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PSE Laboratory
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Nation Taiwan University
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Introduction to Aspen Plus
Part 1: Introduction
2
What is Aspen Plus
Aspen Plus is a market-leading process modeling tool for
conceptual design, optimization, and performance monitoring
for the chemical, polymer, specialty chemical, metals and
minerals, and coal power industries.
3
Ref: http://www.aspentech.com/products/aspen-plus.cfm
What Aspen Plus provides
Physical Property Models
Worlds largest database of pure component and phase equilibrium
data for conventional chemicals, electrolytes, solids, and polymers
Regularly updated with data from U. S. National Institute of Standards
and Technology (NIST)
Comprehensive Library of Unit Operation Models
Addresses a wide range of solid, liquid, and gas processing equipment
Extends steady-state simulation to dynamic simulation for safety and
controllability studies, sizing relief valves, and optimizing transition,
startup, and shutdown policies
Enables you build your own libraries using Aspen Custom Modeler or
programming languages (User-defined models)
4
Ref: Aspen Plus Product Brochure
More Detailed
Properties analysis
Properties of pure component and mixtures (Enthalpy,
density, viscosity, heat capacity,etc)
Phase equilibrium (VLE, VLLE, azeotrope calculationetc)
Parameters estimation for properties models (UNIFAC
method for binary parameters, Joback method for boiling
pointsetc)
Data regression from experimental deta
Process simulation
pump, compressor, valve, tank, heat exchanger, CSTR, PFR,
distillation column, extraction column, absorber, filter,
crystallizeretc 5
What course Aspen Plus
can be employed for
MASS AND ENERGY BALANCES
PHYSICAL CHEMISTRY
CHEMICAL ENGINEERING THERMODYNAMICS
CHEMICAL REACTION ENGINEERING
UNIT OPERATIONS
PROCESS DESIGN
PROCESS CONTROL
6
Lesson Objectives
Familiar with the interface of Aspen Plus
Learn how to use properties analysis
Learn how to setup a basic process simulation
7
Outline
Part 1 : Introduction
Part 2 : Startup
Part 3 : Properties analysis
Part 4 : Running Simulation in Aspen Plus (simple units)
Part 5 : Running Simulation in Aspen Plus (Reactors)
Part 6 : Running Simulation in Aspen Plus (Distillation)
Part 7 (additional): Running Simulation in Aspen Plus (Design,
spec and vary)
8
Introduction to Aspen Plus
Part 2: Startup
9
Start with Aspen Plus
11
Interface of Aspen Plus
Model
ModelLibrary
Library (View|
(View| Model
ModelLibrary
Library) )
Stream
12
Status message
More Information
13
Help for Commands for Controlling Simulations
Data Browser
The Data Browser is a sheet and form viewer with a
hierarchical tree view of the available simulation
input, results, and objects that have been defined
14
Setup Specification
Run Type
Input mode
15
Input components
16
Properties
17
Property Method SelectionGeneral Rule
Example 1:
water - benzene
Example 2:
benzene - toluene
18
Typical Activity Coefficient Models
Non-Randon-Two Liquid Model (NRTL)
Uniquac Model
Unifac Model
Typical Equation of States
NRTL
21
NRTL Binary Parameters
22
Access Properties Models and
Parameters
23
Review Databank Data
Including:
Ideal gas heat of formation at 298.15 K
Ideal gas Gibbs free energy of formation at
298.15 K
Heat of vaporization at TB
Normal boiling point
Standard liquid volume at 60F
.
25
Example: PLXANT-1
(Extended Antoine Equation)
Corresponding Model
26
Example: CPIGDP-1
(Ideal Gas Heat Capacity Equation)
Corresponding Model
27
Basic Input---Summary
The minimum required inputs to run a simulation
are:
Setup
Components Property Analysis
Properties
Streams
Process Simulation
Blocks
28
Introduction to Aspen Plus
29
Overview of Property Analysis
Use this form To generate
Tables and plots of pure component properties as a function of temperature
Pure
and pressure
Binary Txy, Pxy, or Gibbs energy of mixing curves for a binary system
Residue Residue curve maps
Ternary maps showing phase envelope, tie lines, and azeotropes of ternary
Ternary
systems
This feature locates all the azeotropes that exist among a specified set of
Azeotrope
components.
