Generalized model for state-resolved chemical reaction rate coefficients in high-temperature air

Generalized model for state-resolved chemical reaction rate coefficients in high-temperature air

In the present study, we propose a general model for state-resolved reaction rate coefficients. The model combines the main advantages of several theoretical models for preferential dissociation and exchange reactions coupled to vibrational relaxation. Vibrational and electronic excitation of all sp...

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Veröffentlicht in:Journal of physics. Conference series 2021-07, Vol.1959 (1), p.12033
Hauptverfasser: Kustova, E, Savelev, A
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Sprache:eng
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Chemical reactions
High temperature air
Mathematical models
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description In the present study, we propose a general model for state-resolved reaction rate coefficients. The model combines the main advantages of several theoretical models for preferential dissociation and exchange reactions coupled to vibrational relaxation. Vibrational and electronic excitation of all species participating in the reaction is taken into account. The complete set of parameters for state-resolved chemical reactions in five-component air is obtained by fitting the results of the most reliable quasi-classical trajectory simulations in the temperature range 2000–15000 K.
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subjects Chemical reactions
High temperature air
Mathematical models
title Generalized model for state-resolved chemical reaction rate coefficients in high-temperature air
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