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cxp484 merged 2 commits into from
Jan 20, 2025
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FDS Manuals: Change tolerance in the Verification guide for reactionrate_arrhenius_equilibrium case. #14087

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FDS Manuals: Verification guide change tolerance for equilibrium case.
cxp484 Jan 20, 2025
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Merge remote-tracking branch 'firemodels/master'
cxp484 Jan 20, 2025
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2 changes: 1 addition & 1 deletion Manuals/FDS_Verification_Guide/FDS_Verification_Guide.tex
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Expand Up @@ -3737,7 +3737,7 @@ \subsection{Finite Rate Reactions (\texorpdfstring{\ct{reactionrate\_arrhenius}}
\begin{table}[ht]
\begin{center}
\caption[Arrhenius values for Jones-Lindstedt four-step reversible C$_3$H$_8$ reaction]{Arrhenius values for Jones-Lindstedt four-step C$_3$H$_8$ reaction for equilibrium; $\alpha$ = [$\mathrm{C_3H_8}$ $\mathrm{O_2}$ $\mathrm{CO}$ $\mathrm{H_2O}$ $\mathrm{CO_2}$ $\mathrm{H_2}$].}
\label{two_step_eq_rev_c3h8}
\label{jones_lindstedt_four_step_eq_rev_c3h8}
\begin{tabular}{|l|l|l|l|l|l|l|l|l|}
\hline Reaction & $\nu_{\alpha}$ & E (J/mol) & A (cm$^3$/mole/s) & $a_{\alpha}$ & $n_i$ \\ \hline \hline
\ref{eq:jones_lindstedt_r1} & [-1 -1.5 3 0 0 4] & 125520 & 0.4e12 & [0.5 1.25 0 0 0 0] & 0 \\ \hline
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4 changes: 2 additions & 2 deletions Utilities/Matlab/FDS_verification_dataplot_inputs.csv
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Expand Up @@ -539,7 +539,7 @@ d,reactionrate_arrhenius_2order_1step,Species/reactionrate_arrhenius_2order_1ste
d,reactionrate_arrhenius_1p75order_2step,Species/reactionrate_arrhenius_1p75order_2step_git.txt,Species/reactionrate_arrhenius_1p75order_2step_soln.csv,1,2,Time,O2|C3H8|CO|CO2|H2O,Cantera O2|Cantera C3H8|Cantera CO|Cantera CO2|Cantera H2O,bo|ko|ro|go|mo,0,100000,,0,100000,-1.00E+09,1.00E+09,0,Species/reactionrate_arrhenius_1p75order_2step_devc.csv,2,3,Time,O2|C3H8|CO|CO2|H2O,FDS RK O2|FDS RK C3H8|FDS RK CO|FDS RK CO2|FDS RK H2O,b|k|r|g|m,0,100000,,0,100000,-1.00E+09,1.00E+09,0,Species Mass Fraction (Arrhenius 1.75 Order),Time (s),Mass Fraction,0,10,1,0,0.3,1,no,0.02 0.90,EastOutside,,1.365,linear,FDS_Verification_Guide/SCRIPT_FIGURES/reactionrate_arrhenius_1p75order_2step,Absolute Error,end,1.00E-02,Species,mx,m,TeX
d,reactionrate_arrhenius_1p75order_2stepr,Species/reactionrate_arrhenius_1p75order_2stepr_git.txt,Species/reactionrate_arrhenius_1p75order_2stepr_soln.csv,1,2,Time,O2|C3H8|CO|CO2|H2O,Cantera O2|Cantera C3H8|Cantera CO|Cantera CO2|Cantera H2O,bo|ko|ro|go|mo,0,100000,,0,100000,-1.00E+09,1.00E+09,0,Species/reactionrate_arrhenius_1p75order_2stepr_devc.csv,2,3,Time,O2|C3H8|CO|CO2|H2O,FDS RK O2|FDS RK C3H8|FDS RK CO|FDS RK CO2|FDS RK H2O,b|k|r|g|m,0,100000,,0,100000,-1.00E+09,1.00E+09,0,Species Mass Fraction (Arrhenius 1.75 Order),Time (s),Mass Fraction,0,10,1,0,0.3,1,no,0.02 0.90,EastOutside,,1.365,linear,FDS_Verification_Guide/SCRIPT_FIGURES/reactionrate_arrhenius_1p75order_2stepr,Absolute Error,end,1.00E-02,Species,mx,m,TeX