Ternary diagrams in Aspen Distillation Synthesis feature: Azeotropes,
Ternary Maps Distillation boundary, Residue curves or distillation curves, Isovolatility curves,
Tie lines, Vapor curve, Boiling point
30
Find Components
31
Find Components
32
Find Components
33
Find Components
Select NRTL
35
Check Binary Parameter
Properties
Parameters
NRTL-1
36
Find Components
37
Find Components
38
Properties Analysis Pure Component
39
Available Properties
Property (thermodynamic) Property (transport)
Availability Free energy Thermal conductivity
Constant pressure
Enthalpy Surface tension
heat capacity
Heat capacity ratio Fugacity coefficient Viscosity
Constant volume heat Fugacity coefficient
capacity pressure correction
Free energy departure Vapor pressure
Free energy departure
Density
pressure correction
Enthalpy departure Entropy
Enthalpy departure
Volume
pressure correction
Enthalpy of
Sonic velocity
vaporization
Entropy departure 40
Example1: CP (Heat Capacity)
2. Select phase
5. Specify pressure
Add N-butyl-acetate
42
Data results
Properties Analysis Binary Components
Binary Component Properties Analysis
Data results
Example: Generate XY plot
6. Specify temperature
3. Select property method (if LLE is slected)
Data results
Property Analysis Conceptual
(Optional)
Design
54
Conceptual Design
Azeotrope Analysis
Azeotrope Analysis
Simple Units
(Mixer, Pump, valve, flash, heat exchanger)
63
Example 1: Calculate the mixing
properties of two stream
1 4
3
2
Mixer Pump
1 2 3 4
Mole Flow kmol/hr
WATER 10 0 ? ?
BUOH 0 9 ? ?
BUAC 0 6 ? ?
Total Flow kmol/hr 10 15 ? ?
Temperature C 50 80 ? ?
Pressure bar 1 1 1 10
Enthalpy kcal/mol ? ? ? ?
Entropy cal/mol-K ? ? ? ?
Density kmol/cum ? ? ? ?
64
Setup Specification
Select Flowsheet
65
Reveal Model Library
66
Adding a Mixer
67
Adding Material Streams
68
Adding Material Streams (contd)
69
Adding Material Streams (contd)
When moving the mouse on the arrows, some description appears.
70
Adding Material Streams (contd)
71
Reconnecting Material Streams
(Feed Stream)
72
Reconnecting Material Streams
(Product Stream)
B1
73
Specifying Feed Condition
74
Specifying Feed Condition (contd)
1 2
75
Specifying Input of Mixer
76
Specifying Input of Mixer (contd)
77
Run Simulation
78
Status of Simulation Results
Message Means
The run has completed normally, and results are
Results available
present.
Results for the run are present. Warning
messages were generated during the
Results with warnings
calculations. View the Control Panel or History
for messages.
Results for the run are present. Error messages
Results with errors were generated during the calculations. View the
Control Panel or History for messages.
Results for the run are present, but you have
changed the input since the results were
Input Changed
generated. The results may be inconsistent with
the current input.
79
Stream Results
80
1 2 3
Substream: MIXED
Mole Flow kmol/hr
WATER 10 0 10
BUOH 0 9 9
BUAC 0 6 6
Total Flow kmol/hr 10 15 25
Total Flow kg/hr 180.1528 1364.066 1544.218
Total Flow cum/hr 0.18582 1.74021 1.870509
Temperature C 50 80 70.08758
Pressure bar 2 1 1
Vapor Frac 0 0 0
Liquid Frac 1 1 1
Solid Frac 0 0 0
Pull down the list and select Enthalpy kcal/mol -67.81 -94.3726 -83.7476
Full to show more properties Enthalpy kcal/kg -3764.03 -1037.77 -1355.82
Enthalpy Gcal/hr -0.6781 -1.41559 -2.09369
results.
