Analisis de Reacto Con Chemcad
Analisis de Reacto Con Chemcad
Analysis
Types of Reactors
Stoichiometric Reactor Module
Stoichiometric Reactors (1)
Stoichiometric Reactors (2)
Stoichiometric Reactors (3)
Equilibrium Reactors
Gibbs Reactor
RGibbs Module
Equilibrium Reactor
REquil Module
Equilibrium Reactor Calculations
Results of Equilibrium Calculations (1)
Results of Equilibrium Calaulations (2)
Comments on Equilibrium Reactors
Kinetic Reactors
RPLUG Module
PFTR Reactors (1)
PFTR Reactor (2)
CSTR Reactors
RCSTR Module
CSTR (1)
CSTR (2)
ChemCAD
Reactor Simulation
ChemCAD Reactors
Types of Reactors
General Considerations and Phase Key
StoichiometricReactor
Equilibrium Reactor
Kinetic Reactor
Gibbs Reactor
Types of Reactor
StoichiometricReactor
Kinetic Reactor
Equilibrium Reactor
Gibbs Reactor
ChemCAD Reactors
General Considerations
Heat of reaction calculated or specified
Reactor thermal mode:
- Adiabatic
- Isothermal
- Heat Load
- Fixed Temp. profile
- Utility Stream
Phase Consideration
Stoichiometric Reactor
General
One Reaction Only
Conversion must be specified
Heat of reaction calculated or specified
Typical Uses
Early of "Budget" process analysis
Component switching - Changing properties
Complete reactions or known conditions
Workshop Reactor1 : Stoichiometric Reactor
Benzene + 3 H
2
---> Cyclohexane
Adiabatic
Conversion of 1 mole of benzene to cyclohexane
using excess of hydrogen
Change reactor type to isothermal at 600 F.
Note cooling load required
Highly exothermic reactions will usually require
quenching, cooling or multiple reactors.
Cyclohexane is normally produced in multiple reactors
with intercooling.
Kinetic Reactor
Reactor Type
CSTR
Plug Flow
Calc Mode
Volume specified
Conversion specified
Phase
Liquid (Default)
Vapor
Mixed phase, reaction occurs in the liquid phase
Mixed phase, reaction occurs in the vapor phase
Kinetic Reactor
= = =
+ =
nrx
j
n
k
C
e
e kj
n
k
a
kj
RT E
j ij i
j
b
k
RT
j
j kj
j
k kj
C e A N r
1 1
) * *
1
) /( ) /(
1 ( * ) ( * * *
kj
= Absorption frequency factor for component k
k
= Absorption energy factor for component k
i
= Power factor for absorption sites term for reaction, j
= Product of all reaction concentration terms
= Sum of absorption factor for each reactant
b
kj
= Exponential factor for reactant k in reaction j
Workshop Reactor2: Kinetic Reactor
Adiabatic kinetic reaction of a lbmole each of acetic acid and ethanol, fed at it's bubble
point to a 1 liter reactor. Kinetics of the forward and reverse reactions are considered.
Mixed phase, reaction occurs in the liquid phase.
Acetic Acid +Ethanol <==>Ethyl Acetate +H
2
O
r
1
=K
1
[AA][EtOH]=k
10
e
-E1/RT
[AA][EtOH] Concentration flag : moles/volume
r
2
=K
2
[EA][H
2
O]=k
20
e
-E2/RT
[EA][H
2
O] Time Unit : Min.
k
10
=29000, E1=7150 Volume Unit : Liters
k
20
=7130, E2=7150 Activation Energy : Cal
Simulate this reactor Molar Flow Unit : Gm-mole
This reaction is endothermic.
Change reactor type to isothermal at 100