Reactions of O2+ with OH-isoprene adduct isomers: Exothermicity, product ions, and rate constants Academic Article

abstract

• The chemical ionization mass spectroscopy (CIMS) was employed for the detection of OH-isoprene adduct radicals. The structures and energies of the product ions from the charge transfer reactions of oxygen ion with OH-isoprene adduct radicals were estimated by ab initio calculations. Density functional theory provided the geometry optimizations of the OH-isoprene adduct cations. Ion energies were calculated by the coupled-cluster theory with single and double excitations.

authors

• Zhang, Renyi

author list (cited authors)

• Zhang, R., & Lei, W.

citation count

• 15

publication date

• November 2000

publisher

• AIP Publishing  Publisher

published in

• J Chem Phys  Journal

Digital Object Identifier (DOI)

• 10.1063/1.1318736

start page

• 8574

end page

• 8579

volume

• 113

issue

• 19