DISPLAY This simple case demonstrates the effects of thermal diffusion on a single light species, H2, diffusing in a heavy carrier species, N2. A source of H2 is placed near the outlet, and N2 flows in at the opposite end. Thermal (Soret) diffusion is the diffusion of species due to temperature gradients, and the model used here makes the light species diffuse more rapidly towards colder surfaces. ENDDISPLAY GROUP 1. Run title and other preliminaries TEXT(C208: 1DZ Thermal Diffusion Test TITLE GROUP 5. Z-direction grid specification GRDPWR(Z,10,1.,1.) GROUP 7. Variables stored, solved & named SOLVE(P1,W1,C1,C2) SOLUTN(P1,P,P,Y,P,P,P);SOLUTN(C1,P,P,Y,P,P,P) STORE(TEM1,DEN1) GROUP 9. Properties of the medium (or media) PRNDTL(C1)=-GRND9;PRNDTL(C2)=-GRND9 GROUP 11. Initialization of variable or porosity fields TEMP0=300. INIADD=F;INIFLD=T FIINIT(C1)=0.5; FIINIT(C2)=0.5 ** Specify negative temperature gradient REAL(TAT1,TATNY);TAT1=0.;TATNY=TAT1-100. PATCH(WHOLE,LINVLZ,1,NX,1,NY,1,NZ,1,LSTEP) INIT(WHOLE,TEM1,TATNY-TAT1,TAT1) INIT(WHOLE,C1,0.2,0.4) GROUP 13. Boundary conditions and special sources ** Injection of H2 in the outlet cell PATCH(H2SO,CELL,1,NX,1,NY,NZ,NZ,1,LSTEP) COVAL(H2SO,C1,FIXFLU,1.E-1) ** Inflow of pure N2 at west boundary INLET(IN1,LOW,1,NX,1,NY,1,1,1,LSTEP) VALUE(IN1,P1,1.); VALUE(IN1,W1,1.) ** Outflow of N2 and H2 OUTLET(OUT1,HIGH,1,NX,1,NY,NZ,NZ,1,LSTEP) GROUP 15. Termination of sweeps RELAX(C1,FALSDT,10.0) VARMIN(C1)=1.E-10;VARMIN(C2)=1.E-10 RESREF(C1)=RESREF(C1)/100 LSWEEP=50 GROUP 19. Data communicated by satellite to GROUND Activate the CHEMKIN Interface LSG61=T Set the CHEMKIN input file names CSG4='tdif' Set the reference pressure in atmospheres CHSOC=1. ** Activate "mixture-averaged" species-diffusion model ENULA=GRND9 ** Activate species thermal-diffusion model ENULB=GRND9 GROUP 21. Print-out of variables NXPRIN=1;NYPRIN=1;NZPRIN=1 GROUP 22. Spot-value print-out IZMON=5;ITABL=3 GROUP 24. Dumps for restarts Indicate that the temperaure should not be constant CHKIBEGIN CONTEM F CHKIEND TSTSWP=-1 DISTIL=T EX(P1)=1.000E-03;EX(W1)=1.000E+00;EX(C1)=3.252E-02 EX(C2)=9.675E-01;EX(DEN1)=1.000E+00;EX(TEM1)=4.500E+01