Entropy cal/mol-K -37.5007 -134.947 -95.6176
Entropy cal/gm-K -2.0816 -1.48395 -1.54799
Density kmol/cum 53.81564 8.619647 13.36534
Density kg/cum 969.5038 783.851 825.5604
Average MW 18.01528 90.93771 61.76874
Enthalpy and Entropy Liq Vol 60F cum/hr 0.1805 1.617386 1.797886
81
Change Units of Calculation Results
82
Setup Defining Your Own Units Set
83
Setup Report Options
84
Stream Results with Format of
Mole Fraction
85
Add Pump Block
86
Add A Material Stream
87
Connect Streams
88
Pump Specification
3. Efficiencies (Default: 1)
89
Run Simulation
90
Block Results (Pump)
91
92
Streams Results
93
Calculation Results
(Mass and Energy Balances)
1 4
3
2
Mixer Pump
1 2 3 4
Mole Flow kmol/hr
WATER 10 0 10 10
BUOH 0 9 9 9
BUAC 0 6 6 6
Total Flow kmol/hr 10 15 25 25
Temperature C 50 80 70.09 71.20
Pressure bar 1 1 1 10
Enthalpy kcal/mol -67.81 -94.37 -83.75 -83.69
Entropy cal/mol-K -37.50 -134.95 -95.62 -95.46
Density kmol/cum 969.50 783.85 825.56 824.29
94
Exercise
1 5 6
2 4
3 Mixer Pump
1 2 3 4 5 6
Mole Flow kmol/hr
Water 10 0 0 ? ? ?
Ethanol 0 5 0 ? ? ?
Methanol 0 0 15 ? ? ?
Total Flow kmol/hr 10 15 15 ? ? ?
Temperature C 50 70 40 ? ? ?
Pressure bar 1 1 1 1 4 2
Enthalpy kcal/mol ? ? ? ? ? ?
Entropy cal/mol-K ? ? ? ? ? ?
Density kmol/cum ? ? ? ? ? ?
120
T-x
T-y
115
T ( C)
T=105 C 110
o
Saturated Feed P=1atm
105
P=1atm
F=100 kmol/hr 100
zwater=0.5 0.0 0.2 0.4 0.6 0.8 1.0
zHAc=0.5 xWater and yWater
Data results
Generate xy plot
Generate xy plot (contd)
Add Block: Flash2
Add Material Stream
Specify Feed Condition
Saturated Feed
(Vapor fraction=0)
P=1atm
F=100 kmol/hr
zwater=0.5
zHAc=0.5
Block Input: Flash2
Flash2: Specification
T=105 C
P=1atm
Required Input Complete
42.658 kmol/hr
zwater=0.501
zHAc=0.409
T=105 C
Saturated Feed P=1atm
P=1atm
F=100 kmol/hr
zwater=0.5 57.342 kmol/hr
zHAc=0.5 zwater=0.432
zHAc=0.568
HEAT EXCHANGE
2000.4 MPa
10000kg/hr
50% 20% 10%
201.0 MPa
60000 kg/hr
COMPONENTS SPECIFICATION
116
Thermodynamic Model NRTL
117
ADD BLOCK: HEATX
Feeds Conditions
CLD-IN HOT-IN
BLOCK INPUT
Check result
121
Check result
122
Introduction to Aspen Plus
Reactor Systems
(RGIBBS, RPLUG,RCSTR)
123
Equilibrium Reactor: RGIBBS
124
Equilibrium Reactor: RGIBBS
Fresh Feed
Reactions: Flow rate 1000 (kmol/h)
CO 0.2368
CO 3H 2 CH 4 H 2O H2 0.7172
H2O 0.0001
CO2 4 H 2 CH 4 2 H 2O CH4 0.0098
CO H 2O CO2 H 2 CO2 0.0361
T=300 k
P=470 psia
125
Equilibrium Reactor: RGIBBS
126
Equilibrium Reactor: RGIBBS
128
KINETICS REACTORS: RPLUG
Reaction :Exothermic & reversible
CO H 2O CO2 H 2 H 41.09( KJ / mol )
kmol
Rate k f YCOYH 2O k rYCO2 YH 2 ( )
kgcat s
47400
k f 51.545 exp( )
RT
85458
k r 3922.1exp( )
RT
Rate [=] Kmol/Kgcat/s
Activation Energy [=] KJ/Kmol
KINETICS REACTORS: RPLUG
Reaction :Exothermic & reversible
CO H 2O CO2 H 2 H 41.09( KJ / mol )
137
Check result
138
Check result
Select Reactor Length column
Display Plot
139
