3 papers
physics.chem-ph2025
Theoretical investigation of real-fluid effects on the oxidation of hydrogen and syngas in high-pressure flow reactors
Mingrui Wang, Tianzhou Jiang, Ting Zhang +5
Investigating the high-pressure pyrolysis and oxidation of hydrogen and syngas is essential for developing accurate combustion models under real engine conditions. Accordingly, flo…
physics.flu-dyn2025
HiPrFlame-An ab initio based real-fluid modeling approach for high-pressure combustion-I. Rationale, methodology, and application to laminar premixed flames
Ting Zhang, Tianzhou Jiang, Mingrui Wang +4
High-pressure combustion is central to modern propulsion and power-generation systems, where operating pressures often exceed the critical point of working fluids, resulting in pro…
physics.chem-ph2024
On the H-atom abstractions from C1-C4 alcohols, aldehydes, and ethers by NO2: ab initio and comprehensive kinetic modeling
Hongqing Wu^, Ruoyue Tang^, Yuxin Dong +6
As crucial additives and intermediate, alcohols, ethers, and aldehydes play a significant role in the combustion process. However, the chemistry of NOXhydrocarbon interactions and…