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    Comput ers & Chemi cal Engineeri ng,Vol. IO, No. 5, pp. M -515, 1986

    Printed in Great

    Britain. All rights reserved

    0098-1354/86 3.00 + 0.00

    Copyright 0 1986Pergamon Journals Ltd

    RIGOROUS SIMULATION AND DESIGN OF COLUMNS

    FOR GAS ABSORPTION AND CHEMICAL

    REACTION-II

    PLATE COLUMNS

    L. DE LEYE and G. F. FROMENT

    Laboratorium voor Petrochemische Techniek, Rijksuniversiteit, Gent, Belgium

    (Received 22 January 1985; revisi on r eceiv ed 5 Sept ember 1985;

    receiv ed for publ icat io n 20 January 1986)

    1. INTRODUCTION

    In Part I [l, this issue, pp. 4935041 of this paper the

    mathematical modelling of absorption accompanied

    by chemical reaction was developed both for simple

    and complex cases and attention was focused upon

    application to packed columns. Part II applies the

    theory to the design or simulation of plate columns.

    These are preferred to packed columns when widely

    varying loadings may be expected. Also, large values

    of the mass-transfer coefficients and large interfacial

    areas can be achieved in traycolumns, which makes

    them appropriate not only for the fast reactions

    encountered in gas treating, but also, given the high

    liquid hold-up, for the slow reactions encountered in

    chemical-producing processes.

    2. MATHEMATICALMODELLING

    The various flows and compositions of the gas and

    liquid in the column and on a typical plate are shown

    in Fig. 1. Gas and liquid feed or withdrawal on a

    plate are also included. The components in the liquid

    phase are numbered in the following order: com-

    ponents undergoing absorption and reaction, phys-

    ically absorbed components, liquid-phase reactants,

    reaction products involved in further reactions, final

    reaction products and inert liquid-phase components.

    When the total number of plates, the compositions,

    flow rates, temperatures and pressures of the gas and

    liquid feed streams and the flow rates of intermediate

    gas or liquid withdrawals are given, the flow rates,

    compositions, temperatures and pressures on each

    plate have to be calculated. This is the simulation

    problem. In the design mode the number of plates

    required to achieve a specified absorption has to be

    determined. This requires a number of iterations in

    the column calculation.

    In the model to be described, the gas is assumed to

    be in plug flow, while the liquid on the plates is

    completely mixed. Non-isothermal and non-isobaric

    operation are considered. The equations below are

    written for a fairly general example involving simulta-

    neous absorption and parallel reactions (Type 1A).

    The variation of, the mole fractions of the absorbing

    components in the gas phase and of the total gas flow

    rate on plate k are given by

    F

    dy i

    l- yj p E?

    di

    I= N j l y=O

    (1)

    = -Njly=i AtR*

    forj=l,...,nA,

    and

    (2)

    while for non-absorbing components,

    FYI constant for j = nA + 1, . . . , n,.

    (3)

    The boundary conditions are

    for 2 = O,yj=yjpk

    F=@

    and

    I

    forj=l,...,no. (4)

    for 2 = h, y,= yj,k

    F = Fk

    Pf and yFk are the gas flow rate and the mole

    fractions in the gas entering the plate. These are

    related to the quantities leaving the plate k + 1 in the

    following way, accounting for side streams:

    and

    forj=l,...,no. (6)

    The equations for the flow rate and composition of

    the liquid are derived, by way of example, for the

    parallel reactions (33) and (34) (Type 1A) of Part I

    [l]. Since the various reactions probably have

    505

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    506

    L. DE LEVEand G. F. FROMENT

    X

    ;j= 1 ..

    .f-JL

    6

    1

    -La

    Y

    ;j=l,...,nG

    X

    , .;j

    , , n

    L

    k-7; ,@,I,

    F T

    k+lk+l

    Gas

    Liquid

    Fig. 1. Flows and compositions in the column and on a plate.

    different reaction rates, the xj,k depend upon the

    for the remaining absorbed components,

    appropriate Hatta number.

