Search Results - "Dames, Enoch E"
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A detailed combined experimental and theoretical study on dimethyl ether/propane blended oxidation
Published in Combustion and flame (01-06-2016)“…In this paper, a binary fuel model for dimethyl ether (DME) and propane is developed, with a focus on engine-relevant conditions (10–50atm and 550–2000K). New…”
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Reaction Rate Constant of CH2O + H = HCO + H2 Revisited: A Combined Study of Direct Shock Tube Measurement and Transition State Theory Calculation
Published in The journal of physical chemistry. A, Molecules, spectroscopy, kinetics, environment, & general theory (06-11-2014)“…The rate constant of the H-abstraction reaction of formaldehyde (CH2O) by hydrogen atoms (H), CH2O + H = H2 + HCO, has been studied behind reflected shock…”
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3
Master Equation Modeling of the Unimolecular Decompositions of Hydroxymethyl (CH2OH) and Methoxy (CH3O) Radicals to Formaldehyde (CH2O) + H
Published in The journal of physical chemistry. A, Molecules, spectroscopy, kinetics, environment, & general theory (22-08-2013)“…α-Hydroxyalkyl radical intermediates (RCHOH, R = H, CH3, etc.) are common to the combustion of nearly all oxygenated fuels. Despite their importance in…”
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4
Automated reaction kinetics and network exploration (Arkane): A statistical mechanics, thermodynamics, transition state theory, and master equation software
Published in International journal of chemical kinetics (01-06-2023)“…The open‐source statistical mechanics software described here, Arkane–Automated Reaction Kinetics and Network Exploration–facilitates computations of…”
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Kinetics and Products of Vinyl + 1,3-Butadiene, a Potential Route to Benzene
Published in The journal of physical chemistry. A, Molecules, spectroscopy, kinetics, environment, & general theory (16-07-2015)“…The reaction between vinyl radical, C2H3, and 1,3-butadiene, 1,3-C4H6, has long been recognized as a potential route to benzene, particularly in 1,3-butadiene…”
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The Effect of Alcohol and Carbonyl Functional Groups on the Competition between Unimolecular Decomposition and Isomerization in C4 and C5 Alkoxy Radicals
Published in International journal of chemical kinetics (01-09-2016)“…ABSTRACT Presented here are computed rates for the thermal unimolecular decomposition of a variety of alkoxy radicals with four‐ and five‐carbon length…”
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7
An improved kinetic mechanism for 3-pentanone pyrolysis and oxidation developed using multispecies time histories in shock-tubes
Published in Combustion and flame (01-05-2014)“…Laser-based OH, CO, CH3, and H2O species histories during 3-pentanone oxidation were measured behind reflected shock waves over the temperature range of…”
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8
The engine reformer: Syngas production in an engine for compact gas-to-liquids synthesis
Published in Canadian journal of chemical engineering (01-04-2016)“…Methane (CH4) reforming was carried out in an internal combustion engine (an “engine reformer”). We successfully produced syngas from the partial oxidation of…”
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Master Equation Modeling of the Unimolecular Decompositions of α-Hydroxyethyl (CH3CHOH) and Ethoxy (CH3CH2O) Radicals
Published in International journal of chemical kinetics (01-03-2014)“…ABSTRACT The unimolecular decomposition of two radical isomers of C2H5O (CH3CH2O/ethoxy, CH3CHOH/α‐hydroxyethyl) are investigated by means of…”
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10
Master Equation Modeling of the Unimolecular Decompositions of [alpha]-Hydroxyethyl (CH3CHOH) and Ethoxy (CH3CH2O) Radicals
Published in International journal of chemical kinetics (01-03-2014)“…The unimolecular decomposition of two radical isomers of C2H5O (CH3CH2O/ethoxy, CH3CHOH/[alpha]-hydroxyethyl) are investigated by means of…”
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11
The Effect of Alcohol and Carbonyl Functional Groups on the Competition between Unimolecular Decomposition and Isomerization in C 4 and C 5 Alkoxy Radicals
Published in International journal of chemical kinetics (01-09-2016)“…ABSTRACT Presented here are computed rates for the thermal unimolecular decomposition of a variety of alkoxy radicals with four‐ and five‐carbon length…”
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12
The Effect of Alcohol and Carbonyl Functional Groups on the Competition between Unimolecular Decomposition and Isomerization in C 4 and C 5 Alkoxy Radicals: EFFECT OF ALCOHOL AND CARBONYL FUNCTIONAL GROUPS ON C4 AND C5 ALKOXY RADICALS
Published in International journal of chemical kinetics (05-07-2016)Get full text
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13
Master Equation Modeling of the Unimolecular Decompositions of Hydroxymethyl (CH sub(2)OH) and Methoxy (CH sub(3)O) Radicals to Formaldehyde (CH sub(2)O) + H
Published in The journal of physical chemistry. A, Molecules, spectroscopy, kinetics, environment, & general theory (02-08-2013)“…alpha -Hydroxyalkyl radical intermediates (RCHOH, R = H, CH sub(3), etc.) are common to the combustion of nearly all oxygenated fuels. Despite their importance…”
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Journal Article -
14
Automated reaction kinetics and network exploration (Arkane): A statistical mechanics, thermodynamics, transition state theory, and master equation software
Published in International journal of chemical kinetics (03-04-2023)“…Abstract The open‐source statistical mechanics software described here, Arkane–Automated Reaction Kinetics and Network Exploration–facilitates computations of…”
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15
Reaction Rate Constant of CH 2 O + H = HCO + H 2 Revisited: A Combined Study of Direct Shock Tube Measurement and Transition State Theory Calculation
Published in The journal of physical chemistry. A, Molecules, spectroscopy, kinetics, environment, & general theory (06-11-2014)Get full text
Journal Article -
16
Reaction Rate Constant of CH sub(2)O + H = HCO + H sub(2) Revisited: A Combined Study of Direct Shock Tube Measurement and Transition State Theory Calculation
Published in The journal of physical chemistry. A, Molecules, spectroscopy, kinetics, environment, & general theory (06-01-2014)“…The rate constant of the H-abstraction reaction of formaldehyde (CH sub(2)O) by hydrogen atoms (H), CH sub(2)O + H = H sub(2) + HCO, has been studied behind…”
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Journal Article -
17
An improved kinetic mechanism for 3-pentanone pyrolysis and oxidation developed using multispecies time histories in shock-tubes
Published in Combustion and flame (01-05-2014)Get full text
Journal Article