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2 - 5 - Catalysis Catalytic Reactors
2 - 5 - Catalysis Catalytic Reactors
Engineering 2
CRE-2
Te k n i k K i m i a U n i v e r s i t a s P e r t a m i n a
Agung Nugroho
Catia Angli Curie
2020
Part 2. Catalysis and Catalytic Reactors
Content Objectives
➢ Rate Limiting Step
➢ Able to make the reaction rate equation
➢ Adsorption limited
based on the rate limiting step
➢ Surface reaction limited
➢ Able to analyze experimental data, decide
➢ Desorption limited
the rate limiting step
➢ Analyzing experimental data
➢ Able to estimate the reaction rate
➢ Evaluation of the rate-law parameters
constants
➢ Reactor design for process limited by
➢ Able to design reactor for process limited
adsorption/surface reaction/desorption
by adsorption/surface reaction/desorption
➢ Packed bed reactor
➢ Fluidized bed reactor
Mechanism involving Inert
Disproportionation reaction of Cumene to Benzene and Propylene
The rate law for the case of no inerts adsorbing on the surface is:
If we were to have an adsorbing inert in the feed, the inert would not participate in the
reaction but would occupy active sites (chemisorption) on the catalyst surface:
Concentration of inert
adsorbed on the surface
𝐶6 𝐻5 𝐶𝐻3 + 𝐻2 ⟶ 𝐶6 𝐻6 + 𝐶𝐻4
Does it match?
→Yes
This shows that the reaction is irreversible
or Kp is >>
Rate law
Stoichiometry 𝐹𝑖 Θ𝑖 + 𝜈𝑖 𝑋 𝑃 𝑇0
𝑃𝑖 = 𝐶𝑖 𝑅𝑇 where 𝐶𝑖 = = 𝐶𝐴0
𝑣 1 + 𝛿𝑦𝐴0 𝑋 𝑃0 𝑇
And for 𝛿=0:
Combine 𝐶𝑖 = 𝐶𝐴0 Θ𝑖 + 𝜈𝑖 𝑋
𝑃 𝑇0
𝑃0 𝑇
𝑃 𝑇0
𝑃𝑇 = 𝐶𝑇 𝑅𝑇 𝐶𝑇 = 𝐶𝑇0 Θ 𝑇 + 𝜈𝑇 𝑋 −10 𝑚𝑜𝑙
𝑃0 𝑇 𝑘 = 140.469 𝑥 10 ൗ𝑔𝑐𝑎𝑡. 𝑠. 𝑎𝑡𝑚2
𝑃𝑇 = 𝑃𝑇0 1 − 𝑋 𝑝
𝑘 = 8.4281 𝑥 10−4 𝑚𝑜𝑙ൗ
𝑃𝐻2 = 𝑃𝑇0 Θ𝐻2 − 𝑋 𝑝 𝑘𝑔𝑐𝑎𝑡. 𝑚𝑖𝑛. 𝑎𝑡𝑚2
𝑃𝐵 = 𝑃𝑇0 𝑋 𝑝 𝐾𝐵 = 1.2638
𝑘𝑃𝐻2 𝑃𝑇 𝐾𝑇 = 1.0058
−𝑟𝑇 ′ =
1 + 𝐾𝐵 𝑃𝐵 + 𝐾𝑇 𝑃𝑇
𝑃𝑇0 = 12 𝑎𝑡𝑚
2
𝑑𝑋 1 𝑘𝑃𝑇0 1 − 𝛼𝑊 1 − 𝑋 1.5 − 𝑋
=
𝑑𝑊 𝐹𝑇0 1 + 𝐾𝐵 𝑃𝑇0 𝑋 1 − 𝛼𝑊 1/2 + 𝐾𝑇 𝑃𝑇0 1 − 𝑋 1 − 𝛼𝑊 1/2
• If we have (ODE):
• We can approximate the solution of such ODE using Runge Kutta 4 order method:
th
Solution (Using RK4)
• Using 2 step (h=0.3) we can get:
• Step 1:
k1 k2 k3 k4
• X1=0.3 → 3589.623 5002.692 5062.737 7486.316 W1 = 1560.34 kg
• X2=0.6 → 7505.66 12157.51 12815.04 25673.42 W2 = 5716.55 kg
(a)
(b)
(c)
(d) (c)
Solution
Propose
𝑘 𝑃𝐵𝑢
−𝑟𝐵𝑢 ′ = 2
1 + 𝐾𝐵𝑢 𝑃𝐵𝑢
• Modelling fluidized bed with CSTR is only an approximation (more complex model
is needed for precise calculation)
• Characteristic of fluidized bed reactor:
Advantages Disadvantages
→ Can handle large amount of feed & solids →Expensive reactor & expensive
→ Easy catalyst replacement/regeneration catalyst regeneration equipment
Fluidized Bed Reactor
Exercise 𝐶6 𝐻5 𝐶𝐻3 + 𝐻2 ⟶ 𝐶6 𝐻6 + 𝐶𝐻4
For the reaction of toluene to form benzene & methane, we wish to design a packed-bed
reactor to process a feed consisting of 30% toluene, 45% hydrogen, and 25% inert (the inert
is not adsorbed). Toluene is fed at a rate of 50 mol/min at a temperature of 640oC and a
pressure of 40 atm (4052 kPa). Hydrogen is used in excess to help prevent coking. Determine
the catalyst weight (in kg) in a fluidized CSTR (fluidized bed) with a bulk density of 400 kg/m3
to achieve 60% conversion.
Design
equations
𝑘𝑃𝐻2 𝑃𝑇
Rate law −𝑟𝑇 ′ =
1 + 𝐾𝐵 𝑃𝐵 + 𝐾𝑇 𝑃𝑇
At X = 0.6 W = 10249.6 kg
Stoichiometry 𝑃𝑇 = 𝑃𝑇0 1 − 𝑋
𝑃𝐻2 = 𝑃𝑇0 Θ𝐻2 − 𝑋
Combine
𝑃𝐵 = 𝑃𝑇0 𝑋
References
Fogler, H. S. 2009. “Elements of Chemical Reaction Engineering”, 5th Ed. Prentice-Hall.
Levenspiel, O. 1999. “Chemical Reaction Engineering”, 3rd Ed. John Wiley & Sons.