulations were performed for various equivalence ratios, ammonia and hydrogen fractions, and pressures. Results demonstrate a two-stage temperature response: for x N H 3 <0.525, hydrogen raised flame temperature, but further enrichment caused a slight decline. NO exhibited a maximum at x N H 3 = 0.32 due to the competition between thermal- and fuel-NOx, consistently peaking at ϕ = 0.9 regardless of hydrogen content, while fuel-rich conditions suppressed NO formation. Reaction pathway analysis revealed that NH 3 controlled NO formation through HNO and NH intermediates, with higher hydrogen concentrations reducing the rates of key NO-forming reactions. • A reduced mechanism for CH 4 /NH 3 /H 2 flames developed and verified by experiments. • At x N H 3 = 0.32, NO peak occurs due to competing thermal and fuel NOx formation. • NO Peak occurs at ϕ = 0.9 for all H 2 contents, but fuel-rich mixtures suppress NO. • For x N H 3 <0.525, H 2 enrichment raises flame temperature, but above it drops. • CO formation is negligible and H 2 -insensitive under lean, but rises in fuel-rich.

International Journal of Hydrogen EnergyVol. 197
Iran University of Science and Technology (IR)
Openalex Percentile: Top 16%
Advanced Combustion Engine Technologies
1.44
AI Navigator

Ask Laika to Summarize, Analyze, and Connect papers live on the map.

Summarize Papers & Methodologies

Extract key findings, datasets, and comparative methods across publications.

Benchmark Rankings & Visual Analytics

Rank top research institutions, authors, funders, topics, and journals by Field-Weighted Citation Impact (FWCI) and paper volume with instant charts.

Connect Distant Disciplines

Bridge topological clusters on the map to find hidden collaborative intersections.