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DSMC.ini
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! =============================================================================== !
! Species1, CO2
! =============================================================================== !
Part-Species1-SpeciesName=CO2
Part-Species1-PolyatomicMol=true
Part-Species1-InteractionID=2
Part-Species1-Tref=273
Part-Species1-dref=5.10E-10
Part-Species1-omega=0.24
Part-Species1-NumOfAtoms=3
Part-Species1-LinearMolec=true
Part-Species1-CharaTempVib1=959.2
Part-Species1-CharaTempVib2=959.2
Part-Species1-CharaTempVib3=1917
Part-Species1-CharaTempVib4=3378.1
Part-Species1-Ediss_eV=5.43
Part-Species1-HeatOfFormation_K=-47328.35
Part-Species1-CharaTempRot = 0.6
Part-Species1-SymmetryFactor = 2
! =============================================================================== !
! Species2, CO
! =============================================================================== !
Part-Species2-SpeciesName=CO
Part-Species2-InteractionID=2
Part-Species2-Tref=273
Part-Species2-dref=4.17E-10
Part-Species2-omega=0.24
Part-Species2-CharaTempVib=3120.7
Part-Species2-Ediss_eV=11.06
Part-Species2-HeatOfFormation_K=-13293.70
Part-Species2-CharaTempRot = 2.8
Part-Species2-SymmetryFactor = 1
! =============================================================================== !
! Species3, O
! =============================================================================== !
Part-Species3-SpeciesName=O
Part-Species3-InteractionID=1
Part-Species3-Tref=273
Part-Species3-dref=3.49E-10
Part-Species3-omega=0.24
Part-Species3-HeatOfFormation_K=29969.45
! =============================================================================== !
! Data for chemical Reaction
! =============================================================================== !
DSMC-NumOfReactions=1
!--------------------------------------------------------------------!
!--------- Reaction1: CO2 + M -> CO + O + M ------------------------!
!--------------------------------------------------------------------!
DSMC-Reaction1-ReactionModel=TCE
DSMC-Reaction1-Reactants=(/1,0,0/)
DSMC-Reaction1-Products=(/2,0,3,0/)
DSMC-Reaction1-Arrhenius-Prefactor=1.15E-08
DSMC-Reaction1-Arrhenius-Powerfactor=-1.5
DSMC-Reaction1-Activation-Energy_K=63280
DSMC-Reaction1-NumberOfNonReactives=3
DSMC-Reaction1-NonReactiveSpecies=(/1,2,3/)