Skip to main content
U.S. Department of Energy
Office of Scientific and Technical Information

Acceleration of a Chemical Reaction due to Nonequilibrium Collisional Dynamics: Dimerization of Polyaromatics

Journal Article · · Journal of Physical Chemistry Letters
 [1];  [2];  [3]
  1. Department of Chemistry and Biochemistry, Florida International University, Miami, Florida33199, United States; OSTI
  2. Department of Chemistry and Biochemistry, Florida International University, Miami, Florida33199, United States
  3. Department of Mechanical Engineering, University of California at Berkeley, Berkeley, California94720, United States
Not provided.
Research Organization:
Florida International Univ. (FIU), Miami, FL (United States)
Sponsoring Organization:
USDOE Office of Science (SC)
DOE Contract Number:
FG02-04ER15570
OSTI ID:
2419003
Journal Information:
Journal of Physical Chemistry Letters, Journal Name: Journal of Physical Chemistry Letters Journal Issue: 49 Vol. 13; ISSN 1948-7185
Publisher:
American Chemical Society
Country of Publication:
United States
Language:
English

References (38)

Unimolecular Dissociations and Free Radical Recombination Reactions journal March 1952
Mechanism of E-bridge formation by various PAH molecules: A theoretical study journal July 2022
Molecular mass growth through ring expansion in polycyclic aromatic hydrocarbons via radical–radical reactions journal August 2019
The Molecular Composition of Soot journal January 2020
π-Diradical Aromatic Soot Precursors in Flames journal August 2021
The Recombination of Propargyl Radicals and Other Reactions on a C 6 H 6 Potential journal October 2003
The Lancet Commission on pollution and health journal February 2018
Molecular dynamics with combined quantum and empirical potentials: C 2 H 2 adsorption on Si(100) journal July 1993
A study on the coagulation of polycyclic aromatic hydrocarbon clusters to determine their collision efficiency journal March 2010
Modelling soot formation in a benchmark ethylene stagnation flame with a new detailed population balance model journal May 2019
Kinetic modeling of soot formation with detailed chemistry and physics: laminar premixed flames of C2 hydrocarbons journal April 2000
Detection of Aliphatically Bridged Multi-Core Polycyclic Aromatic Hydrocarbons in Sooting Flames with Atmospheric-Sampling High-Resolution Tandem Mass Spectrometry journal November 2018
Physical origins of interactions in dimers of polycyclic aromatic hydrocarbons journal January 2008
Reaction mechanism of soot formation in flames journal February 2002
Thermodynamics of poly-aromatic hydrocarbon clustering and the effects of substituted aliphatic chains journal January 2013
Isolation of an Intrinsic Precursor to Molecular Chemisorption journal January 1998
A quantitative study of the clustering of polycyclic aromatic hydrocarbons at high temperatures journal January 2012
Soot formation journal January 1981
The kinetics of polynuclear aromatic hydrocarbon agglomeration in flames journal January 1991
Investigating repetitive reaction pathways for the formation of polycyclic aromatic hydrocarbons in combustion processes journal June 2017
Bounding the role of black carbon in the climate system: A scientific assessment: BLACK CARBON IN THE CLIMATE SYSTEM journal June 2013
Fifty years of research and progress on carbon black journal January 1994
Prenucleation chemistry of aromatics: A two-ring precursor? journal September 2022
On the mechanism of soot nucleation journal January 2020
Formation of nascent soot and other condensed-phase materials in flames journal January 2011
Experimental study of the influence of hydrogen as a fuel additive on the formation of soot precursors and particles in atmospheric laminar premixed flames of methane journal March 2021
Detailed kinetic modeling of soot formation in shock-tube pyrolysis of acetylene journal January 1985
Dynamics of Pyrene-Dimer Association and Ensuing Pyrene-Dimer Dissociation journal October 2020
Air pollution and COVID-19 mortality in the United States: Strengths and limitations of an ecological regression analysis journal November 2020
Nucleation of soot: Molecular dynamics simulations of pyrene dimerization journal January 2002
On the Mechanism of Soot Nucleation. III. The Fate and Facility of the E-Bridge journal August 2021
Evidence on the formation of dimers of polycyclic aromatic hydrocarbons in a laminar diffusion flame journal August 2020
Detailed Kinetic Monte Carlo Simulations of Graphene-Edge Growth journal January 2010
Reformulation and Solution of the Master Equation for Multiple-Well Chemical Reactions journal May 2013
Reactivity of Polycyclic Aromatic Hydrocarbon Soot Precursors: Kinetics and Equilibria journal November 2020
Exploring the Role of PAHs in the Formation of Soot: Pyrene Dimerization journal September 2010
Insights into incipient soot formation by atomic force microscopy journal January 2019
Resonance-stabilized hydrocarbon-radical chain reactions may explain soot inception and growth journal September 2018

Similar Records

Kinetics of nonequilibrium chemical reactions and separation of isotopes
Journal Article · 1975 · Zh. Eksp. Teor. Fiz., v. 68, no. 6, pp. 2032-2037 · OSTI ID:4096232

Numerical investigation of nonequilibrium electron effects on the collisional ionization rate in the collisional-radiative model
Journal Article · 2024 · Physical Review. E · OSTI ID:2396425