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[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 …
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 …
A review of terminology used to describe soot formation and evolution under combustion and pyrolytic conditions
This review presents a glossary and review of terminology used to describe the chemical
and physical processes involved in soot formation and evolution and is intended to aid in …
and physical processes involved in soot formation and evolution and is intended to aid in …
On the mechanism of soot nucleation
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 …
Modeling soot formation in flames and reactors: Recent progress and current challenges
The study of soot has long been motivated by its adverse impacts on health and the
environment. However, this combustion knowledge is also relevant to the production of …
environment. However, this combustion knowledge is also relevant to the production of …
Formation of incipient soot particles from polycyclic aromatic hydrocarbons: A ReaxFF molecular dynamics study
In this study, we present the results from a series of ReaxFF molecular dynamics (MD)
simulations to uncover the underlying mechanisms behind the nucleation and growth of …
simulations to uncover the underlying mechanisms behind the nucleation and growth of …
[HTML][HTML] Insights into incipient soot formation by atomic force microscopy
Combustion-generated soot particles can have significant impact on climate, environment
and human health. Thus, understanding the processes governing the formation of soot …
and human health. Thus, understanding the processes governing the formation of soot …
Soot formation mechanism of modern automobile engines and methods of reducing soot emissions: A review
As the main pollutant emitted by automobile engines, soot particles have brought great harm
to the environment and human health. However, the soot formation process in automobile …
to the environment and human health. However, the soot formation process in automobile …
Effects of oxygenated biofuel additives on soot formation: A comprehensive review of laboratory-scale studies
Oxygenated fuels have been widely used in combustion engines to tailor fuel properties,
improve combustion performance and reduce harmful emissions such as soot particles …
improve combustion performance and reduce harmful emissions such as soot particles …
A radical approach to soot formation
Humans have used the high-temperature synthesis of carbon particles as a source of
pigments since prehistoric times (1), and today,“carbon blacks” are used in tires, inks …
pigments since prehistoric times (1), and today,“carbon blacks” are used in tires, inks …