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Chemical Engineering Assignment on Catalysis

The document contains 7 questions regarding catalytic reaction kinetics and reactor design for chemical engineering students. It provides background information and experimental data for reactions involving t-butyl alcohol production, reactant concentration in cylindrical pores, kinetics determination from plug flow reactor data, and fluidized bed reactor design. Students are asked to derive rate laws, effectiveness factors, determine operating conditions, and analyze kinetics and deactivation models based on the information provided.

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Naina Sontakkey
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0% found this document useful (0 votes)
99 views2 pages

Chemical Engineering Assignment on Catalysis

The document contains 7 questions regarding catalytic reaction kinetics and reactor design for chemical engineering students. It provides background information and experimental data for reactions involving t-butyl alcohol production, reactant concentration in cylindrical pores, kinetics determination from plug flow reactor data, and fluidized bed reactor design. Students are asked to derive rate laws, effectiveness factors, determine operating conditions, and analyze kinetics and deactivation models based on the information provided.

Uploaded by

Naina Sontakkey
Copyright
© © All Rights Reserved
We take content rights seriously. If you suspect this is your content, claim it here.
Available Formats
Download as PDF, TXT or read online on Scribd

Laxminarayan Institute of Technology

Accredited by NAAC with A+ Grade (3.48 CGPA)


Rashtrasant Tukadoji Maharaj Nagpur University
[Link]/litnagpur

Title : Assignment No-2 Date: 03/04/2023


Academic Year : 2022-23
Semester : VI
Subject Name : CRE-II
Class : B. Tech. Chemical Engineering/ Technology
Last date of Submission : 14/04/2022

Que 1) t-Butyl alcohol (TBA) is an important octane enhancer that is used to replace lead additives in
gasoline. TBA was produced by the liquid-phase hydration (W) of isobutene (I) over an Amberlyst-15
catalyst. The system is normally a multiphase mixture of hydrocarbon, water, and solid catalysts.
However, the use of cosolvents or excess TBA can achieve reasonable miscibility. The reaction
mechanism is believed to be
𝐼+𝑆 ↔𝐼∙𝑆
𝑊+𝑆 ↔𝑊∙𝑆
𝑊 ∙ 𝑆 + 𝐼 ∙ 𝑆 ↔ 𝑇𝐵𝐴 ∙ 𝑆 + 𝑆
𝑇𝐵𝐴 ∙ 𝑆 ↔ 𝑇𝐵𝐴 + 𝑆
Derive a rate law assuming:
(a) The surface reaction is rate-limiting.
(b) The adsorption of isobutene is limiting.
(c) The reaction follows Eley–Rideal kinetics
𝐼 ∙ 𝑆 + 𝑊 ↔ 𝑇𝐵𝐴 ∙ 𝑆
and the surface reaction is limiting.
(d) Isobutene (I) and water (W) are adsorbed on different sites.
𝐼 + 𝑆1 ↔ 𝐼 ∙ 𝑆1
𝑊 + 𝑆2 ↔ 𝑊 ∙ 𝑆2
(e) What generalization can you make by comparing the rate laws derived in parts (a) through (d)?
Que 2) For cylindrical pore of length L, prove that the concentration of reactant within the pore is given
𝐶𝐴 𝑐𝑜𝑠ℎ 𝑚(𝐿−𝑥)
by 𝐶
= 𝑐𝑜𝑠ℎ 𝑚𝐿
𝐴𝑆
Also derive the expression for the effectiveness factor as a function of Thiele Modulus.
Que 3) The catalytic reaction A -- 4R is run at 3.2 atm and 117ºC in plug flow reactor which
contains 0.01 kg of catalyst and uses feed consisting of the partially converted product of 20
litres/hr of pure unreacted A. The results are as follows:
Run No 1 2 3 4
3
CA0 (mol/dm ) 0.1 0.08 0.06 0.04
CAout (mol/dm3) 0.084 0.070 0.055 0.038
Find a rate equation to represent this reaction
Que 4) Reactant A at CA0= 10 mol/m3 is to be passed through a packed bed catalytic reactor
where it will decompose into either R or S. To maximize the formation of R and for 90%
decomposition of A determine
 whether to operate in the strong pore diffusion regime or in the diffusion-free regime
 whether to use plug flow or mixed flow (high recycle)

Signature of Faculty Member Head of Department

Chemical Engineering Department DOC_AP_rev_00


Laxminarayan Institute of Technology
Accredited by NAAC with A+ Grade (3.48 CGPA)
Rashtrasant Tukadoji Maharaj Nagpur University
[Link]/litnagpur

 CR expected in the exit stream.