    For the absorbed components undergoing a very

    fast reaction (appropriate Hatta number > 3),

    (7)

    ik=O forj=l,...,nv;

    for those involved in a moderately fast reaction

    (appropriate Hatta number between 0.3 and 3),

    forj=n,+l,...,n,. (10)

    X/k(L+

    Ww~)=xj,k-,L;_,

    +xw,,k

    WV,

    +NjIy-.vL

    A:Rh, - aj,jrj(l - A,y,)Rh,c,

    The mole fractions of reactants, reaction products

    =x,~k_,L;_,+xw,,kwk T f Q

    I- I

    a/,/

    and inerts in the liquid on the plate are given by

    X,,.k(G + WW,)

    forj=n,+l,...,n,+n,; (8)

    x

    {(@Y - F,Y,,,) -

    [x,Ow~ + 4)

    for the absorbed components undergoing a very slow

    reaction (Ha c 0.3)

    -(G-I%-, + W,XW,,,)l~

    forj=n,+l,...

    ,+,+nR+nP (11)

    and

    +y~kkFl~-Yj,kFk-Uj, jrj(l -A$,)Rh,C,

    Xj,k L;+ WWt)=Xj,k-IL;-I+X~,.~Wv~

    forj=nv+n,+l,...,n,+nM+n,; (9)

    forj=n,+n,+n,+l,...,n,. (12)

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    Simulation of absorption and reaction in columns-II

    507

    The minus sign in equation (11) applies to the

    reactants, the plus sign to the reaction products.

    The absorption fluxes of the different components

    are determined from

    ~jl,=,=kG,j Pt)k[Yj-H~ Xj.k)il

    forj=l,...,nA, (13)

    and from the application of Ficks law for diffusion:

    du,

    NjIy=o=

    -

    Djckdy=o

    forj=l,...,n, (14)

    and

    N J = = -

    Dj Ck

    dY

    YL

    forj=n,+l,...,n,. (15)

    For the determination of these fluxes, the concen-

    tration profiles of the absorbed components, under-

    going fast reactions in the liquid film, have to be

    computed from the following set of second-order

    differential equations:

    Djdzx=%r.

    or

    j=

    I,...

    dy2 C, *

    ,nv+n,; (16)

    and for the liquid-phase reactant participating in the

    fast reactions,

    Da+rFr,

    /=I k

    with boundary conditions

    at

    y=o

    dx,=

    Njly=o

    dy

    -- forj=l,...,nv+n,

    DjCk

    dxa

    - = 0 for the liquid-phase reactant

    dy

    ticipating in the fast reactions

    andat y=y,,

    xj = 0 forj=l,...,nv

    xj=xik forj=nv+l,...,nv+n,

    xa = x, k for the liquid-phase reactant

    ticipating in the fast reactions.

    par-

    (17)

    par-

    When the kinetic expressions of the nv very fast

    and nM moderately fast reactions have the following

    simple forms:

    rj = kjC_?lC~R

    for j = 1,

    . . . , nv

    (18)

    and

    rj =

    kjC,CtR

    for j = nv + 1, . . . , n, +

    nM,

    (19)

    the interfacial fluxes of the absorbed components that

    undergo the fast reactions, obtained through the

    approximate solutions of Onda et al. [2],

    Njly-0 =

    fi

    1

    Hi

    tanh (Ha;)

    ~ -

    ko.j(Pt)k + kL,j(Pt)k

    Hay

    forj=l,...,nv, (20)

    are not necessarily computed from the integrated

    equations (16) and (17), but may also be obtained

    through

    HjXj,k

    Njly-o= 1

    -

    cash (Ha;)

    Hj

    tanh(Ha;)

    ko,jG,)k + kL.j(Jt)k

    HaJ

    forj=n,+l,...,nv+n,

    and

    Njly-yL=

    Ha ,k ,c xj,k>i-xj,kcosh Ha~)

    I

    LJ k

    sinh (Ha;)

    forj=nv+l,...,nv+n,

    with

    HI = Hi(Pth

    I

    ck

    and provided that Ha; is expressed by

    (21)

    (22)

    Haj =

    mj,,y+aj, k,C - I (xi k)?J - (xK ,+)yDj

    kLJ

    forj=l,...,nv (23)

    and

    /

    kL.j

    for j = nv + 1, . . . , n, + nM.

    (24)

    If one or more of the fast reactions have a more

    general kinetic expression, the set of second-order

    differential equations (16) has to be solved numer-

    ically. The integration is performed by means of a

    variable-step finite-difference method for the solution

    of boundary-value problems.

