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SAJJAD KHUDHUR ABBAS
Chemical Engineering , Al-Muthanna University, Iraq
Oil & Gas Safety and Health Professional – OSHACADEMY
Trainer of Trainers (TOT) - Canadian Center of Human
Development
Episode 7 : iCON
Basic Training
© 2012 PETROLIAM NASIONAL BERHAD (PETRONAS)
SKG 16 - iCON Basic Training – Itinerary
2
Day Training Modules
22 October 2013 Slides presentation
1. Compressor Train
2. Demethanizer Column
3. Fractionation Train
4. Propane Loop
5. Steam Reformer
23 October 2013 1. Oil Characterization
2. Refinery Separation
3. Amine System
24 October 2013 1. Utility Optimizer Module 1
2. Utility Optimizer Module 2
3. Column Optimization
4. Property Regression
2013 PETROLIAM NASIONAL BERHAD (PETRONAS)
© 2012 PETROLIAM NASIONAL BERHAD (PETRONAS)
Outline
3
• Introduction to Process Simulation
• iCON Software
• Thermodynamic Property Package
• Modeling Approach
• Hands On Training
2013 PETROLIAM NASIONAL BERHAD (PETRONAS)
4
Introduction to Process Simulation
Introduction
Process simulation is the representation/replication of the real world
process behavior through mathematical models.
Process Simulator is a software that predicts the condition, composition
and properties of a particular point (stream) from an initial condition through
mass and energy balances and thermodynamic principles.
iCON is based squarely on fundamental thermodynamic principles
(equation based).
These principles are used in two main features of the process simulator:
 The thermodynamic calculation engine
 The simulation solver for unit operation and flowsheet.
Introduction
 The thermodynamic engine provides:
 Rigorous thermodynamic equilibrium and physical property estimation
for industrially important systems
The simulation solver continually monitors:
 The degrees of freedom of the flow sheet,
 Immediately invokes the necessary calculations when the degrees of
freedom are complete,
 Solved the system of equations describing the flow sheet.
© 2012 PETROLIAM NASIONAL BERHAD (PETRONAS)
Steady State Vs Dynamics
7
Steady State Dynamic
Mass & Energy
Balance
Always balance Not always balance
Time dependence No Yes
Accumulation i.e.
level simulation
No Yes
Equipment
dimension
Not required Required
Pressure profile No impact Impacts flow
Typical applications • Process Design
•Equipment Rating & Monitoring
• Utility Balance
• Process Control Optimization
• Plant Startup & Shutdown
•Operator Training Simulator
© 2012 PETROLIAM NASIONAL BERHAD (PETRONAS) 8
Process Simulation & Optimization Cycle
1
2
3
45
9
PETRONAS Official Process Simulation Software
© 2012 PETROLIAM NASIONAL BERHAD (PETRONAS)
What is iCON?
10
iCON is an innovative steady-state &
dynamic simulation software modeling
tool for oil, gas, petrochemical, utilities
and power generation industries.
iCON is capable of solving a wide range
of engineering problems and is
industry driven. It has been proven in
reliability in oil gas production, oil
refinery, petrochemicals, utility &
power generation
11
Thermodynamic Property Package
© 2012 PETROLIAM NASIONAL BERHAD (PETRONAS) 12
Property Package
A property package is a collections of equations that define (given set of
physical conditions) :
1. State of matter i.e vapor/mix/liquid phase
2. Physical properties.
Derived by fitting experimental data.
© 2012 PETROLIAM NASIONAL BERHAD (PETRONAS)
Why proper property selection is crucial?
13
• To calculate the component properties at certain T&P (e.g. density, heat capacity etc.)
• To determine the phase of the component at certain T&P (e.g. V/L/V+L)
• To determine the in what proportion the component would exist in each phase (equilibrium)
• The accuracy of the calculated/simulated results will greatly depend on the accuracy of the
thermodynamic package prediction.
2013 PETROLIAM NASIONAL BERHAD (PETRONAS)
© 2012 PETROLIAM NASIONAL BERHAD (PETRONAS) 14
Types of Property Package
Equation of State Model
• Good for non polar
liquid and gas phase
since can calculate
critical point.
