Reactions forming Cn=2,10(0,+), C n=2,4H(0,+), and C3H2(0,+)in the gas phase: Semiempirical branching ratios

Abstract

The aim of this paper is to provide a new set of branching ratios (BRs) for interstellar and planetary chemical networks based on a semiempirical model. We applied, instead of zero-order theory (i.e., only the most exoergic decaying channel is considered), a statistical microcanonical model based on the construction of breakdown curves and using experimental high velocity collision BRs for their parameterization. We applied the model to ion-molecule, neutral-neutral, and ion-pair reactions implemented in the few popular databases for astrochemistry, such as KIDA, OSU, and UMIST. We studied the reactions of carbon and hydrocarbon species with electrons, He+, H+, CH+, CH, C, and C+ leading to intermediate complexes of the type Cn=2,10, Cn=2,4H, C3H2, C Cn=2,10+, Cn=2,4H+, or C 3H2+. Comparison of predictions with measurements supports the validity of the model. Huge deviations with respect to database values are often obtained. Effects of the new BRs in time-dependent chemistry for dark clouds and for photodissociation region chemistry with conditions similar to those found in the Horsehead Nebula are discussed. © 2013. The American Astronomical Society. All rights reserved.