Ab initio quantum chemical predictions of enthalpies of formation, heat capacities, and entropies of gas-phase energetic compounds

Antoine Osmont; L. Catoire; Iskender Gökalp; Vigor Yang

doi:10.1016/j.combustflame.2007.05.001

Journal articles

Ab initio quantum chemical predictions of enthalpies of formation, heat capacities, and entropies of gas-phase energetic compounds

Antoine Osmont L. Catoire Iskender Gökalp ¹ Vigor Yang

1 ICARE - Institut de Combustion, Aérothermique, Réactivité et Environnement

Document type :

Journal articles

Domain :

Engineering Sciences [physics]

Engineering Sciences [physics] / Reactive fluid environment

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https://hal.archives-ouvertes.fr/hal-01221102
Contributor : Laurent Catoire <>
Submitted on : Tuesday, October 27, 2015 - 2:19:48 PM
Last modification on : Wednesday, March 20, 2019 - 1:20:20 AM

Ab initio quantum chemical predictions of enthalpies of formation, heat capacities, and entropies of gas-phase energetic compounds

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Ab initio quantum chemical predictions of enthalpies of formation, heat capacities, and entropies of gas-phase energetic compounds

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