Page 156 - Modeling of Chemical Kinetics and Reactor Design
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126    Modeling of Chemical Kinetics and Reactor Design


                                 − ( r A )=  −dC A  = kC C B                             (3-59)
                                                  A
                                         dt
                                From stoichiometry:

                                                                      A                  B
                              Amount at time t = 0                   C AO               C BO
                              Amount at time t = t                   C                   C
                                                                       A                  B
                              Amounts that have reacted           (C AO  –C )          C BO  –C B
                                                                         A
                              and from stoichiometry (C   – C ) = 2(C    – C ).
                                                       AO    A        BO    B
                                Expressing the concentration of B in terms of A and the original
                              amounts C   , C   gives
                                        AO   BO

                                 C =  C BO  −  1  C (  AO − C )                          (3-60)
                                  B
                                                     A
                                           2
                                Substituting Equation 3-60 into Equation 3-59 gives

                                 C A          −dC              t
                                                               ∫
                                  ∫               A          = dt
                                                           
                                               1
                                    kC       − (C    − C  )  0                         (3-61)
                                         C
                                 C AO  A   BO      AO    A
                                              2           
                                  C A                              t
                                                                   ∫
                                 −  ∫           dC A           = kdt
                                                 1
                                                         1
                                      C      − C      + C      0                     (3-62)
                                          
                                  C AO  A  C BO    AO      A 
                                                2       2    
                                Taking the partial fractions of Equation 3-62 with  α = [C BO   –
                              (1/2)C AO ] gives the following:
                                       1        ≡  p  +    q
                                       1        C        1                             (3-63)
                                 C  α +  C        A   α +  C A
                                       2                 2
                                           A
                                  A
                                    
                                         1
                                1≡ p α + C     + qC                                     (3-64)
                                        2  A      A
                                Solving for constants p and q involves equating the “constant” and
                              the coefficient of “C ” in Equation 3-64:
                                                 A
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