d,reactionrate_arrhenius_equilibrium,Species/reactionrate_arrhenius_equilibrium_git.txt,Species/reactionrate_arrhenius_equilibrium_soln.csv,1,2,Time,O2|C3H8|CO|CO2|H2O,Cantera O2|Cantera C3H8|Cantera CO|Cantera CO2|Cantera H2O,bo|ko|ro|go|mo,0,100000,,0,100000,-1.00E+09,1.00E+09,0,Species/reactionrate_arrhenius_equilibrium_devc.csv,2,3,Time,O2|C3H8|CO|CO2|H2O,FDS RK O2|FDS RK C3H8|FDS RK CO|FDS RK CO2|FDS RK H2O,b|k|r|g|m,0,100000,,0,100000,-1.00E+09,1.00E+09,0,Species Mass Fraction (Equilibrium),Time (s),Mass Fraction,0,4,1,0,0.25,1,no,0.05 0.90,EastOutside,,1.365,linear,FDS_Verification_Guide/SCRIPT_FIGURES/reactionrate_equilibrium_species,Absolute Error,end,1.00E-02,Species,mx,m,TeX
d,reactionrate_arrhenius_equilibrium,Species/reactionrate_arrhenius_equilibrium_git.txt,Species/reactionrate_arrhenius_equilibrium_soln.csv,1,2,Time,Temperature,Cantera Temperature,bo,0,100000,,0,100000,-1.00E+09,1.00E+09,0,Species/reactionrate_arrhenius_equilibrium_devc.csv,2,3,Time,TEMP,FDS RK Temperature,b,0,100000,,0,100000,-1.00E+09,1.00E+09,0,Temperature (Equilibrium),Time (s),Temperature (°C),0,4,1,0,3500,1,no,0.05 0.90,SouthEast,,1,linear,FDS_Verification_Guide/SCRIPT_FIGURES/reactionrate_equilibrium_temperature,Relative Error,end,1.00E-02,Species,mx,m,TeX
d,reactionrate_arrhenius_equilibrium,Species/reactionrate_arrhenius_equilibrium_git.txt,Species/reactionrate_arrhenius_equilibrium_soln.csv,1,2,Time,Temperature,Cantera Temperature,bo,0,100000,,0,100000,-1.00E+09,1.00E+09,0,Species/reactionrate_arrhenius_equilibrium_devc.csv,2,3,Time,TEMP,FDS RK Temperature,b,0,100000,,0,100000,-1.00E+09,1.00E+09,0,Temperature (Equilibrium),Time (s),Temperature (°C),0,4,1,0,3500,1,no,0.05 0.90,SouthEast,,1,linear,FDS_Verification_Guide/SCRIPT_FIGURES/reactionrate_equilibrium_temperature,Relative Error,end,2.00E-02,Species,mx,m,TeX
d,reactionrate_arrhenius_equilibrium,Species/reactionrate_arrhenius_equilibrium_git.txt,Species/reactionrate_arrhenius_equilibrium_soln.csv,1,2,Time,Pressure,Cantera Pressure,bo,0,100000,,0,100000,-1.00E+09,1.00E+09,0,Species/reactionrate_arrhenius_equilibrium_devc.csv,2,3,Time,PRES,FDS RK Pressure,b,0,100000,,0,100000,-1.00E+09,1.00E+09,0,Pressure (Equilibrium),Time (s),Pressure (Pa),0,4,1,0,500000,1,no,0.05 0.90,SouthEast,,1,linear,FDS_Verification_Guide/SCRIPT_FIGURES/reactionrate_equilibrium_pressure,Relative Error,end,2.00E-02,Species,mx,m,TeX
d,reactionrate_arrhenius_jones_lindstedt,Species/reactionrate_arrhenius_jones_lindstedt_git.txt,Species/reactionrate_arrhenius_jones_lindstedt_soln.csv,1,2,Time,O2|C3H8|CO|CO2|H2O,Cantera O2|Cantera C3H8|Cantera CO|Cantera CO2|Cantera H2O,bo|ko|ro|go|mo,0,100000,,0,100000,-1.00E+09,1.00E+09,0,Species/reactionrate_arrhenius_jones_lindstedt_devc.csv,2,3,Time,O2|C3H8|CO|CO2|H2O,FDS RK O2|FDS RK C3H8|FDS RK CO|FDS RK CO2|FDS RK H2O,b|k|r|g|m,0,100000,,0,100000,-1.00E+09,1.00E+09,0,Species Mass Fraction (Jones-Lindstedt),Time (s),Mass Fraction,0,4,1,0,0.25,1,no,0.05 0.90,EastOutside,,1.365,linear,FDS_Verification_Guide/SCRIPT_FIGURES/reactionrate_jones_lindstedt_species,Absolute Error,end,1.00E-02,Species,mx,m,TeX