• Covers a wide
temperature & pressure
range
• Advance Peng-Robinson,
Soave-Redlich-Kwong
• Hydrocarbon application
Activity Coefficient Model
• Good to represent non-
ideal liquid due to
presence of polar
components, but cannot
predict critical point
• Limited T & P range
• Non Random Two
Liquids (NRTL), UNIFAC,
UNIQUAC, Wilson
• Chemicals with high
polarity i.e. water,
alcohol
Special Packages
• Customized to represent
specific process which
may include kinetics
data in addition to
equilibrium data
• Limited T & P range
• Urea, Amine, Steam97
© 2012 PETROLIAM NASIONAL BERHAD (PETRONAS)
Property Package Selection Guideline
15
PETRONAS Technical Standards : Property Package Selection
(PTS 20.00.10.37 ) is available in AXIS
© 2012 PETROLIAM NASIONAL BERHAD (PETRONAS) 16
Example
Objective:
To give an indication of NH3 purity, an online calculation can be implemented as part of
ELMS, to enable operators to take necessary action to drain any contaminants i.e.
compressor oil from NH3.
Actual saturation Pressure &
Temperature
Actual saturation Pressure &
Temperature
© 2012 PETROLIAM NASIONAL BERHAD (PETRONAS) 17
Example
• The figure above shows multiple plots of pure NH3 using 21 different
thermodynamic packages and a plot of actual DCS data.
• Lee-Kesler-Plöcker (LKP) is found to be the best suited thermo-package.
1400
1450
1500
1550
1600
1650
1700
33 34 35 36 37 38 39 40
Pressure(kPaA)
Temp (deg C)
Pure Ammonia Temp VS Pressure
APR
APR-NG
Refinery SRK
APR-LK
NGL-PR
API SOUR
CHAO SEADER
GRAYSON
STREED
MAXWELL
BONELL
LKP
UNIQUAC
wilson
TK-WILSON
NRTL
VAN LAAR
Actual
DCS data
NGL-PR
Thermo
Lee Kesler
Plocker
Thermo
18
Modeling Approach
© 2012 PETROLIAM NASIONAL BERHAD (PETRONAS)
Modeling Approach – Degree of Freedom
19
Unit Operation in
iCON
Degree of Freedom • No. of specification required for the calculation to complete
• Inadequate specification  calculation will not progress
• Overspecified  inconsistency error will created
2013 PETROLIAM NASIONAL BERHAD (PETRONAS)
© 2012 PETROLIAM NASIONAL BERHAD (PETRONAS)
Modeling Approach – Degree of Freedom
20
Unit Operation Typical Specification
Stream Pressure, Temperature, Flow, Composition
Separator With feed stream, separator will converged without having to
specify anything
Cooler/Heater With feed stream, user needs to specify either:
1. Temperature outlet, Delta P
2. Temperature outlet, Pressure outlet
Heat Exchanger User needs to have both fluids properties (2 streams; shell
and tube)
Other specifications are similar to cooler/heater
Compressor/Pump
/Expander
With feed stream, user needs to specify either:
1. Pressure outlet, Efficiency
2. Pressure outlet, Temperature outlet
If with compressor curve, speed is required as specification
2013 PETROLIAM NASIONAL BERHAD (PETRONAS)
21
Hands-on Training..
22
Desktop
23
New file..
24
#1 Property package: Advance Peng Robinson
#2 Add components:
Water; Nitrogen; Carbon Dioxide; Methane; Ethane; Propane; iso-Butane; n-Butane;
iso-Pentane; n-Pentane; n-Hexane;
h2o;n2;co2;c1;c2;c3;ic4;nc4;ic5;nc5;nc6;
1 Water
2 Nitrogen
3 Carbon
Dioxide;
4 Methane
5 Ethane
6 Propane
7 Iso-Butane
8 n-Butane
9 iso-Pentane
10 n-Pentane
11 n-Hexane
25
#1 Property package: Advance Peng Robinson
#2 Add components:
Water; Nitrogen; Carbon Dioxide; Methane; Ethane; Propane; iso-Butane; n-Butane;
iso-Pentane; n-Pentane; n-Hexane;
h2o;n2;co2;c1;c2;c3;ic4;nc4;ic5;nc5;nc6;
1 Water
2 Nitrogen
3 Carbon
Dioxide;
4 Methane
5 Ethane
6 Propane
7 Iso-Butane
8 n-Butane
9 iso-Pentane
10 n-Pentane
11 n-Hexane
26
#3 Flash a material stream
Unit
Temperature Deg C 30
Pressure Kpa 1000
Mass Flow Kg/h 125
Water Mol %
1
Nitrogen Mol %
0.5
Carbon
Dioxide;
Mol %
0.5
Methane Mol %
1
Ethane Mol %
1
Propane Mol %
5
Iso-Butane Mol %
45
n-Butane Mol %
40
iso-Pentane Mol %
2
n-Pentane Mol %
2
n-Hexane Mol %
2
27
# 4 Flash options
P-T Flash
Vapor Fraction (VF)
Flash Calculation
P-H Flash
Temperature , Pressure , Flow ,Composition
Enthalpy, Pressure , Flow ,Composition
Vapor Fraction, Pressure , Flow ,Composition
28
# 5 Pseudo component: Min data: Normal Boiling Point or Molecular Weight + Liquid Density
29
Getting started
Starting iCON from desktop.
