CE3503 Expectations
Mass Balance, Kinetics and Reactors, and Mass Transport
1. Mass Balance
a. Basics: be able to write the mass balance on a control volume:


dm 
 min  mout  m reaction
dt
and express that mass balance in terms of concentration:
V
F
IJ
G
HK
dC
dC
 Q  Cin  Q  C  V 
dt
dt
rxn only
b. Kinetics: know the difference between conservative and reactive substances, applying
the Kinetic Rate Law:
dC
 k  Cn
dt
to differentiate between zero and first order reactions and provide the reaction rate
coefficient for each. Be able to use the analytical solutions for zero- and first-order rate
equations:
Ct  C0  e k  t
Ct  C0  k  t
to calculate concentration as a function of time. Be able to apply the first order kinetics
in determining a chemical’s half-life. Be able to adjust both zero- and first-order rate
coefficients for changes in temperature:
kT  k20  T  20
c. Reactor Analogs: know the three types of reactor analogs (batch, plug flow and
completely-mixed flow) and be able to provide examples of their application to both
natural and engineered systems.
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d. Plug Flow Reactors: understand how the equation for a batch reactor becomes the
solution for a plug flow reactor, i.e. by considering a train of batch reactors with position
now equated with time,
C t  C0  e  k  t ; batch reactor or plug flow with ‘t’ = time of travel;
C L  C0  e
C L  C0  e
 k
 k
L

L

; plug flow with ‘t’ given by distance and velocity, t 
L

; plug flow with ‘t’ given by hydraulic retention time,  
and
V
Q
e. Completely-Mixed Flow Reactors: understand the implications of the ‘completelymixed’ and ‘constant volume’ assumptions used in deriving the CMFR mass balance.
Be able to apply the general mass balance expression:
V
F
IJ
G
HK
dC
dC
 Q  Cin  Q  C  V 
dt
dt
rxn only
to the behavior of a conservative substance at steady state in a CMFR, i.e. the mixing
basin calculation:
V
dC
 Qup  Cup  Qin  Cin  Q  C
dt
and
Cmb 
Qup  Cup  Qin  Cin
Q C

Be able to apply the general mass balance expression:
V
F
IJ
G
HK
dC
dC
 Q  Cin  Q  C  V 
dt
dt
rxn only
to a CMFR, solving that equation at steady state for a reactive substance (e.g. first order
decay),
Css  Cin 
Q
Q V k
to obtain the steady state concentration.
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Understand the concept of retention time:

V
Q
and be able to calculate  for any type of reactor.
Know when a steady state solution is appropriate and when a time variable approach
should be used, by determining the 95% response time for the reactor:
t95% 
 ln 0.05
3

1
1
k
k


Be able to apply (not derive; not memorize) the time variable solution to the mass
balance equation:
1 
1 
  k   t

  k   t 


Ct  Css1  e
 Css2  1  e    




to calculate concentration as a function of time as a system moves between two steady
states.
f. Reactor Comparison: understand the characteristics of PFRs and CMFRs and be able
to explain why PFRs are inherently more efficient. Also understand why CMFRs might
be a better solution for some situations, even though they are inherently less efficient.
2. Mass Transport
a. Basics
Understand the role of mass transport in governing pollutant fate in natural and
engineered systems. Be able to define and differentiate the two basic types of mass
transport, advection and diffusion, and describe the difference between molecular and
turbulent diffusion.
b. Advection: be able to recognize the advection terms in the generalized mass balance,
V
F
I
G
HJ
K
dC
dC
 Q  Cin  Q  C  V 
dt
dt
3
rxn only
c. Diffusion: be able to express diffusion as a mass flux density:

mdiff  J diff  A
realizing that mass flux density due to diffusion is related to the diffusion coefficient and
the concentration gradient as defined by Fick’s First Law:
J diff   D 
dC
dx
The mass balance for a completely-mixed volume in a lake is given by:
V
dC
 J diff  A
dt
and substituting the definition of diffusion:
V
dC
dC
 D
A
dt
dx
Be able to apply this equation to compute a mass flux.
Mass Balance, Reactor and Mass Transport Problems
Batch Reactor: initial chemical concentration = 100 mg∙L-1; zero order rate coefficient =
0.1 mg∙L-1∙d-1; first order rate coefficient = 0.1 d-1;  = 1.08.
1. Calculate the time required to reduce the concentration of the chemical by 90% if
decay follows zero-order kinetics. [900 days]
2. Calculate the time required to reduce the concentration of the chemical by 90% if
decay follows first order kinetics. [23 days]
3. Calculate half-life of the chemical at 20 °C.
4. Calculate half-life of the chemical at 35 °C.
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Plug Flow Reactor: initial chemical concentration = 100 mg∙L-1; first order rate
coefficient = 3 d-1; inflow = 100 m3∙d-1; reactor configuration, column, length = 10 m,
cross-sectional area = 1 m2.
5. Determine the effluent chemical concentration. [74 mg/L]
6. Determine the required column length to achieve a 95% reduction in chemical
concentration. [50 m]
Completely-Mixed Flow Reactor: initial chemical concentration = 100 mg∙L-1; first
order rate coefficient = 3 d-1; inflow = 100 m3∙d-1; reactor volume = 10 m3.
7. Calculate the steady-state effluent concentration.
8. Calculate the reactor retention time.
9. Calculate the 95% response time for the reactor and for the reactor with a conservative
substance.
10. Calculate the reactor concentration 0.25 days following a 50% reduction in the
influent chemical concentration.
11. Compare the effluent chemical concentrations for PFR and CMFR. Which is more
efficient? Why? Are there any applications for which the reactor that performs less
efficiently would be a better choice?
Diffusion: the transport of organic chemicals from air to water is governed by diffusion
across a stagnant film of air located immediately above the air-water interface.
Polyaromatic hydrocarbons (PAHs) are a class of chemicals generated through coke
production, coal combustion and other activities. Total PAH levels in the bulk air at a
site in Chicago near Lake Michigan were 300 ng·m-3 and at the water surface were 50
ng·m-3. Assume a stagnant film thickness of 2 cm and a diffusion coefficient in air for
PAHs of 5x10-6 m2·s-1.
12. Calculate the mass flux density (J, g·m-2·yr-1) and mass flux (MT·yr-1) of PAHs to
Lake Michigan by diffusion. [1.97x10-3; 114 MT·yr-1]
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