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Homework- #7
Prepared By:-
Faisal Mumtaz: 20101361
Ashwin Murali: 20105451
Date of Submission: 12/05/2013
Submitted to: Dr. Shaker Haji
4.25] POLYMATH code:
d(FA)/d(V) = rA - RA
FA(0) = 100
d(FB)/d(V) = rB - RB
FB(0) = 0
d(FC)/d(V) = rC
FC(0) = 0
rA = -k * (CA - ((CB * (CC ^ 2)) / KC))
rB = -rA
rC = -2 * rA
CA = CT0 * (FA / FT)
CB = CT0 * (FB / FT)
CC = CT0 * (FC / FT)
FT = FA + FB + FC
CA0 = FA0 / v0
CT0 = CA0
FA0 = 100
v0 = 100
RA = kCA * CA
RB = kCB * CB
kCA = 1
kCB = 40
k = 10
KC = 0.01
xA = (FA0 - FA) / FA0
V(0) = 0
V(f) = 20
Differential equations
1 d(FA)/d(V) = rA - RA
2 d(FB)/d(V) = rB - RB
3 d(FC)/d(V) = rC
Explicit equations
1 KC = 0.01
2 v0 = 100
3 k = 10
4 FA0 = 100
5 CA0 = FA0 / v0
6 CT0 = CA0
7 FT = FA + FB + FC
8 CC = CT0 * (FC / FT)
9 CA = CT0 * (FA / FT)
10 CB = CT0 * (FB / FT)
11 rA = -k * (CA - ((CB * (CC ^ 2)) / KC))
12 kCA = 1
13 kCB = 40
14 RA = kCA * CA
15 RB = kCB * CB
16 rB = -rA
17 rC = -2 * rA
18 xA = (FA0 - FA) / FA0
a.) Plot of flow rates (FA, FB & FC) versus reactor volume (V)
Plot of flow rates (RA & RB) versus reactor volume (V)
b.) POLYMATH code:
Differential equations
1 d(x)/d(V) = -rA / FA0
Explicit equations
1 KC = 0.01
2 FA0 = 100
3 v0 = 100
4 CA0 = FA0 / v0
5 CA = CA0 * (1 - x)
6 CB = CA0 * x
7 CC = CA0 * 2 * x
8 k = 10
9 rA = -k * (CA - ((CB * (CC ^ 2)) / KC))
For IMRCF:
For PFR:
For imrcf, no products are diffused out of the membrane, so total conversion
remains low, the membrane does not participate in the reaction directly; it
simply acts as a barrier to the reactants and some products. Where as the pfr
achieves higher conversion
d(FA)/d(V) = rA - RA
FA(0) = 100
d(FB)/d(V) = rB
FB(0) = 0
d(FC)/d(V) = rC - RC
FC(0) = 0
rA = -k * (CA - ((CB * (CC ^ 2)) / KC))
rB = -rA
rC = -2 * rA
CA = CT0 * (FA / FT)
CB = CT0 * (FB / FT)
CC = CT0 * (FC / FT)
FT = FA + FB + FC
CA0 = FA0 / v0
CT0 = CA0
FA0 = 100
v0 = 100
RA = kCA * CA
RC = kCC * CC
kCA = 1
kCC = 80
k = 10
KC = 0.01
xA = (FA0 - FA) / FA0
V(0) = 0
V(f) = 20
Differential equations
1 d(FA)/d(V) = rA - RA
2 d(FB)/d(V) = rB
3 d(FC)/d(V) = rC - RC
Explicit equations
1 KC = 0.01
2 v0 = 100
3 k = 10
4 FA0 = 100
5 CA0 = FA0 / v0
6 CT0 = CA0
7 FT = FA + FB + FC
8 CC = CT0 * (FC / FT)
9 CA = CT0 * (FA / FT)
10 CB = CT0 * (FB / FT)
11 rA = -k * (CA - ((CB * (CC ^ 2)) / KC))
12 kCA = 1
13 kCC = 40
14 RA = kCA * CA
15 RC = kCC * CC
16 rB = -rA
17 rC = -2 * rA
18 xA = (FA0 - FA) / FA0
POLYMATH code:
POLYMATH Report
Ordinary Differential Equations 10-May-2013
Calculated values of DEQ variables
Variable Initial value Minimal value Maximal value Final value
1 CA 0.2 0.0909091 0.2 0.0909091
2 CA0 0.2 0.2 0.2 0.2
3 CB 0.2 0.0909091 0.2 0.0909091
4 CC 0 0 0.1090909 0.1090909
5 CD 0 0 0.1090909 0.1090909
6 FA0 2. 2. 2. 2.
7 k 1.37 1.37 1.37 1.37
8 Ke 1.44 1.44 1.44 1.44
9 rA -0.0548 -0.0548 -1.188E-17 -1.188E-17
10 V 0 0 1000. 1000.
11 v0 10. 10. 10. 10.
12 x 0 0 0.5454545 0.5454545
Differential equations
1 d(x)/d(V) = -rA / FA0
Explicit equations
1 v0 = 10
2 CA0 = 0.2
3 CD = CA0 * x
4 CA = CA0 * (1 - x)
5 CB = CA0 * (1 - x)
6 CC = CA0 * x
7 FA0 = CA0 * v0
8 k = 1.37
9 Ke = 1.44
10 rA = -k * (CA * CB - ((CC * CD) / Ke))
Finally, by using the table we found that the volume of PFR is 40.45 dm3at x =
0.464.
Explicit equations
1 Ke = 1.44
2 CA0 = 0.2
3 FT = FA + FB + FC + FD
4 k = 1.37
5 CT0 = 0.4
6 CC = CT0 * (FC / FT)
7 CD = CT0 * (FD / FT)
8 CA = CT0 * (FA / FT)
9 CB = CT0 * (FB / FT)
10 rA = -k * (CA * CB - ((CC * CD) / Ke))
11 rB = rA
12 v0 = 10
13 kD = 0.1
14 RD = kD * CD
15 rC = -rA
16 rD = rC
17 FA0 = CA0 * v0
18 xA = (FA0 - FA) / FA0
Finally, by using the table we found that the volume of membrane reactor is
38.47 dm3at x = 0.464. Also, by using membrane reactor we can reach x = 0.85
and the volume require to achieve it is 432.63 dm3. So, by doubling the feed
rate in membrane reactor FA0=FB0= 4 instead of 2 before, so u end up with
0.458 as conversion after changing FA0 and FB0 values in polymath.
Plot of flow rates (FA, FB, FC and FD) versus membrane reactor volume (V)
Plot of Concentrations (CA, CB, CC and CD) versus membrane reactor volume
(V)