activity
20072025
most citedInfluence of the position of the double bond on the autoignition of linear alkenes at low temperature

66 citations · 120 across the 10 of their papers we have counts for

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Showing 2007Show all

5 papers · 1 filter

physics.chem-ph2007

Primary reactions of the thermal decomposition of tricyclodecane

Olivier Herbinet, Baptiste Sirjean, Roda Bounaceur +4

In order to better understand the thermal decomposition of polycyclanes, the pyrolysis of tricyclodecane has been studied in a jet-stirred reactor at temperatures from 848 to 933 K…

physics.chem-ph2007★ 35 cited

Extension of the composite CBS-QB3 method to singlet diradical calculations

Baptiste Sirjean, René Fournet, Pierre-Alexandre Glaude +1

The composite CBS-QB3 method is widely used to obtain accurate energies of molecules and radicals although its use in the case of singlet diradicals gives rise to some difficulties…

physics.chem-ph2007

The autoignition of cyclopentane and cyclohexane in a shock tube

Baptiste Sirjean, Frédéric Buda, Hichem Hakka +4

Ignition delay times of cyclohexane-oxygen-argon and cyclopentane-oxygen-argon mixtures have been measured in a shock tube, the onset of ignition being detected by OH radical emiss…

physics.chem-ph2007

Detailed kinetic study of the ring opening of cycloalkanes by CBS-QB3 calculations

Baptiste Sirjean, Pierre-Alexandre Glaude, M. F. Ruiz-Lopez +1

This work reports a theoretical study of the gas phase unimolecular decomposition of cyclobutane, cyclopentane and cyclohexane by means of quantum chemical calculations. A biradica…

physics.chem-ph2007

Thermal decomposition of norbornane (bicyclo[2.2.1]heptane) dissolved in benzene. Experimental study and mechanism investigation

Olivier Herbinet, Baptiste Sirjean, Frédérique Battin-Leclerc +2

The thermal decomposition of norbornane (dissolved in benzene) has been studied in a jet stirred reactor at temperatures between 873 and 973 K, at residence times ranging from 1 to…