THE USE OF DATABASE FOR PHYSICOCHEMICAL PROCESSES IN FORMULATION OF SETS OF EQUATIONS GOVERNING A CHEMICALLY REACTING AND VIBRATIONALLY RELAXING GAS

Citation
Vn. Makarov et Sa. Losev, THE USE OF DATABASE FOR PHYSICOCHEMICAL PROCESSES IN FORMULATION OF SETS OF EQUATIONS GOVERNING A CHEMICALLY REACTING AND VIBRATIONALLY RELAXING GAS, CHEMICAL PHYSICS REPORTS, 16(5), 1997, pp. 793-812
Citations number
15
Categorie Soggetti
Physics, Atomic, Molecular & Chemical
Journal title
ISSN journal
10741550
Volume
16
Issue
5
Year of publication
1997
Pages
793 - 812
Database
ISI
SICI code
1074-1550(1997)16:5<793:TUODFP>2.0.ZU;2-B
Abstract
A universal generator of equations that describe physicochemical kinet ics using databases comprising chemical and plasma-chemical reactions, vibration-vibrational and vibration-translational energy exchange bet ween various modes in molecules, and processes allowing for the effect of chemical reactions on vibrational relaxation is developed. A mathe matical model of physicochemical processes in mixtures containing CO2, N-2, He, H2O, CO, O-2, H-2, NO, OH, H, and O molecules and atoms is s uggested, a mechanism of vibrational energy exchange and chemical reac tions is chosen, and a physicochemical database is compiled. Potential ity of the generator is illustrated by way of example of numerical sim ulation of kinetic processes taking place in flows of a CO2-containing laser mixture in a supersonic nozzle and laser cavity.