Selecting thermo.
Selecting components.
Converging a stream.
Units.
Bubble / dew points.
Phase diagram.
Special properties.
Making a copy
• Spec from
•Clone
•Copy stream
•Show datasheet
•Table
•Writing
Controller
• Temperature control
Process Calculator
•Totalizer
Pseudo component
Ammonia ref – choosing thermo
© 2012 PETROLIAM NASIONAL BERHAD (PETRONAS)
Modeling Approach – Data Propagation
30
• In port has a mass flow
of 200 kg/hr (mole flow =
4.84 kg-mole/hr)
• Since the cooler has a
single In and a single Out
material port:
No accumulation
of matter
 No chemical
reactions
•Therefore, the:
Mole Flow
Mass Flow
of In and Out port must be
IDENTICAL
2013 PETROLIAM NASIONAL BERHAD (PETRONAS)
© 2012 PETROLIAM NASIONAL BERHAD (PETRONAS)
Modeling Approach – Data Propagation
31
• Note that even though
the mole and mass flows are
NOT known, the
thermodynamic state of the
In port IS known.
• Click on the
node and inspect the
physical properties of the In
port.
• Now click on the (Mass
Flow, In) cell and press the
<Delete> key.
• You will notice that the
since the mass flow is not
specified, the mole flow is
automatically forgotten.
2013 PETROLIAM NASIONAL BERHAD (PETRONAS)
© 2012 PETROLIAM NASIONAL BERHAD (PETRONAS)
Modeling Approach – Data Propagation
32
• Click on the (MassFlow,
Out) cell and specify a
mass flow of 2000 kg/h as
shown below
• Hit the <Enter> key
2013 PETROLIAM NASIONAL BERHAD (PETRONAS)
© 2012 PETROLIAM NASIONAL BERHAD (PETRONAS)
Modeling Approach – Data Propagation
33
• Note that the Out port
mass flow is now specified
(blue background),
• And the mole flow is
automatically calculated at
4.84 kgmole/h.
• Also, note that the
available information is
propagated backwards to
the In port.
2013 PETROLIAM NASIONAL BERHAD (PETRONAS)
© 2012 PETROLIAM NASIONAL BERHAD (PETRONAS)
34
Flash Calculations • Rigorous three-phase calculations except for Wilson (only vapor
liquid)
• Type of flash calculation based on degree of freedom concept
depending on specifications imposed on the system
• Independent Variables: Pressure (P), Enthalpy (H)
• Dependent Variables: vapor fraction, Temperature and entropy
P-T Flash
• Independent Variables: Vapor Fraction (VF) and Temperature (T)
or Vapor Fraction (VF) and Pressure (P)
• Dependent Variables: Pressure (P) or Temperature (T) and
enthalpy and entropy
• Examples:
• Dew Points: VF = 1.0, and either P or T
• Bubble Points: VF = 0.0, and either P or T
Vapor Fraction (VF)
Flash Calculation
• Independent Variables: Temperature (T), Pressure (P)
• Dependent Variables: vapor fraction, enthalpy and entropy
P-H Flash
2013 PETROLIAM NASIONAL BERHAD (PETRONAS)
35
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Episode 7 : iCON Basic Training

  • 1. 1 SAJJAD KHUDHUR ABBAS Chemical Engineering , Al-Muthanna University, Iraq Oil & Gas Safety and Health Professional – OSHACADEMY Trainer of Trainers (TOT) - Canadian Center of Human Development Episode 7 : iCON Basic Training
  • 2. © 2012 PETROLIAM NASIONAL BERHAD (PETRONAS) SKG 16 - iCON Basic Training – Itinerary 2 Day Training Modules 22 October 2013 Slides presentation 1. Compressor Train 2. Demethanizer Column 3. Fractionation Train 4. Propane Loop 5. Steam Reformer 23 October 2013 1. Oil Characterization 2. Refinery Separation 3. Amine System 24 October 2013 1. Utility Optimizer Module 1 2. Utility Optimizer Module 2 3. Column Optimization 4. Property Regression 2013 PETROLIAM NASIONAL BERHAD (PETRONAS)
  • 3. © 2012 PETROLIAM NASIONAL BERHAD (PETRONAS) Outline 3 • Introduction to Process Simulation • iCON Software • Thermodynamic Property Package • Modeling Approach • Hands On Training 2013 PETROLIAM NASIONAL BERHAD (PETRONAS)
  • 5. Introduction Process simulation is the representation/replication of the real world process behavior through mathematical models. Process Simulator is a software that predicts the condition, composition and properties of a particular point (stream) from an initial condition through mass and energy balances and thermodynamic principles. iCON is based squarely on fundamental thermodynamic principles (equation based). These principles are used in two main features of the process simulator:  The thermodynamic calculation engine  The simulation solver for unit operation and flowsheet.
