Reactive force field molecular dynamics simulation of pyridine combustion assisted by an electric field

The reduction of nitrogen oxides (NOx) is a perennial challenge for fuel combustion. Electric field enhanced combustion promising technology to decrease NOx emissions during the process. This study aims investigate effects electric on fuel-NOx formation pyridine (the main nitrogen-containing compounds in fossil fuels) yields products (NO, NO2, N2, CO and CO2) are investigated oxidation with external imposed. Results indicate that can reduce (CO NO) Moreover, reaction mechanisms under different fields explored at atomic scales, which provides an explanation changes varying characteristics. fills current knowledge gaps concerning influence emissions, has potential form control strategies