d,reactionrate_arrhenius_jones_lindstedt,Species/reactionrate_arrhenius_jones_lindstedt_git.txt,Species/reactionrate_arrhenius_jones_lindstedt_soln.csv,1,2,Time,Temperature,Cantera Temperature,bo,0,100000,,0,100000,-1.00E+09,1.00E+09,0,Species/reactionrate_arrhenius_jones_lindstedt_devc.csv,2,3,Time,TEMP,FDS RK Temperature,b,0,100000,,0,100000,-1.00E+09,1.00E+09,0,Temperature (Jones-Lindstedt),Time (s),Temperature (°C),0,4,1,0,3500,1,no,0.05 0.90,SouthEast,,1,linear,FDS_Verification_Guide/SCRIPT_FIGURES/reactionrate_jones_lindstedt_temperature,Relative Error,end,1.00E-02,Species,mx,m,TeX
Expand All @@ -549,7 +549,7 @@ d,reactionrate_arrhenius_2order_1step_cvode,Species/reactionrate_arrhenius_2orde
d,reactionrate_arrhenius_1p75order_2step_cvode,Species/reactionrate_arrhenius_1p75order_2step_cvode_git.txt,Species/reactionrate_arrhenius_1p75order_2step_soln.csv,1,2,Time,O2|C3H8|CO|CO2|H2O,Cantera O2|Cantera C3H8|Cantera CO|Cantera CO2|Cantera H2O,bo|ko|ro|go|mo,0,100000,,0,100000,-1.00E+09,1.00E+09,0,Species/reactionrate_arrhenius_1p75order_2step_cvode_devc.csv,2,3,Time,O2|C3H8|CO|CO2|H2O,FDS CVODE O2|FDS CVODE C3H8|FDS CVODE CO|FDS CVODE CO2|FDS CVODE H2O,b|k|r|g|m,0,100000,,0,100000,-1.00E+09,1.00E+09,0,Species Mass Fraction (Arrhenius 1.75 Order),Time (s),Mass Fraction,0,10,1,0,0.3,1,no,0.02 0.90,EastOutside,,1.365,linear,FDS_Verification_Guide/SCRIPT_FIGURES/reactionrate_arrhenius_1p75order_2step_cvode,Absolute Error,end,1.00E-02,Species,mx,m,TeX
d,reactionrate_arrhenius_1p75order_2stepr_cvode,Species/reactionrate_arrhenius_1p75order_2stepr_cvode_git.txt,Species/reactionrate_arrhenius_1p75order_2stepr_soln.csv,1,2,Time,O2|C3H8|CO|CO2|H2O,Cantera O2|Cantera C3H8|Cantera CO|Cantera CO2|Cantera H2O,bo|ko|ro|go|mo,0,100000,,0,100000,-1.00E+09,1.00E+09,0,Species/reactionrate_arrhenius_1p75order_2stepr_cvode_devc.csv,2,3,Time,O2|C3H8|CO|CO2|H2O,FDS CVODE O2|FDS CVODE C3H8|FDS CVODE CO|FDS CVODE CO2|FDS CVODE H2O,b|k|r|g|m,0,100000,,0,100000,-1.00E+09,1.00E+09,0,Species Mass Fraction (Arrhenius 1.75 Order),Time (s),Mass Fraction,0,10,1,0,0.3,1,no,0.02 0.90,EastOutside,,1.365,linear,FDS_Verification_Guide/SCRIPT_FIGURES/reactionrate_arrhenius_1p75order_2stepr_cvode,Absolute Error,end,1.00E-02,Species,mx,m,TeX
d,reactionrate_arrhenius_equilibrium_cvode,Species/reactionrate_arrhenius_equilibrium_cvode_git.txt,Species/reactionrate_arrhenius_equilibrium_soln.csv,1,2,Time,O2|C3H8|CO|CO2|H2O,Cantera O2|Cantera C3H8|Cantera CO|Cantera CO2|Cantera H2O,bo|ko|ro|go|mo,0,100000,,0,100000,-1.00E+09,1.00E+09,0,Species/reactionrate_arrhenius_equilibrium_cvode_devc.csv,2,3,Time,O2|C3H8|CO|CO2|H2O,FDS CVODE O2|FDS CVODE C3H8|FDS CVODE CO|FDS CVODE CO2|FDS CVODE H2O,b|k|r|g|m,0,100000,,0,100000,-1.00E+09,1.00E+09,0,Species Mass Fraction (Equilibrium),Time (s),Mass Fraction,0,4,1,0,0.25,1,no,0.05 0.90,EastOutside,,1.365,linear,FDS_Verification_Guide/SCRIPT_FIGURES/reactionrate_equilibrium_species_cvode,Absolute Error,end,1.00E-02,Species,mx,m,TeX
