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    Aa + BB +CC+DD RR A+ (B/a) B + (C/a) C + (D/a) D (R/a) R R - KC C C C N N (1-X) N N - (B/a) (N - N) N N - (C/a) (N - N) N N - (D/a) (N - N) C N /V

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    Chemical Engineering
    The document describes equations for modeling a constant-volume batch reactor. It provides the chemical reaction equation, rate equation, equations for calculating component concentrations over time based on stoichiometry, and equations for determining conversion and reaction time as a function of the initial amounts of reactants. Input parameters for an example are given and results of calculations tracking component concentrations and conversion over time are shown.

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    Aa + BB +CC+DD RR A+ (B/a) B + (C/a) C + (D/a) D (R/a) R R - KC C C C N N (1-X) N N - (B/a) (N - N) N N - (C/a) (N - N) N N - (D/a) (N - N) C N /V

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    Chemical Engineering
    37 views7 pages
    The document describes equations for modeling a constant-volume batch reactor. It provides the chemical reaction equation, rate equation, equations for calculating component concentrations over time based on stoichiometry, and equations for determining conversion and reaction time as a function of the initial amounts of reactants. Input parameters for an example are given and results of calculations tracking component concentrations and conversion over time are shown.

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    Original Title

    Batch Reactor

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    The document describes equations for modeling a constant-volume batch reactor. It provides the chemical reaction equation, rate equation, equations for calculating component concentrations over time based on stoichiometry, and equations for determining conversion and reaction time as a function of the initial amounts of reactants. Input parameters for an example are given and results of calculations tracking component concentrations and conversion over time are shown.

    Copyright:

    © All Rights Reserved
    Download as XLS, PDF, TXT or read online from Scribd
    Download as xls, pdf, or txt
    37 views7 pages

    Aa + BB +CC+DD RR A+ (B/a) B + (C/a) C + (D/a) D (R/a) R R - KC C C C N N (1-X) N N - (B/a) (N - N) N N - (C/a) (N - N) N N - (D/a) (N - N) C N /V

    Uploaded by

    Chemical Engineering
    The document describes equations for modeling a constant-volume batch reactor. It provides the chemical reaction equation, rate equation, equations for calculating component concentrations over time based on stoichiometry, and equations for determining conversion and reaction time as a function of the initial amounts of reactants. Input parameters for an example are given and results of calculations tracking component concentrations and conversion over time are shown.

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    © All Rights Reserved
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    of 7

    Constant-Volume Batch Reactor

    Equations

    aA + bB +cC+dD=rR Chemical Reaction Notation


    A+(b/a)B +(c/a)C +(d/a)D=(r/a)R
    r=-kCACB(b/a)CC(c/a)CD(d/a) Rate Equation X - Conversion
    NA=NAo*(1-XA) By definition of conversion C - Concentration (moles/L)
    NB,i=NB,(i-1) - (b/a) (NA,(i-1)-NA,i) Based on Stoichiometry N - Number of Moles
    NC,i=NC,(i-1) - (c/a) (NA,(i-1)-NA,i) Based on Stoichiometry K - Rate Constant (units vary)
    a,b,c,d - coeffients of chemical
    ND,i=ND,(i-1) - (d/a) (NA,(i-1)-NA,i) Based on Stoichiometry equation
    Cj = Nj/V j=A, B, C, D Concentration for each component A,B,C,D- Chemical Components
    x
    N A0 dx
    t= ∫
    V 0 −r n - total number of steps

    Input data h - step interval


    V= 2500 Liter reactor volume i - step index
    NAo= 90 gmole initial moles of A j - constituent index
    NBo= 250 gmole initial moles of B
    NCo= 500 gmole initial moles of C
    NDo= 150 gmole initial moles of D
    NC= 4 number of chemical constituents (1, 2, 3, or 4)
    XAf 0.9 Final conversion Specification
    n 18 Number of steps
    a= 1
    b= 2
    c= 4
    d= 1
    k= 350000 units vary
    h= 0.05 step interval

    Calculations
    XA NAo CA NBo CB NCo CC NDo CD r Nao/(-rAV)
    gmole A/(sec-
    (Moles) (moles/L) (Moles) (moles/L) (Moles) (moles/L) (Moles) (moles/L) L)

    0 90 0.036 250 0.100 500 0.200 150 0.060 -1.210E-02 2.97619


    0.05 85.5 0.034 241 0.096 482 0.193 145.5 0.058 -8.945E-03 4.024419
    0.1 81 0.032 232 0.093 464 0.186 141 0.056 -6.536E-03 5.508109
    0.15 76.5 0.031 223 0.089 446 0.178 136.5 0.055 -4.713E-03 7.638556
    0.2 72 0.029 214 0.086 428 0.171 132 0.053 -3.350E-03 10.74597
    0.25 67.5 0.027 205 0.082 410 0.164 127.5 0.051 -2.344E-03 15.35668
    0.3 63 0.025 196 0.078 392 0.157 123 0.049 -1.612E-03 22.32814
    0.35 58.5 0.023 187 0.075 374 0.150 118.5 0.047 -1.088E-03 33.09106
    0.4 54 0.022 178 0.071 356 0.142 114 0.046 -7.186E-04 50.09748
    0.45 49.5 0.020 169 0.068 338 0.135 109.5 0.044 -4.635E-04 77.67746
    0.5 45 0.018 160 0.064 320 0.128 105 0.042 -2.909E-04 123.7408
    0.55 40.5 0.016 151 0.060 302 0.121 100.5 0.040 -1.771E-04 203.3067
    0.6 36 0.014 142 0.057 284 0.114 96 0.038 -1.040E-04 346.2029
    0.65 31.5 0.013 133 0.053 266 0.106 91.5 0.037 -5.855E-05 614.8838
    0.7 27 0.011 124 0.050 248 0.099 87 0.035 -3.134E-05 1148.739
    0.75 22.5 0.009 115 0.046 230 0.092 82.5 0.033 -1.576E-05 2284.605
    0.8 18 0.007 106 0.042 212 0.085 78 0.031 -7.309E-06 4925.295
    0.85 13.5 0.005 97 0.039 194 0.078 73.5 0.029 -3.033E-06 11868.15
    0.9 9 0.004 88 0.035 176 0.070 69 0.028 -1.058E-06 34013.15

    Total Time (seconds) =


    Time (minutes) =
    Conversion

    Batch Reactor Converion


    1
    0.9
    0.8
    0.7
    0.6
    0.5
    0.4
    0.3
    0.2
    0.1
    0
    0.10 1.00 10.00 100.00 1000.00 10000.00

    Time (sec)
    Note: To change the number of chemical constituents, alter variable NC. The concentrations will be automatically set to 1.0, which cause
    the reaction rate to be uneffected by the component (multiplication by 1.0 to a power in the rate eq.).
    t

    (sec)

    0.41

    0.78

    1.58

    3.41

    8.08

    21.39

    65.91

    253.54

    1440.18

    1795
    29.92
    o 1.0, which cause

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