    The fluxes of the remaining absorbed components,

    undergoing a very slow reaction or which are only

    physically absorbed, are given by

    Yj- HjXj*k

    Njly-o= 1

    Hj

    ko,j(Pt)k + kL,j(Pt)k

    forj=nv+n,+l,...,n,. (25)

    The temperature on a plate is determined from an

    enthalpy balance around the plate:

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    508

    L. DE LEYEand G. F. FROMENT

    G-IL;-, ? Xj,k-ICpL.,-Tk

    Fk f yj,kCpc;.j

    with

    j=l

    j=l

    Q = (-AH,b)(Ft_YFk FkJj,k)

    + (WW, + Li) 5 Xj.kCpL,

    forj=l,...,n,+ (27)

    ,=I

    t Tk+,

    [

    (Fk+\- VW,+)) 2 Yj,k+lCpG.,

    and

    j-l

    +Tvk+,l/ ,k+, j Yv,,, + I CPO., + Twt WV,

    Q~k= -AH~ )~,{ ~~Y~k-F,Yj.k)

    O L

    -[xj,k L;+ W~,)-(~;-,~,k-,

    x c xw,.kcPL.,

    j=l

    = Q: -, , Q;? - 5 Q; , (26)

    ,= I

    + WVkXW,,,I)

    forj=l,...,n,. (28)

    start

    NO

    Gas withdr.

    YES

    Estimate

    I

    ITER = 1

    k=l

    DETERM. PHYS. PROP.

    kG kL

    PLATE CHARACT.

    I

    Determine

    Haj j = 1 . . . I-IR

    YES

    NO

    Fig. 2(a)

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    Simulation of absorption and reaction in columns-11

    Equation (26) is written in the following form: 3. A COMPUTER PROGRAM, A-Tray

    509

    Tk_,A;+TkB;+Tk+,C;=D; k=l,..., N,

    The second subprogram of A-Tower, specifically

    (29)

    with A; = 0 and CN = 0, so that the coefficient matrix

    of the set of non-linear algebraic equations (29) is

    reduced to a tridiagonal matrix.

    The pressure drop on a plate depends upon the

    type of tray (sieve, bubble caps, valve, . . . , etc.).

    Correlations are available in the literature and these

    were incorporated into the program A-Tray.

    Ha .

    3'

    j = l,n

    V + M

    I

    dealing with plate columns is called A-Tray. It com-

    prises three modules: one for physical absorption,

    one for single absorption accompanied by a single

    reaction, reversible or irreversible, and one for mul-

    tiple absorption accompanied by a set of parallel or

    consecutive reactions, with kinetic regimes ranging

    from very slow to instantaneous and non-isothermal,

    non-isobaric operation. It is clear from the previous

    section that the calculations lead to the number of

    xI

    ; j = l,n

    j,k

    V + M

    I

    'k

    I

    Determine PHYS. PROP.

    Determine PHYS. PROP. 1

    kG' kL

    kG kL

    I

    Plate

    charact.

    RUKUGILL Num. Int.

    Eqs (l),(2)

    y;:k

    ; j = 1,nA

    F;

    Eq (3)

    ';:k

    ; j=n

    A

    + 1,n

    G

    Eqs (5),(6)

    Fk+l

    'i,k+l'

    j = l,nG

    Combin.

    Eqs (11),(12)

    _ *

    L'k

    Eqs (11),(12)

    'j,k'

    j = nA t l,nL

    Eqs (8),(9),(10)

    'j,k'

    j = *v t l,nA

    Eqs (23),(24)

    Ha :

    3'

    j = l.nV t nM

    Calculate Ck

    I

    Plate chat-act.

    I

    RUKUGILL Num. Int.

    Eqe (l),(2)

    y;:k

    ; J = l,n

    A

    F;

    Eq (3)

    y;;k

    ; j = nA + l,nG

    Eqs (5),(e)

    Fk+l

    yj,ktl'

    j = 1,n

    G

    Num.

    Integr.

    2ndorder

    Diff.

    eqs (16)

    xI.

    j = 1,

    J*k

    V + M

    dc.

