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Master Equation Modelling of Non-equilibrium Chemistry in Stellar Outflows

descriptionPublicationkeyboard_double_arrow_right Article 31 Jan 2022 English Publisher:ZenodoFunded by:UKRI | A Programme of Astrophysi...
Authors: John M. C. Plane; Stuart H. Robertson;

doi: 10.5281/zenodo.5925204 , 10.5281/zenodo.5925205

Master Equation Modelling of Non-equilibrium Chemistry in Stellar Outflows

Abstract

Supplementary Information for a Faraday Discussion paper. Contents: Figure S1. Potential energy surface for the reaction between SiO2 and H2O. Energies are calculated at the cbs-qb3 level of theory [Montgomery et al., 1999]. Table S1. Molecular properties and heats of formation (at 0 K) of the stationary points on the SiO2 + H2O potential energy surface. Table S2. Reaction scheme for forming gas-phase Ca, Fe and Mg silicate molecules in the stellar outflow.

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Keywords

Stellar outflow chemistry, Vibrational disequilibrium, Master Equation statistical rate theory

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