[HTML][HTML] Formation and growth mechanisms of polycyclic aromatic hydrocarbons: A mini-review

E Reizer, B Viskolcz, B Fiser - Chemosphere, 2022 - Elsevier
Polycyclic aromatic hydrocarbons (PAHs) are mostly formed during the incomplete
combustion of organic materials, but their importance and presence in materials science …

Combustion chemistry of aromatic hydrocarbons

H Jin, W Yuan, W Li, J Yang, Z Zhou, L Zhao… - Progress in Energy and …, 2023 - Elsevier
Aromatic hydrocarbons are important components of petroleum-based transportation fuels,
biomass, coal, and solid waste, etc. The reaction kinetics of aromatic hydrocarbons largely …

Multi-scale complexities of solid acid catalysts in the catalytic fast pyrolysis of biomass for bio-oil production–A review

R Liu, M Sarker, MM Rahman, C Li, M Chai… - Progress in Energy and …, 2020 - Elsevier
Despite remarkable progress in catalytic fast pyrolysis, bio-oil production is far from
commercialization because of multi-scale challenges, and major constraints lie with …

From theoretical reaction dynamics to chemical modeling of combustion

SJ Klippenstein - Proceedings of the Combustion Institute, 2017 - Elsevier
The chemical modeling of combustion treats the chemical conversion of hundreds of species
through thousands of reactions. Recent advances in theoretical methodologies and …

Investigation on the pyrolysis and oxidation of toluene over a wide range conditions. I. Flow reactor pyrolysis and jet stirred reactor oxidation

W Yuan, Y Li, P Dagaut, J Yang, F Qi - Combustion and Flame, 2015 - Elsevier
The pyrolysis of toluene was studied in a flow reactor at pressures from 5 to 760 Torr and
temperatures from 1100 to 1730 K using synchrotron vacuum ultraviolet photoionization …

Temperature-and pressure-dependent rate coefficients for the HACA pathways from benzene to naphthalene

AM Mebel, Y Georgievskii, AW Jasper… - Proceedings of the …, 2017 - Elsevier
RRKM-Master Equation calculations have been performed to evaluate temperature-and
pressure-dependent rate coefficients for acetylene addition reactions to the C 6 H 5, C 6 H 4 …

Unconventional excited-state dynamics in the concerted benzyl (C7H7) radical self-reaction to anthracene (C14H10)

RI Kaiser, L Zhao, W Lu, M Ahmed… - Nature …, 2022 - nature.com
Polycyclic aromatic hydrocarbons (PAHs) are prevalent in deep space and on Earth as
products in combustion processes bearing direct relevance to energy efficiency and …

Spray combustion and soot formation characteristics of the acetone-butanol-ethanol/diesel blends under diesel engine-relevant conditions

Z Xu, X Duan, Y Liu, B Deng, J Liu - Fuel, 2020 - Elsevier
The acetone–butanol–ethanol (ABE) is considered as a promising biofuel to partially
substitute the diesel fuel. In this paper, the optical constant volume combustion chamber was …

Atomistic insights into p-nitrotoluene combustion via the ReaxFF molecular dynamics and density functional theory study

S Jin, W Gao, G Li, X Geng, M Bi, H Jiang - Process Safety and …, 2024 - Elsevier
Abstract p-Nitrotoluene is a toxic, flammable, and explosive nitro-hazardous chemical in
process industries. However, the combustion reaction mechanism is still unclear, and kinetic …

Investigation on the pyrolysis and oxidation of toluene over a wide range conditions. II. A comprehensive kinetic modeling study

W Yuan, Y Li, P Dagaut, J Yang, F Qi - Combustion and Flame, 2015 - Elsevier
The flow reactor pyrolysis of toluene from low to atmospheric pressures and jet stirred
reactor oxidation of toluene at high pressure have been studied in Part I of this serial work …