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October 2, 2012, 13:31 |
Modeling Chemistry
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#1 |
New Member
Vikram Reddy
Join Date: Jun 2012
Posts: 13
Rep Power: 13 |
Hello CFX users, I have a multi-step reaction which looks like the following
A<=>B+C , k1=forward rate;k-1=backward rate B->D+3C, k2=forward reaction rate (irreversible) B is an intermediate and d[B]/dt=0; so -d[A]/dt= k1[A]/(1+k-1/k2[C]) and we have similar equations for C and D I have information only about k1 and (k-1/k2) and not k-1 and k2 individually. In theory this is enough to predict the reaction rates of A,C and D. How do I model this in CFX? Thanks in advance, Vikram |
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