The kinetics of the decomposition, when free of pore diffusion resistance, is given by

Que 5) Reactant gas (u0 = 0.3 m/s, v0 = 0.3π m3/s passes upward through a 2-m diameter
fluidized bed (umf= 0.03 m/s, εmf= 0.5) containing 7 tons of catalyst (W = 7000
kg, ρs = 2000 kg/m3). Reaction proceeds as follows:

(a) Calculate the conversion of reactant.


(b) Find the proper mean concentration of A seen by the solids.
(c) If gas were made to flow downward through the solids we would have a packed bed.
Assuming plug flow of gas find the conversion of reactant for this situation.
Additional Data
CA0 = 100 mol/m3, Diffusivity D = 20 × 10-6 m2/s, α = 0.33
Estimated bubble size in the bed: db = 0.32 m
See Figure which represents this system.

Que 6) Write down the detailed note on the types of deactivation of catalyst with reference to
kinetics of deactivation.
Que 7) The catalytic decomposition of reactant (A→R) is studied in a packed bed
reactor filled with 2.4-mm pellets and using a very high recycle rate of product
gases (assume mixed flow). The results of a long-time run and additional data
are given below

Find the kinetics of reaction and deactivation, both in the diffusion-free and in
the strong pore diffusion resistance regime.

Signature of Faculty Member Head of Department

Chemical Engineering Department DOC_AP_rev_00

Common questions

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The comparison of rate laws derived under different assumptions regarding the limiting steps reveals the sensitivity of catalytic dynamics to these steps. Generally, if adsorption is limiting, the rate law depends on the concentration of free catalyst sites and adsorbate concentration; if the surface reaction is limiting, the adsorbed species' concentrations govern the rate. This demonstrates how different steps within the reaction mechanism direct the focus of rate laws towards varying kinetic parameters and constants, emphasizing the complex balance between adsorption, reaction, and desorption in catalyst performance .

To maximize selectivity towards product R in the decomposition of reactant A, one should consider using a flow regime that encourages the desired pathway while minimizing side reactions. In cases where strong pore diffusion limits reactions, it may be advantageous to operate in a diffusion-free regime using a catalyst particle size that reduces internal mass transfer resistance. Additionally, a plug flow reactor may provide higher selectivity compared to a mixed flow system, as it minimizes back-mixing and allows for better control over the residence time and concentration profiles, favoring the primary reaction route to R over S .

Assuming the surface reaction is the rate-limiting step implies that the adsorption of reactants and desorption of products occur much faster than the actual chemical transformation on the catalyst surface. Thus, the rate law is primarily determined by the kinetics of the surface reaction, rather than the adsorption equilibria. This results in a rate law that directly correlates reaction rate with the concentration of adsorbed reactants, assuming other steps are at equilibrium or do not significantly slow down the overall rate .

The effectiveness factor measures the efficiency of a porous catalyst in converting reactants to products by considering the ratio of the actual reaction rate to that predicted in the absence of diffusion limitations. It is crucial because it combines chemical reaction kinetics and mass transfer effects, highlighting whether the internal mass transfer resistance significantly inhibits the overall reaction. The effectiveness factor depends on the Thiele Modulus, which is a dimensionless number reflecting the balance between reaction rate and diffusion rate. A high Thiele Modulus suggests strong diffusion limitations, while a low modulus indicates negligible diffusion resistance .

t-Butyl alcohol (TBA) is used as an octane enhancer to replace lead additives in gasoline due to its ability to increase the octane number, which improves fuel efficiency and reduces knocking in engines. The liquid-phase hydration of isobutene over an Amberlyst-15 catalyst involves a multiphase system where hydrocarbons, water, and solid catalysts interact. The reaction mechanism includes the initial adsorption of isobutene and water onto catalyst sites, followed by the formation of TBA. This process can be modified for miscibility with cosolvents or excess TBA .

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