    5-l YYL

    ; j = nv t l,nV t M

    Eqs (8),(9),(10)

    'j,k'

    j = nv t l,nA

    Calculate Ck

    d

    Fig. 2(b)

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    510

    L.

    DE LEYE nd G. F.

    FROMENT

    real-not theoretical-trays. By way of example, the

    algorithm used for the case whereby the absorption

    A tray-to-tray method is used, starting at the top

    plate of the column. The calculation of the successive

    is accompanied by Type 1A parallel reactions,

    defined in Part I [1] of this paper, is shown in Fig. 2.

    estimates of the unknown variables at the top and the

    various plates is reduced to the problem of solving a

    NO

    I

    (APt)k-+.(Pt)k; k = 1 . . . N

    M0

    c

    I

    Estimate

    Estimate

    yj,l'

    j = 1 . . . nC-1

    'j,l'

    j = 1 . . . nA

    F1

    L

    I

    TV

    ITER = ITER t 1

    I

    b

    (x. k)E

    SSQ,

    =

    Z( J9

    - (x. k)C 2

    ('j,k)E

    ) tZ(

    (Ha" .jE - (Ha .)

    -q2 t

    (

    (Ha j)E

    ('k)E - ('k)C)2

    (=k)E

    (Xi k)E -

    (Xi,k)C 2

    (x*, )E - (Xi,

    SSQ, = Z(

    ('j,k)E

    ) + Z( .lgk

    J,k)'

    ('I. )E

    )2

    + (

    (CkjE - (CkjC 2

    )

    J,k

    (=k)E

    (x. k)E

    SSQ, = Z(

    - (x. k)C 2

    ) +(

    Cc,), -

    (=k)C 2

    ('j,k)E

    ('k)E

    )

    Fig. 2(c)

    Fig. 2(a-c). Flow chart of the algorithm for the simulation of a plate column in which absorption is

    accompanied by a Type IA system of parallel reactions.

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    Simulation of absorption and reaction in columns---II

    511

    Table 1. Constructive details of the valve trays in

    the H,S-DEA column

    Property

    Active area, n (m) 0.4225

    Relative free area on plate

    0.153

    Weir length (m)

    0.872

    Weir height (m)

    0.066

    Valve thickness (m) 0.00188

    Table 3. Commuted results for the H,S-DEA absorption column

    Top

    column

    Bottom

    column

    set of non-linear algebraic equations. For this pur-

    pose the program contains Wegsteins method [3] and

    the generalized secant method [4]. The application of

    A-Tray to a couple of important industrial processes

    is illustrated in the next section.

    L (kmol/h)

    F (kmol/h)

    YHB

    xti,s

    +wx-I

    XHS-

    ;;;y

    T (R)

    A: (m2/m)

    ko, HZ (kmollm h b)

    F. ::)(mih)

    F

    LI

    2208.8

    2247.9

    161.69

    200.8

    0.13 x lo-

    0.195

    0.0

    0.134 x 10-J

    0.41 x lo-

    0.230 x IO-

    0.0

    0.173 x 10-l

    0.0

    0.173 x 10-l

    7.47

    7.590

    318.15

    321.5

    535.68

    292.45

    0.442

    0.443

    0.367

    0.387

    0.153 0.169

    0.371

    0.328

    No. of iterations: 4

    CPU time used (Data General MV 6000): 25 s

    4. EXAMPLES OF THE APPLICATION OF A-Tray

    4.1. The absorption of H2S in an aqueous di-

    ethanolami ne (DEA) solut ion

    I n this example a DEA solution is used for the

    removal of H,S from a refinery stream. The gas feed

    has an average molecular weight of 24.9 kg/kmol and

    contains 19.5 mol of Hz S. The flow rate, temperature

    and pressure of the gas feed are 200.85 kmol/h,

    318.15 K and 7.6 b, respectively. A 20 wt% DEA

    solution at a temperature of 318.15 K is used as

    solvent. Its flow rate is 2208.8 kmol/h. The column

    has a diameter of 0.98 m and is equipped with 18

    Glitsch Vl-ballast trays. The constructive details of

    the plates are summarized in Table 1.

    The solubility of H,S in the solution was taken

    from Kent and Eisenberg [8].

