In the pursuit of cleaner and more efficient energy technologies, researchers from the University of Central Florida’s Department of Mechanical and Aerospace Engineering have been exploring the potential of alcohol additives to enhance the combustion of ammonia and methane mixtures. This research, led by Amirali Shateri, Zhiyin Yang, Jianfei Xie, and Nasser Sherkat, aims to understand how ethanol and methanol can influence the combustion process and reduce harmful emissions. Their findings, published in the journal Combustion and Flame, offer promising insights for the energy industry.
The team employed a computational method called Reactive Force Field (ReaxFF) molecular dynamics simulations to investigate the underlying mechanisms of how alcohol additives affect the reaction pathways and emissions of ammonia-methane blends. This approach allowed them to simulate the combustion process at a molecular level, providing detailed insights into the chemical reactions and interactions that occur.
The researchers found that adding alcohols to the ammonia-methane mixture altered the formation pathways of nitrogen oxides (NOx), a group of pollutants that contribute to smog and acid rain. Specifically, they observed that alcohol additives reduced the diversity of NOx compounds and shifted the equilibrium towards simpler forms like NO and NO2. At lower temperatures (2,000 K), methanol was particularly effective in reducing NO2 formation. At higher temperatures (3,000 K), both ethanol and methanol suppressed NO production, with methanol having a stronger effect. The study also noted that nitric acid (HNO3) production was present at lower temperatures but became negligible at higher temperatures due to thermal breakdown.
Moreover, the researchers discovered that alcohol additives facilitated the decomposition of ammonia and methane, leading to a reduction in peak emissions. They also found that methanol and ethanol significantly impacted the hydrogen bond energies of the mixture, promoting more complex reaction pathways.
The practical implications of this research are significant for the energy industry. By optimizing the use of alcohol additives in ammonia-methane combustion, it may be possible to develop more efficient and cleaner propulsion systems. This could be particularly relevant for industries such as transportation and power generation, where reducing emissions and improving fuel efficiency are key priorities. The computational methodology used in this study also offers a scalable and robust approach for future research, enabling further optimization of these mixtures for practical applications.
In summary, this research provides a fundamental understanding of how alcohol additives can enhance the combustion efficiency and reduce emissions of ammonia-methane blends. By leveraging these insights, the energy industry can explore new strategies to develop sustainable and efficient energy technologies.
This article is based on research available at arXiv.

