2018
DOI: 10.1126/science.aau5941
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A radical approach to soot formation

Abstract: Chain reactions of resonance-stabilized radicals turn molecules into clusters and nanoparticles

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Cited by 102 publications
(39 citation statements)
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“…Note that the chain propagation reactions involving RSRs has been confirmed by quantum computations [138]. However, detailed rates for the various proposed radical chain propagation reactions still need to be determined so that a complete mechanism can be assembled to test the capabilities of the CHRCR mechanism in predicting the formation of large molecular species and soot [273].…”
Section: C2h2 → 2csoot + H2 R45 C6h6 → 6csoot + 3h2 R46mentioning
confidence: 97%
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“…Note that the chain propagation reactions involving RSRs has been confirmed by quantum computations [138]. However, detailed rates for the various proposed radical chain propagation reactions still need to be determined so that a complete mechanism can be assembled to test the capabilities of the CHRCR mechanism in predicting the formation of large molecular species and soot [273].…”
Section: C2h2 → 2csoot + H2 R45 C6h6 → 6csoot + 3h2 R46mentioning
confidence: 97%
“…While previous mechanisms for covalent cluster formation required repeated high energy barrier activation of stable PAHs (and thus not perfectly compatible with the rapid nucleation of soot, even in low temperature radical-starved regions), the recently proposed clustering of hydrocarbon by radical chain reaction (CHRCR) mechanism [138] highlights the role of radical chain propagation through resonantly stabilized radicals. This new CHRCR mechanism overcomes the issue of low molecular growth rates associated with existing chemical nucleation mechanisms and also allows σ-dimerization from large RSRs [138,273]. Although promising, one challenge is that detailed reaction rates must be established for the proposed reactions so that an extensive kinetic mechanism can be assembled to test whether CHRCR can explain experimental features on soot formation.…”
Section: Summary Challenges and Prospectsmentioning
confidence: 99%
“…In addition, it could be seen from the results of SEM images that the char layer surface of formulation 2 in addition of PHC was greatly different from formulation 1. EPDM insulation materials (Organic polymers containing hydrocarbons) produced PAH 33 in the process of ablation, and PAH was an organic phase with benzene ring structure. Also, PHC contained organic phase and was weak in polarity.…”
Section: Resultsmentioning
confidence: 99%
“…The PHRR of AL5 and AL10 is nearly the same, whereas the PRSR of AL10 is 10.7% lower than that of AL5. The reduction of PRSR may result from the transition metal ions in the LDHs (Zn 2+ ), which can catalyze the thermal degradation of the polymer [34], suppress the growth of polyaromatic hydrocarbons and the growth of their clusters, and reduce the formation of soot [35].…”
Section: Resultsmentioning
confidence: 99%