    The standard correlations incorporated in the pro-

    gram, which are listed in Table 2, were used for the

    determination of the mass-transfer coefficients and

    the different plate characteristics.

    The initial estimates of temperature and pressure

    on each tray were 3 18.15 K and 7.6 b. The mole

    fraction of HIS at the top of the column was esti-

    mated to be 1 x lo-, the convergence tolerance was

    set equal to 10-j. The results of the computations are

    summarized in Table 3.

    The absorption of H2S in this solution is accom-

    panied by the following overall reaction [5,6]:

    H, S + R,NH & HS- +

    RNH;

    .

    (30)

    The variations of the mole fractions of H,S in the

    gas phase, of DEA and the reaction products in the

    liquid phase and of the gas and liquid flow rates along

    the column are shown in Fig. 3.

    Figure 4 shows the computed temperature and

    pressure profiles in the column.

    This reaction is instantaneous and reversible.

    Data for the determination of the equilibrium

    constant of the reaction, K,, were taken from the

    literature [7,8].

    4.2. The simul t aneous absorpti on of H,S and CO2 i n

    an aqueous NaOH solut ion

    Densities and viscosities of the solution and

    The absorption of H2S and CO2 in an aqueous

    diffusivities of the reactants in the solution were

    NaOH solution is applied in the purification of the

    calculated out of the experimental values [9] and

    effluent resulting from the thermal cracking of naph-

    literature data [lo, 111. For the determination of the

    tha for the production of ethylene. The absorption is

    diffusivity of the H,S in water, Wilke-Changs cor-

    carried out in a plate column with two NaOH

    relation was used. This diffusivity was corrected for

    circuits, one with a concentrated and one with a lean

    the composition of the aqueous solution according to

    caustic solution. The configuration of the tower is

    the Stokes-Einstein relationship.

    schematically represented in Fig. 5.

    Table 2. Standard correlations in

    the A-Tray program for the deter-

    mination of the mass-transfer

    coefficients and the plate character-

    istics

    Property

    ko

    k,

    A:

    h,

    f,

    &,

    h

    Correlation

    Stichlmair [I 21

    Stichlmair [12]

    Stichlmair [12]

    Stichlmair (121

    Stichlmair [I21

    Glitsch Inc. [13]

    The gas feed to the column, F,, equals

    5800 kmol/h. The feed temperature and pressure are

    3 13.15 K and 12.8 b. The composition of the gas feed

    is given in Table 4. 2510 kmol/h of an aqueous

    solution containing 4 wt% of NaOH are fed at the

    top of the column. 1500 kmol/h of the liquid solution

    is withdrawn from tray 15 and 2300 kmol/h of a

    1 wt% NaOH solution is added on the underlying

    tray.

    The column, with a diameter of 2.764m, is

    equipped with 30 V,-Glitsch Ballast trays. The con-

    structive details of these trays are given in Table 5.

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    512

    L. DE LEYE nd G. F.

    FROMENT

    Gas or liquid flaw rate kmol/h)

    0

    1000

    2000

    I

    t

    TOP

    0

    0.1 x10-

    02x10-

    I

    0.3 x10- 0.4 x10-

    l-

    I

    I I

    I

    x, mole fraction

    5-

    y, mole fraction

    Fig. 3. Variation of the mole fractions of H,S in the gas phase, of DEA and the reaction products in

    the liquid phase and of the gas and liquid flow rates along the column.

    Total pressure b)

    TOD

    7.5 8.0

    x

    I _

    320

    330

    Temperature K

    1

    Fig. 4. Temperature and pressure on each tray in the H,S-DEA absorption column.

    The absorption of H,S in an NaOH solution is

    accompanied by the following overall reaction [14]:

    H,S + NaOH 2 NaHS + H20.

    (31)

    This reaction is instantaneous and reversible.

    In strong OH solutions CO2 is undergoing the

    following overall reaction [15, 161:

    COz + 2NaOH - Na2 CO3 + H,O.

    (32)

    Since NaOH and the salt products are completely

    dissociated, reactions (31) and (32) can be presented

    in ionic form:

    H2S + OH- & HS- + Hz0

    (33)

    and

    CO2 + 20H- - CO:- + H,O.

    Fig. 5. Schematic representation of the H,S-CO,-NaOH

    (34)

    column.

