Estimation of Chemical Equilibria in High-Pressure Gaseous Systems

Ammonia synthesis:prediction of equilibrium conver- sion up to 3500 bar at (a) 673.15 K and (b) 723.15 K. Experimental data from Winchester and Dodge ...
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Ind. Eng. Chem. Res. 1996,34,4583-4584

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ADDITIONS AND CORRECTIONS Volume 34, Number 9

Estimation of Chemical Equilibria in HighPressure Gaseous Systems by a Modified Redlich-Kwong-Soave Equation of State. Albert0 Bertucco,* Massimiliano Barolo, and Giorgio Soave Pages 3159-3165. An error in the publication process caused light gray lines in all of the figures. The correct figures are presented below. In K, 100

-3.0 T

90

I

60

-4.0

1

-6.0

1

70

60 50

-5'0

40

-7.0

30 100 200 300 400 500 800 700 800 900 P [bar]

Figure 1. Ammonia synthesis: effect of k" on equilibrium conversion. Curve a: ~ N ~ N= H ~ = 0.4; curve b all k i s set to zero.

,

1

-1.7

-1.6

-1.5

1

'

1

'

1

-1.4 -1.3 -1000/T [l/K]

'

-1.2

-1.1

Figure 3. Ammonia synthesis: dependence of calculated Kf on temperature and comparison with thermodynamic values (TRC, 1971) at P = 800 bar.

5

0 100 200 300 400 500 600 700 600 900 P [bar]

6

thermodynamic

i

0 0

1

1 , 1000

I

~

'

I

-

3000

2000 P [bar]

'

,

4000

jy' 70

-

50 i

40

0 100 200 300 400 500 600 700 800 900 P [bar]

Figure 2. Ammonia synthesis: dependence of K, on pressure at (a) 681.15 K and (b) 753.15 K. Experimental data from Nielsen (1968).

0888-588519512634-4583$09.00/0

I

' 1

0

1000

'

1

2000 P [bar]

'

1

1

3000

4000

Figure 4. Ammonia synthesis: prediction of equilibrium conversion up t~ 3500 bar at (a) 673.15 K and (b) 723.15 K. Experimental data from Winchester and Dodge (1956).

0 1995 American Chemical Society

4584 Ind. Eng. Chem. Res., Vol. 34,No. 12, 1995 KP 2.2

,

2.0 1.8

-

1.6 -

++ E

I

1.0

, 60

90

120 150 P [bar]

180

210

Figure 5. Water-gas shift reaction: dependence of K .on pressure at T = 593 K. (n),experimental data from Sorgato and Angelin (1965); (+), calculated by LR; ( x 1, calculated by S92. 1.0

1

S92, 573 K

]a)

= I LR, 523 K

0.0

I

i

0

100

300

400

S92, 573 K

\

0.6 -

200 P [bar]

I

‘Y \

LR, 573 K

0.2 -

-

/ S92, 523 K

0.0

0

100

200

P [bar]

300

400

Figure 6. Methanol synthesis: prediction of Kpas a function of pressure at T = 523 and 573 K (a) HdCO ratio in the feed equal to 5 and (b) stoichiometric HdCO ratio in the feed. IE950821Q