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Objectives
Notes
Graphical method
Numerical method
Polynomial Fit
Differential Method
Half Life
Initial rate
Case Study
Consider the following reaction that occurs in a constant
volume batch reactor
Mole
Balance:
Rate Law:
Stoichiomet
ry:
Combine:
Integral Method
Zero order
First order
Second order
dC A
rA k
dt
dC A
rA kC A
dt
dC A
2
rA kC A
dt
CA
CA
CA
dC
C A0
k dt
0
C A C A0 kt
C A C A0 kt
dC A
C C A k 0 dt
A0
ln C A CC
A
A0
kt
ln C A ln C A0 kt
ln C A0 ln C A kt
C A0
ln
kt
CA
dC A
C C A 2 k 0 dt
A0
1
C
A
CA
kt
C A0
1
1
kt
C A C A0
1
1
kt
C A C A0
Finally we should also use the formula to plot reaction rate data in
terms of concentration vs. time for 0, 1st, and 2nd order reactions.
These types of plots are usually used to determine the values k for
runs at various temperatures and then used to determine the
activation energy.
Zero Order
First Order
Second Order
t1
t2
t3
concentration (mol/dm3)
CAo
CA1
CA2
CA3
1. Graphical
l Point
or point
st point
1
dC A
2.
C A(i 1) C A( i 1)
dt 2t
1
dC A
C A4 C A2
e.g.,
dt t 3 2t
dC A
3.e.g .,
dt
t5
1
C A3 4C A4 3C A5
2t
#
SELF TEST
The reaction AB is carried out in a constant volume batch
reactor. Determine the reaction order and specific reaction rate
from the following data.
t(min)
10
20
30
CA(mol/dm3)
0.6
0.4
0.3
Finite Difference
Method of Half-Lives
Half life, t1/2 time takes for the concentration of the reactant to fall to
half of its initial concentration.
Rate Law:
Combine:
1 1
1
1 1
t
k ( 1) C A
C A0
t 1
kC A0 ( 1)
C A0
CA
t1
2 1 1 1
1
k ( 1) C A0
ln t 1
2 1
ln
(1 ) ln C A0
( 1)k
Slope = 1-
ln t1/2
ln CA0
#
Differential reactors
Inert filing
FA0
FAe
L
Catalyst
rA '
FA0 X v0C A0 vC Ae
F
P
W
W
W
rA '
v0 (C A0 C Ae ) v0C Ae
W
W
Linearizing,
The End