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    Simulation of absorption and reaction in columns-11 513

    Table 4. Composition of gas feed

    for the H,S-CO,-NaOH absorp-

    tion column

    Component

    Mole fraction

    KS

    0.00079

    CO,

    0.00055

    CH,

    0.28612

    GH,

    0.31337

    C,H,

    0.07493

    C,H,

    0.10218

    C,H,

    0.0442

    C,H,s

    0.0171

    H,

    0.16076

    Table 5. Constructive details of the ballast trays in

    the H,S-CO,-NaOH absorntion column

    Prooertv

    Active area, C2(m*) 5.072

    Relative free area on plate 0.1869

    Weir length (m) 2.259

    Weir height (m) 0.05

    Valve thickness (m)

    0.00188

    Density material (kg/m) 8169

    The equilibrium constant K, of the first reaction is

    W-1

    K1 = (HrS)(OH-)

    The kinetic expression of the reaction with CO2 has

    the following form:

    r =

    kCco,

    CoH

    For the determination of the equilibrium constant

    K, , data of Edwards et al. [17] were used. The

    reaction rate coefficient

    k

    in equation (36), as a

    function of temperature and ionic strength of the

    Table 6. Compositions, flow rate and temperature

    of the intermediate liquid withdrawal (W,,,) and

    liquid feed (WV,,) in the H,S-CO,-NaOH absorp

    tion column

    W (kmol/h)

    XHlS

    xcol

    hOH

    %w-IS

    %&go,

    T

    (K)

    Stream Wwll Stream IV,,,

    1500

    2300

    0.123 x lo-

    0.0

    0.0

    0.0

    0.183 x lo-

    0.4529 x IO-

    0.602 x 10-J

    0.0

    0.710 x lo-*

    0.0

    314.63

    313.15

    Table 7. Computed results for the H -CD-NaOH absorption

    column

    L (kmol/h)

    F (kmol/h)

    YH2.s

    Y,Z

    +s

    xcol

    +&OH

    +WiS

    XN.EO,

    P, b)

    T (K)

    A ; (m2/m)

    IC0.u2skmollm2 h b)

    ko.,,, (kmol/m h b)

    k,n,, (m/h)

    k,, co1 (m/h)

    hF (m)

    el.

    Haco2

    Top

    Bottom

    column

    column

    2510 3314.6

    5792.2 5800

    0.103 x 10-r

    0.792 x 10-s

    0.132 x 10-s

    0.551 x lo-

    0.0 0.903 x 10-s

    0.0 0.0

    0.1842 x 10-l

    0.551 x 10-Z

    0.0

    0.138 x 1O-2

    0.0 0.930 x 10-a

    12.569 12.79

    314.11 313.78

    525.7 523.1

    0.401 0.381

    0.392 0.378

    0.390 0.313

    0.429 0.410

    0.159 0.170

    0.225 0.226

    76.1 39.3

    No. of iterations: 8

    CPU time used: 242 s

    Flow rote (kmol/h)

    0

    2500

    5000

    b

    0. 1 x10 1

    I

    I

    x, mole fraction

    5

    -

    NoOH

    10

    25

    Bottom

    0

    0.1 x10-3

    0.5 x10-3

    01 x10-z

    02x10-4

    I

    *

    F

    y, mole fraction

    Fig. 6. Variations of the mole fractions of the different components in the gas and liquid phases and of

    the gas and liquid flow rates along the H,S-CO,-NaOH absorption column.

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    514

    L. E LEYEand G. F. FROMENT

    TOP 12 0

    ,

    1

    Total pressure (b)

    12 5 130

    30

    ottom >\:

    3,0

    315 320

    5

    0): 15

    T

    10

    Temp mtermed

    is

    laquld feed

    i

    4

    f;

    a

    20

    T

    25

    Temperature

    1

    K)

    Fig. 7. H -CO, absorption in NaOH. Temperatures and

    pressures along the column.

    solution, is given by Hikita et al. [16] and Pinsent et

    al. [18].

    The simultaneous absorption of H,S and CO2 in

    the NaOH solution is accompanied by a Type 1B

    system of parallel reactions.

    The diffusion coefficients of H,S and CO, in Hz0

    were determined from experimental data [9, 191.

