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Combustion in the future: The importance of chemistry

Authors :
Katharina Kohse-Höinghaus
Source :
Proceedings of the Combustion Institute. International Symposium on Combustion
Publication Year :
2020
Publisher :
Elsevier, 2020.

Abstract

Combustion involves chemical reactions that are often highly exothermic. Combustion systems utilize the energy of chemical compounds released during this reactive process for transportation, to generate electric power, or to provide heat for various applications. Chemistry and combustion are interlinked in several ways. The outcome of a combustion process in terms of its energy and material balance, regarding the delivery of useful work as well as the generation of harmful emissions, depends sensitively on the molecular nature of the respective fuel. The design of efficient, low-emission combustion processes in compliance with air quality and climate goals suggests a closer inspection of the molecular properties and reactions of conventional, bio-derived, and synthetic fuels. Information about flammability, reaction intensity, and potentially hazardous combustion by-products is important also for safety considerations. Moreover, some of the compounds that serve as fuels can assume important roles in chemical energy storage and conversion. Combustion processes can furthermore be used to synthesize materials with attractive properties. A systematic understanding of the combustion behavior thus demands chemical knowledge. Desirable information includes properties of the thermodynamic states before and after the combustion reactions and relevant details about the dynamic processes that occur during the reactive transformations from the fuel and oxidizer to the products under the given boundary conditions. Combustion systems can be described, tailored, and improved by taking chemical knowledge into account. Combining theory, experiment, model development, simulation, and a systematic analysis of uncertainties enables qualitative or even quantitative predictions for many combustion situations of practical relevance. This article can highlight only a few of the numerous investigations on chemical processes for combustion and combustion-related science and applications, with a main focus on gas-phase reaction systems. It attempts to provide a snapshot of recent progress and a guide to exciting opportunities that drive such research beyond fossil combustion. © 2020 The Combustion Institute. Published by Elsevier Inc. All rights reserved.

Subjects

Subjects :
Chemical process
2M2B, 2-methyl-2-butene
General Chemical Engineering
PDF, probability density function
XAS, X-ray absorption spectroscopy
QCL, quantum cascade laser
Combustion
DFT, density functional theory
PM10 PM2,5, sampled fractions with sizes up to ∼10 and ∼2,5 µm
KDE, kernel density estimation
Combustion diagnostics
DEE, diethyl ether
Energy transformation
WLTP, Worldwide Harmonized Light Vehicle Test Procedure
DFWM, degenerate four-wave mixing
FC, fuel cell
Energy
PFR, plug-flow reactor
PES, photoelectron spectrum/spectra
SOx, sulfur oxides
LH2, liquid hydrogen
LIF, laser-induced fluorescence
LII, laser-induced incandescence
SNR, signal-to-noise ratio
CI, compression ignition
GW, global warming
OTMS, Orbitrap MS
FCEV, fuel cell electric vehicle
PI, photoionization
PAH, polycyclic aromatic hydrocarbon
DME, dimethyl ether
GC, gas chromatography
MVK, methyl vinyl ketone
RCM, rapid compression machine
SOEC, solid-oxide electrolysis cell
SOFC, solid-oxide fuel cell
Reaction mechanisms
EGR, exhaust gas recirculation
IE, ionization energy
PEM, polymer electrolyte membrane
HFO, heavy fuel oil
Article
PACT, predictive automated computational thermochemistry
Combustion chemistry
IR, infrared
ICEV, internal combustion engine vehicle
ALS, Advanced Light Source
PIV, particle imaging velocimetry
OME, oxymethylene ether
VOC, volatile organic compound
KHP, ketohydroperoxide
TOF-MS, time-of-flight MS
MDO, marine diesel oil
DMM, dimethoxy methane
NTC, negative temperature coefficient
Mechanical Engineering
EI, electron ionization
BC, black carbon
CCS, carbon capture and storage
HAB, height above the burner
TDLAS, tunable diode laser absorption spectroscopy
RCCI, reactivity-controlled compression ignition
AFM, atomic force microscopy
Chemical energy
TiRe-LII, time-resolved LII
Combustion synthesis
Biofuels
Combustion modeling
HRTEM, high-resolution transmission electron microscopy
GHG, greenhouse gas
HCCI, homogeneous charge compression ignition
SVO, straight vegetable oil
TSI, threshold sooting index
BEV, battery electric vehicle
JSR, jet-stirred reactor
PIE, photoionization efficiency
NOx, nitrogen oxides
RMG, reaction mechanism generator
LOHC, liquid organic hydrogen carrier
LTC, low-temperature combustion
MBMS, molecular-beam MS
ATcT, Active Thermochemical Tables
PRF, primary reference fuel
UFP, ultrafine particle
ARAS, atomic resonance absorption spectroscopy
LCA, lifecycle analysis
DMC, dimethyl carbonate
RON, research octane number
CA, crank angle
LT, low-temperature
FT, Fischer-Tropsch
Flammability
DBE, di-n-butyl ether
BTL, biomass-to-liquid
APCI, atmospheric pressure chemical ionization
YSI, yield sooting index
Energy conversion
MTO, methanol-to-olefins
DRIFTS, diffuse reflectance infrared Fourier transform spectroscopy
Emissions
LNG, liquefied natural gas
LIGS, laser-induced grating spectroscopy
VUV, vacuum ultraviolet
HACA, hydrogen abstraction acetylene addition
TPES, threshold photoelectron spectrum/spectra
Exothermic reaction
Process (engineering)
REMPI, resonance-enhanced multi-photon ionization
SIMS, secondary ion mass spectrometry
STM, scanning tunneling microscopy
Fuels
CRDS, cavity ring-down spectroscopy
PM, particulate matter
FRET, fluorescence resonance energy transfer
IPCC, Intergovernmental Panel on Climate Change
CEAS, cavity-enhanced absorption spectroscopy
SOA, secondary organic aerosol
SNG, synthetic natural gas
Physical and Theoretical Chemistry
SI, spark ignition
DCN, derived cetane number
IC, internal combustion
TPRF, toluene primary reference fuel
Combustion kinetics
PEPICO, photoelectron photoion coincidence
CFD, computational fluid dynamics
GTL, gas-to-liquid
CTL, coal-to-liquid
PLIF, planar laser-induced fluorescence
Synthetic fuels
MS, mass spectrometry
FTIR, Fourier-transform infrared
Electric power
Biochemical engineering

Details

Language :
English
Database :
OpenAIRE
Journal :
Proceedings of the Combustion Institute. International Symposium on Combustion
Accession number :
edsair.doi.dedup.....f3000cde68ef341028ddd5bf5624c989
Full Text :
https://doi.org/10.1016/j.proci.2020.06.375