d,reactionrate_arrhenius_equilibrium_cvode,Species/reactionrate_arrhenius_equilibrium_cvode_git.txt,Species/reactionrate_arrhenius_equilibrium_soln.csv,1,2,Time,Temperature,Cantera Temperature,bo,0,100000,,0,100000,-1.00E+09,1.00E+09,0,Species/reactionrate_arrhenius_equilibrium_cvode_devc.csv,2,3,Time,TEMP,FDS CVODE Temperature,b,0,100000,,0,100000,-1.00E+09,1.00E+09,0,Temperature (Equilibrium),Time (s),Temperature (°C),0,4,1,0,3500,1,no,0.05 0.90,SouthEast,,1,linear,FDS_Verification_Guide/SCRIPT_FIGURES/reactionrate_equilibrium_temperature_cvode,Relative Error,end,1.00E-02,Species,mx,m,TeX
d,reactionrate_arrhenius_equilibrium_cvode,Species/reactionrate_arrhenius_equilibrium_cvode_git.txt,Species/reactionrate_arrhenius_equilibrium_soln.csv,1,2,Time,Temperature,Cantera Temperature,bo,0,100000,,0,100000,-1.00E+09,1.00E+09,0,Species/reactionrate_arrhenius_equilibrium_cvode_devc.csv,2,3,Time,TEMP,FDS CVODE Temperature,b,0,100000,,0,100000,-1.00E+09,1.00E+09,0,Temperature (Equilibrium),Time (s),Temperature (°C),0,4,1,0,3500,1,no,0.05 0.90,SouthEast,,1,linear,FDS_Verification_Guide/SCRIPT_FIGURES/reactionrate_equilibrium_temperature_cvode,Relative Error,end,2.00E-02,Species,mx,m,TeX
d,reactionrate_arrhenius_equilibrium_cvode,Species/reactionrate_arrhenius_equilibrium_cvode_git.txt,Species/reactionrate_arrhenius_equilibrium_soln.csv,1,2,Time,Pressure,Cantera Pressure,bo,0,100000,,0,100000,-1.00E+09,1.00E+09,0,Species/reactionrate_arrhenius_equilibrium_cvode_devc.csv,2,3,Time,PRES,FDS CVODE Pressure,b,0,100000,,0,100000,-1.00E+09,1.00E+09,0,Pressure (Equilibrium),Time (s),Pressure (Pa),0,4,1,0,500000,1,no,0.05 0.90,SouthEast,,1,linear,FDS_Verification_Guide/SCRIPT_FIGURES/reactionrate_equilibrium_pressure_cvode,Relative Error,end,2.00E-02,Species,mx,m,TeX
d,reactionrate_arrhenius_jones_lindstedt_cvode,Species/reactionrate_arrhenius_jones_lindstedt_cvode_git.txt,Species/reactionrate_arrhenius_jones_lindstedt_soln.csv,1,2,Time,O2|C3H8|CO|CO2|H2O,Cantera O2|Cantera C3H8|Cantera CO|Cantera CO2|Cantera H2O,bo|ko|ro|go|mo,0,100000,,0,100000,-1.00E+09,1.00E+09,0,Species/reactionrate_arrhenius_jones_lindstedt_cvode_devc.csv,2,3,Time,O2|C3H8|CO|CO2|H2O,FDS CVODE O2|FDS CVODE C3H8|FDS CVODE CO|FDS CVODE CO2|FDS CVODE H2O,b|k|r|g|m,0,100000,,0,100000,-1.00E+09,1.00E+09,0,Species Mass Fraction (Jones-Lindstedt),Time (s),Mass Fraction,0,4,1,0,0.25,1,no,0.05 0.90,EastOutside,,1.365,linear,FDS_Verification_Guide/SCRIPT_FIGURES/reactionrate_jones_lindstedt_species_cvode,Absolute Error,end,1.00E-02,Species,mx,m,TeX
d,reactionrate_arrhenius_jones_lindstedt_cvode,Species/reactionrate_arrhenius_jones_lindstedt_cvode_git.txt,Species/reactionrate_arrhenius_jones_lindstedt_soln.csv,1,2,Time,Temperature,Cantera Temperature,bo,0,100000,,0,100000,-1.00E+09,1.00E+09,0,Species/reactionrate_arrhenius_jones_lindstedt_cvode_devc.csv,2,3,Time,TEMP,FDS CVODE Temperature,b,0,100000,,0,100000,-1.00E+09,1.00E+09,0,Temperature (Jones-Lindstedt),Time (s),Temperature (°C),0,4,1,0,3500,1,no,0.05 0.90,SouthEast,,1,linear,FDS_Verification_Guide/SCRIPT_FIGURES/reactionrate_jones_lindstedt_temperature_cvode,Relative Error,end,1.00E-02,Species,mx,m,TeX
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