Combustion chemistry in the twenty-first century: Developing theory-informed chemical kinetics models

JA Miller, R Sivaramakrishnan, Y Tao… - Progress in Energy and …, 2021 - Elsevier
Over the last 20 to 25 years theoretical chemistry (particularly theoretical chemical kinetics)
has played an increasingly important role in developing chemical kinetics models for …

Recent advances in understanding of flammability characteristics of hydrogen

AL Sánchez, FA Williams - Progress in Energy and Combustion Science, 2014 - Elsevier
The current increasing interest in hydrogen utilization and increasing understanding of
hydrogen combustion motivate this review of flammability characteristics of hydrogen. The …

Measurement and modelling of the laminar burning velocity of methane-ammonia-air flames at high pressures using a reduced reaction mechanism

EC Okafor, Y Naito, S Colson, A Ichikawa, T Kudo… - Combustion and …, 2019 - Elsevier
Ammonia and blends of ammonia with methane are gaining increased interest as fuels for
gas turbine applications and hence optimized reduced reaction mechanisms for the fuels …

Detailed kinetic mechanism for the oxidation of ammonia including the formation and reduction of nitrogen oxides

KP Shrestha, L Seidel, T Zeuch, F Mauss - Energy & fuels, 2018 - ACS Publications
This work introduces a newly developed reaction mechanism for the oxidation of ammonia
in freely propagating and burner-stabilized premixed flames as well as shock-tube, jet …

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 …

Yet another kinetic mechanism for hydrogen combustion

AA Konnov - Combustion and Flame, 2019 - Elsevier
Recent suggestion by Burke and Klippenstein (2017) that chemically termolecular reactions
H+ O 2+ R may significantly affect kinetic pathways under common combustion situations …

An ignition delay time and chemical kinetic modeling study of the pentane isomers

J Bugler, B Marks, O Mathieu, R Archuleta… - Combustion and …, 2016 - Elsevier
Ignition delay times of n-pentane, iso-pentane, and neo-pentane mixtures were measured in
two shock tubes and in a rapid compression machine. The experimental data were used as …

Influence of functional groups on low-temperature combustion chemistry of biofuels

B Rotavera, CA Taatjes - Progress in Energy and Combustion Science, 2021 - Elsevier
Ongoing progress in synthetic biology, metabolic engineering, and catalysis continues to
produce a diverse array of advanced biofuels with complex molecular structure and …

Development of a reduced primary reference fuel mechanism for internal combustion engine combustion simulations

H Wang, M Yao, RD Reitz - Energy & Fuels, 2013 - ACS Publications
A reduced PRF mechanism was proposed for combustion simulations of PRF and
diesel/gasoline fuels based on the latest LLNL mechanism. The reduced PRF mechanism …

[HTML][HTML] An experimental and kinetic modeling study of the auto-ignition of natural gas blends containing C1–C7 alkanes

AAES Mohamed, S Panigrahy, AB Sahu… - Proceedings of the …, 2021 - Elsevier
Ignition delay time measurements for multi-component natural gas mixtures were carried out
using a rapid compression machine at conditions relevant to gas turbine operation, at …