    These coefficients were corrected for the composition

    of the liquid using the Stokes-Einstein relationship.

    For the determination of the diffusion coefficients of

    the ionic species the correlation of Nernst-Haskell

    [20] was used.

    The solubilities of H,S and CO, in H,O were

    computed from data by Edwards et al. [17]. They

    were corrected for the ionic strength of the solution.

    Again, the standard correlations (see Table 2) in

    the program were used for the determination of the

    mass-transfer coefficients and plate characteristics.

    The initial estimates of temperature and pressure

    on each tray were 313.15 K and 12.8 b. The mole

    fractions of H,S and CO2 at the top of the column

    were estimated to be 1 x lOen and 1 x 10m6. The

    convergence tolerance was set equal to lo-. The

    computed results are summarized in Tables 6 and 7.

    The reaction with CO2 is in the very fast regime.

    The variations of the mole fractions of the different

    components in the gas and liquid phases and of the

    gas and liquid flow rates along the column are shown

    in Fig. 6. Fig. 7 shows the computed temperatures

    and pressures along the column.

    NOMENCLATURE

    A, = Absorbed component j

    a = Stoichiometric coefficient

    A, = Gas-liquid interfacial area per unit liquid

    A: = Gas-liquid interfacial area per m3 froth on the

    volume (m2/m3)

    plate (m2/m3)

    a; = Interfacial area per unit of packed column

    (mlm)

    C, = Molar concentration of component A

    (kmol/m)

    C, = Total molar concentration in the liquid on

    plate k (kmol/m)

    cP= Specific heat (kJ/kmol K)

    D = Molecular diffusivity (m2/h)

    dk = Column diameter (m)

    F =

    Total molar gas flow (kmol/h)

    F, = Enhancement factor

    Fk = Molar gas flow rate leaving plate k (kmol/h)

    Hj =

    Henrys coefficient for absorbed component j

    (b m3/kmol)

    Ha, Ha = Hatta number, modified Hatta number

    -AH, = Heat of absorption of component j (kJ/kmol)

    -AH? =

    Heat of reaction of reaction i (kJ/kmol)

    & = Froth height on plate (m) .

    Ki =

    Equilibrium constant of reaction j

    k

    kj = Reaction-rate coefficient of reaction j

    o, A, = Gas-side

    mass-transfer

    coefficient for

    k

    absorbed component A, (kmol/m2 h b)

    , *. =

    Liquid-side mass-transfer coefficient of

    -_I absorbed component A, (m/h)

    L = Volumetric liquid flow rate (m3/h)

    L = Molar liquid kow rate (kmoljhj

    L& = Molar flow rate of liquid feed to column

    (kmol/h)

    L; = Molar flow rate of liquid stream leaving plate

    k (kmol/h)

    mj,, = Reaction order with respect to component j

    in reaction I

    h4 = Molecular weight (kg/kmol)

    m = Reaction order

    Njl,-0

    = Interfacial flux of component j per unit

    gas-liquid interfacial area (kmol/m2 h)

    n, = Number of absorbing components

    n, = Number of reactions in the liquid phase

    no = Total number of components in gas phase

    nL = Total number of components in liquid phase

    nM = Number of gas-phase components involved in

    moderately fast reactions

    np = Number of reaction products in the liquid

    phase

    na = Number of reactants in liquid phase

    n, = Number of gas-phase components involved in

    very slow reactions

    nv = Number of gas-phase components involved in

    very fast reactions

    p = Partial pressure (b)

    pt =

    Total pressure (b)

    P, = Product j

    r = Reaction rate (kmol/m h)

    Rj = Liquid-phase reactant j

    Q = Total heat of absorption of component j on

    plate k (kJ/h)

    QF = ;f;;;,heat of cooling taken away from plate

    QTk = T )heat of reaction of reaction j on plate k

    Tk =

    Temperature on plate

    k

    (K)

    T,, = Temperature of intermediate gas feed to plate

    k (K)

    T,, =

    Temperature of intermediate liquid feed to

    plate k (K)

    V,, = Flow rate of intermediate gas withdrawal

    from plate k (kmol/h)

    X, = Mole fraction of component j in the liquid

    bulk

    V,, = Flow rate of intermediate gas feed to plate k

    (kmol/h)

