Insights into evolution mechanism of PAHs in coal thermal conversion: A combined experimental and DFT study
Yifeng Chen, Sheng Su, Liangping Zhang, Long Jiang, Mengxia Qing, Huanying Chi, Peng Ling, Hengda Han, Kai Xu, Yi Wang, Song Hu, Jun Xiang
Topics & Concepts
PhenanthreneAnthraceneChemistryFluorenePyrolysisCyclopentadienyl complexNaphthaleneCoalIndeneTetralinPhotochemistryDensity functional theoryReaction mechanismThermodynamicsOrganic chemistryComputational chemistryPolymerCatalysisPhysicsThermochemical Biomass Conversion ProcessesAdvanced Combustion Engine TechnologiesHeat transfer and supercritical fluids