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Published in 2018 at "Computational and Theoretical Chemistry"
DOI: 10.1016/j.comptc.2018.02.014
Abstract: Abstract Guaiacol is the main representative of methoxyphenols generated from the pyrolysis of ligin. The gas-phase reaction mechanism of guaiacol with NO3 radical was researched by using density functional theory at M06-2X/6-31+g(d,p)//M06-2X/6-311+g(3df,2p) level in this…
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Keywords:
mechanism kinetic;
guaiacol;
mechanism;
nitrate radical ... See more keywords
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Published in 2021 at "Fuel"
DOI: 10.1016/j.fuel.2021.121315
Abstract: Abstract Coolant additives are commonly used to offset the excessive combustion temperature of 5-aminotetrazole (5-AT) based solid propellants. However, the discrepancy of the burn-rate reduction by different coolants has been observed, restricting the precise control…
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Keywords:
decomposition;
decomposition mechanism;
mechanism kinetic;
kinetic behavior ... See more keywords
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Published in 2018 at "Energy & Fuels"
DOI: 10.1021/acs.energyfuels.8b02612
Abstract: In this work, the aqueous solutions of 1-hydroxyethyl-3-methylimidazolium lysine ([C2OHmim][Lys]) and methyldiethanolamine (MDEA) were developed to obtain an efficient absorbent for CO2 capture. The absorption performance, regeneration performance, reaction mechanism, and kinetic study of the…
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Keywords:
absorption;
methylimidazolium lysine;
mechanism kinetic;
hydroxyethyl methylimidazolium ... See more keywords
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Published in 2018 at "Kinetics and Catalysis"
DOI: 10.1134/s0023158418040079
Abstract: A kinetic study of ethylene oxidation to acetaldehyde by p-benzoquinone in the Pd(OAc)2–HClO4−LiClO4–CH3CN–H2O system has been carried out under conditions when palladium(II) cationic complexes exist at a molar fraction of water of 0.67 and 30°С.…
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Keywords:
cationic complexes;
mechanism kinetic;
oxidation;
kinetic models ... See more keywords
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Published in 2023 at "Catalysts"
DOI: 10.3390/catal13050799
Abstract: Methacrolein (MAL) is an important intermediate extensively used in the manufacture of methyl methacrylate and other materials (polymers and resins). In this study, a series of secondary amines/acids were explored as catalysts for the condensation…
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Keywords:
kinetic study;
methacrolein;
mechanism kinetic;
synthesis methacrolein ... See more keywords