Theoretical approaches for studying Astrochemistry
GRALL, UMR 5024, CNRS et Université de Montpellier II, Place Eugene Bataillon, 34095 Montpellier, France
The most popular ab initio theoretical approaches that are used to study the gas phase astrochemical reactivity are presented. The methods that are needed for the electronic calculation and the statistical approaches that are used for determining the rate coefficients are detailed.
© Owned by the authors, published by EDP Sciences, 2011