585.0 587.5 590.0 592.5 595.0 597.5 600.0 602.5 605.0 607.5 Check result
Block B2 (RPlug) Profiles Process Stream
Temperature MIXED
TEMPERATURE K
0.0 0.5 1.0 1.5 2.0 2.5 3.0 3.5 4.0 4.5 5.0 5.5 6.0 6.5 7.0 7.5 8.0 8.5 9.0 9.5 10.0
Reactor length MIXED meter
140
Check result
141
Check result
Select Reactor Length column
Display Plot
142
Check result
Block B2 (RPlug) Profiles Process Stream
0.5
0.45
0.4
0.35
0.0 0.5 1.0 1.5 2.0 2.5 3.0 3.5 4.0 4.5 5.0 5.5 6.0 6.5 7.0 7.5 8.0 8.5 9.0 9.5 10.0
Reactor length MIXED meter
KINETICS REACTORS: RCSTR
Reactor :
Reaction rate :
RCHA kVRCACH Where
ft 3
VR: reactor volume lbmole 3
ft
CA: concentration of Aniline lbmole ft 3
Reaction kinetics :
k k0 exp( E ) Where
RT
T : temperature (R)
E 2000 Btu E : activity energy
lbmole
k0 10
8
Reaction Kinetics Input
Reaction Kinetics Input
Reaction Kinetics Input
Feeds Conditions
Two fresh feed stream :
Distillation Process
(DSTWU, RADFRAC)
154
Distillation Separation
There are two degrees of
1 freedom to manipulate
distillate composition and
2
xwater=0.99 bottoms composition to
RR ? manipulate the distillate and
20
bottoms compositions.
Saturated Feed
If the feed condition and the
P=1.2atm number of stages are given,
F=100 kmol/hr
zwater=0.5
39 QR ? how much of RR and QR are
zHAc=0.5 40
required to achieve the
xHAc=0.99 specification.
Distillation Separation
Example :
A mixture of benzene and toluene containing 40 mol% benzene
is to be separated to dive a product containing 90 mol%
benzene at the top, and no more than 10% benzene in bottom
product. The feed enters the column as saturated liquid, and
the vapor leaving the column which is condensed but not
cooled, provide reflux and product. It is proposed to operate
the unit with a reflux ratio of 3 kmol/kmol product. Please
find:
62.5
1. By what you learned in Material balance and
unit operation
From thermodynamic phase equilibrium, and the calculation of operating line:
Select NRTL
2. By the shortcut method in Aspen Plus (DISTWU)
(Select property method)
Same as Case 2
3. More rigorous method in Aspen Plus (RADFRAC)
(Column Specification)
187
3. More rigorous method in Aspen Plus (RADFRAC)
(Design , Spec and Vary)
3. More rigorous method in Aspen Plus (RADFRAC)
(Design , Spec and Vary)
What do we want??
--- 90% Benzene at top.
What do we want??
--- 90% Benzene at top.
Select Benzene
3. More rigorous method in Aspen Plus (RADFRAC)
(Design , Spec and Vary)
Add a Vary
(1 Design Spec 1 Vary)
3. More rigorous method in Aspen Plus (RADFRAC)
(Design , Spec and Vary)
What do we want??
--- 10% Benzene at bot.
What do we want??
--- 10% Benzene at bot.
2nd Vary
3. More rigorous method in Aspen Plus (RADFRAC)
(Design , Spec and Vary)
T : Temperature
P : Pressure
F : Liquid and vapor flow rate.
Q: Heat Duty
3. More rigorous method in Aspen Plus (RADFRAC)
(Profile Inside the Column)
Click Plot
Click Plot
214