Oxidation of cyclopentadienyl radical with molecular oxygen: A theoretical study Article

Oleinikov, Artem D, Azyazov, Valeriy N, Mebel, Alexander M. (2018). Oxidation of cyclopentadienyl radical with molecular oxygen: A theoretical study . COMBUSTION AND FLAME, 191 309-319. 10.1016/j.combustflame.2018.01.010

Open Access International Collaboration

keywords

  • Ab initio calculations
  • COMBUSTION
  • Cyclopentadienyl
  • Energy & Fuels
  • Engineering
  • Engineering, Chemical
  • Engineering, Mechanical
  • Engineering, Multidisciplinary
  • KINETICS
  • NAPHTHYL RADICALS
  • Oxidation
  • PHENYL
  • PRODUCT YIELDS
  • Physical Sciences
  • Potential energy surface
  • RATE COEFFICIENTS
  • RATE CONSTANTS
  • REACTION-MECHANISM
  • RRKM - master equation
  • Rate constants
  • SOOT
  • Science & Technology
  • Technology
  • Thermodynamics

Digital Object Identifier (DOI)

publisher

  • ELSEVIER SCIENCE INC

start page

  • 309

end page

  • 319

volume

  • 191