Article : texte imprimé

Kinetic modeling of the free-radical process during the initiated thermal cracking of normal alkanes with 1-nitropropane as an initiator

Yulei Guan, Auteur ; Bolun Yang, Auteur ; Suitao Qi, Auteur |

Dans Industrial & engineering chemistry research (Vol. 50 N° 15, Août 2011)

To elucidate the accelerating effect of 1-nitropropane on the thennal cracking of normal alkanes, ab initio and density functional theory calculations were performed to investigate the elementary reactions involved in the initiated thermal crack[...]

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