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Problem: Design of a Chemical Reaction Network

Ref: S.H. Choi, J.W. Ko and V. Manousiouthakis


A stochastic approach to global optimization of chemical processes
Comp. Chem. Eng. , 1351-1356 (1999).

Solved by:
Spreadsheets in Chemical Engineering Education – a tool in process design and process integration
Eugénio C. Ferreira, R. Lima and R. Salcedo (Int. J. Engineering Education , 20:6, 928-938, 2004)

k1 k3
A→B→C

F3 https://d
F1
V1 F7 F5

F0 F9

F8
https:
F2 F4 F6

V2
k2 k4
A→B→C

Parameters
k_1 k_2 k_3 k_4 F_0 F_9 C_A0 C_B0
0.09755988 0.09658428 0.0391908 0.03527172 1 1 1 0

Inequality constraint Variables


Initial Optimal
V10.5+V20.5 ≤ 4
point solution
4.00000 0<= F_1 0.000000 <=1 1
0<= F_2 1.000000 <=1 0
Equality constraints 0<= F_3 0.000000 <=1 1
Eq1 0 0<= F_4 1.000000 <=1 1
Eq2 0 0<= F_5 0.000000 <=1 0
Eq3 0 0<= F_6 1.000000 <=1 1
Eq4 0 0<= F_7 0.000000 <=1 1
Eq5 0 0<= F_8 0.000000 <=1 0
Eq6 0 0<= C_A3 0.163165 <=1 1
Eq7 0 0<= C_B3 0.000000 <=1 0
Eq8 0 0<= C_A4 1.000000 <=1 0.771509
Eq9 0 0<= C_B4 0.000000 <=1 0.204197
Eq10 0 0<= C_A5 0.000000 <=1 0.771509
Eq11 0 0<= C_B5 0.000000 <=1 0.204197
Eq12 0 0<= C_A6 0.392910 <=1 0.516993
Eq13 0 0<= C_B6 0.388100 <=1 0.388811
0<= V_1 0.000000 <=16 3.035684
FOBJ 3.88100E-01 0<= V_2 ######## <=16 5.097112

Exception handling
Equations Expression Flags
Ineq. V_1 0
constraint V_2 0
0
Link

https://drive.google.com/file/d/1trkeFwfwE-du_fGuuHwTDBKRzPQeVleN/view

Excelent File
https://sites.google.com/view/processdesignandsimulation/home
N/view

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