Soot inception: Carbonaceous nanoparticle formation in flames
The route by which gas-phase molecules in hydrocarbon flames form condensed-phase
carbonaceous nanoparticles (incipient soot) is reviewed. These products of incomplete …
carbonaceous nanoparticles (incipient soot) is reviewed. These products of incomplete …
[HTML][HTML] Classical and reactive molecular dynamics: Principles and applications in combustion and energy systems
Molecular dynamics (MD) has evolved into a ubiquitous, versatile and powerful
computational method for fundamental research in science branches such as biology …
computational method for fundamental research in science branches such as biology …
[HTML][HTML] Formation and growth mechanisms of polycyclic aromatic hydrocarbons: A mini-review
Polycyclic aromatic hydrocarbons (PAHs) are mostly formed during the incomplete
combustion of organic materials, but their importance and presence in materials science …
combustion of organic materials, but their importance and presence in materials science …
Combustion chemistry of aromatic hydrocarbons
Aromatic hydrocarbons are important components of petroleum-based transportation fuels,
biomass, coal, and solid waste, etc. The reaction kinetics of aromatic hydrocarbons largely …
biomass, coal, and solid waste, etc. The reaction kinetics of aromatic hydrocarbons largely …
On the mechanism of soot nucleation
M Frenklach, AM Mebel - Physical Chemistry Chemical Physics, 2020 - pubs.rsc.org
The mechanism of carbon particulate (soot) inception has been a subject of numerous
studies and debates. The article begins with a critical review of prior proposals, proceeds to …
studies and debates. The article begins with a critical review of prior proposals, proceeds to …
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 …
through thousands of reactions. Recent advances in theoretical methodologies and …
Combustion in the future: The importance of chemistry
K Kohse-Höinghaus - Proceedings of the Combustion Institute, 2021 - Elsevier
Combustion involves chemical reactions that are often highly exothermic. Combustion
systems utilize the energy of chemical compounds released during this reactive process for …
systems utilize the energy of chemical compounds released during this reactive process for …
A new detailed kinetic model for surrogate fuels: C3MechV3. 3
There is an increasing demand for kinetic models of surrogate components to predict the
combustion and emissions of real fuels. In this paper, a new surrogate fuel mechanism …
combustion and emissions of real fuels. In this paper, a new surrogate fuel mechanism …
[HTML][HTML] Examination of a soot model in premixed laminar flames at fuel-rich conditions
The primary objective of the present work is to collect and review the vast amount of
experimental data on rich laminar premixed flames of hydrocarbon fuels reported in recent …
experimental data on rich laminar premixed flames of hydrocarbon fuels reported in recent …
Formation mechanisms of naphthalene and indene: From the interstellar medium to combustion flames
The article addresses the formation mechanisms of naphthalene and indene, which
represent prototype polycyclic aromatic hydrocarbons (PAH) carrying two six-membered and …
represent prototype polycyclic aromatic hydrocarbons (PAH) carrying two six-membered and …