    .x~,~ Mole fraction of component j in the bulk of

    the liquid stream leaving plate k

    x~,,~ = Mole fraction of component j in the inter-

    mediate liquid feed to plate k

    y = Coordinate perpendicular to the gas-liquid

    interface (m)

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    Simulation of absorption and reaction in columns-II

    515

    yr, = Location of reaction front of reaction j (m)

    yo = Gas-film thickness (m)

    y, = Mole fraction of component j in the bulk of

    the gas phase

    yik = Mole fraction of component j in the bulk of

    the gas stream leaving plate k

    y, = Liquid-film thickness (m)

    J+,,~ = Molar fraction of component j in the inter-

    mediate gas feed to plate k

    z = Axial coordinate in the froth on the plate (m)

    Greek symbols

    eL = Liquid hold-up of packing or fraction of

    liquid in the froth

    pL = Liquid density (kg/m3)

    R = Cross-section of tower (m2)

    R, =

    Active area of plate (m)

    Subscripts

    A, = With respect to absorbed component j

    b = In the bulk of the gas or liquid phase

    Cj = With respect to the consecutive component j

    G=Gas

    i = At gas-liquid interface

    j = Co&one& index

    k = Plate number

    14.

    5.

    6.

    7.

    8.

    9.

    10.

    11.

    12.

    13.

    L = Liquid

    Pj= With respect to product j

    RI= With respect to reactant j

    15.

    16,

    Superscripts

    G = In gas phase

    L = In liquid phase

    in = At inlet

    out = At outlet

    eq = Equilibrium value

    abs = Absorption

    R = Reaction

    C = Cooling

    17.

    18.

    19.

    20.

    REFERENCES

    L. De Leye and G. F. Froment, Comput. them. Engng

    10, 493 (1986).

    K. Onda, E. Sada, T. Kobayashi and M. Fujine, Chem.

    Engng Sci.

    25, 1023 (1970).

    J. H. Wegstein, Communs Ass. comput. M ach. 1, 9

    (1958).

    A. W. Westerberg, H. P. Hutchison, R. L. Motard and

    P. Winter, Process F lowsheeting, pp. 54-65. Cambridge

    Univ. Press, Cambs. (1979).

    C. Ouwerkerk, Hydrocarbon Process. 57 4), 89 1978).

    A. E. Cornelissen, Trans. I nst. them. Engrs 58, 242

    1980).

    Handbook of Physical Constants, revised edn; Geol. Sot.

    Am. Mem. 97, Sect.18 (1966).

    R. L. Kent and B. Eisenberg, Hydrocarbon Process.

    55 2), 87 1976).

    W. J. Thomas and I. A. Furzer, Chem. Engng Sci. 17,

    115 1962).

    Y. M. Tseng and A. R. Thompson, J. them. Engng Data

    9(2), 264 (l-964).

    J. A. Riddick and W. B. Bunger, Organic Solvents, 3rd

    edn. Wiley Interscience, New York (1970).

    J. Stichlmair, Grundlagen der Dimensioni erung des

    GaslFlussiakeit-Kontaktapparates.

    Bodenkolonne.

    Verlag Chemie, Weinheim-(1978).

    Glitsch Inc.. Ballast Tray Design Manual, Bull. NO.

    4900. Dallas, Tex. (1978): -

    G. Astarita, Mass Transfer with Chemical Reaction.

    Elsevier, Amsterdam (1967).

    P. V. Danckwerts, Gas-Liquid Reactions. McGraw-

    Hill, New York (1970).

    H. Hikita, S. Asai and T. Takatsuka, Chem. Engng J.

    11, 131 (1976).

    T. J. Edwards, J. Newman and J. M. Prausnitx, AIChE

    JI 21(2), 248 (1977).

    B. R. W. Pinsent, L. Pearson and F. J. W. Roughton,

    Trans. Farad. Sot. 52, 1512 1956).

    R. H. Perrv and C. H. Chilton, Chemical Engineers

    Handbook, Chap. 3, 5th edn. McGraw-Hill, New York

    (1973).

    R. C. Reid, J. M. Prausnitz and T. K. Sherwood, The

    Properties of Gases and L iqui ds. McGraw-Hill, New

    York (1977).