  • 6. Introduction  The thermodynamic engine provides:  Rigorous thermodynamic equilibrium and physical property estimation for industrially important systems The simulation solver continually monitors:  The degrees of freedom of the flow sheet,  Immediately invokes the necessary calculations when the degrees of freedom are complete,  Solved the system of equations describing the flow sheet.
  • 7. © 2012 PETROLIAM NASIONAL BERHAD (PETRONAS) Steady State Vs Dynamics 7 Steady State Dynamic Mass & Energy Balance Always balance Not always balance Time dependence No Yes Accumulation i.e. level simulation No Yes Equipment dimension Not required Required Pressure profile No impact Impacts flow Typical applications • Process Design •Equipment Rating & Monitoring • Utility Balance • Process Control Optimization • Plant Startup & Shutdown •Operator Training Simulator
  • 8. © 2012 PETROLIAM NASIONAL BERHAD (PETRONAS) 8 Process Simulation & Optimization Cycle 1 2 3 45
  • 9. 9 PETRONAS Official Process Simulation Software
  • 10. © 2012 PETROLIAM NASIONAL BERHAD (PETRONAS) What is iCON? 10 iCON is an innovative steady-state & dynamic simulation software modeling tool for oil, gas, petrochemical, utilities and power generation industries. iCON is capable of solving a wide range of engineering problems and is industry driven. It has been proven in reliability in oil gas production, oil refinery, petrochemicals, utility & power generation
  • 12. © 2012 PETROLIAM NASIONAL BERHAD (PETRONAS) 12 Property Package A property package is a collections of equations that define (given set of physical conditions) : 1. State of matter i.e vapor/mix/liquid phase 2. Physical properties. Derived by fitting experimental data.
  • 13. © 2012 PETROLIAM NASIONAL BERHAD (PETRONAS) Why proper property selection is crucial? 13 • To calculate the component properties at certain T&P (e.g. density, heat capacity etc.) • To determine the phase of the component at certain T&P (e.g. V/L/V+L) • To determine the in what proportion the component would exist in each phase (equilibrium) • The accuracy of the calculated/simulated results will greatly depend on the accuracy of the thermodynamic package prediction. 2013 PETROLIAM NASIONAL BERHAD (PETRONAS)
  • 14. © 2012 PETROLIAM NASIONAL BERHAD (PETRONAS) 14 Types of Property Package Equation of State Model • Good for non polar liquid and gas phase since can calculate critical point. • Covers a wide temperature & pressure range • Advance Peng-Robinson, Soave-Redlich-Kwong • Hydrocarbon application Activity Coefficient Model • Good to represent non- ideal liquid due to presence of polar components, but cannot predict critical point • Limited T & P range • Non Random Two Liquids (NRTL), UNIFAC, UNIQUAC, Wilson • Chemicals with high polarity i.e. water, alcohol Special Packages • Customized to represent specific process which may include kinetics data in addition to equilibrium data • Limited T & P range • Urea, Amine, Steam97
  • 15. © 2012 PETROLIAM NASIONAL BERHAD (PETRONAS) Property Package Selection Guideline 15 PETRONAS Technical Standards : Property Package Selection (PTS 20.00.10.37 ) is available in AXIS
  • 16. © 2012 PETROLIAM NASIONAL BERHAD (PETRONAS) 16 Example Objective: To give an indication of NH3 purity, an online calculation can be implemented as part of ELMS, to enable operators to take necessary action to drain any contaminants i.e. compressor oil from NH3. Actual saturation Pressure & Temperature Actual saturation Pressure & Temperature
  • 17. © 2012 PETROLIAM NASIONAL BERHAD (PETRONAS) 17 Example • The figure above shows multiple plots of pure NH3 using 21 different thermodynamic packages and a plot of actual DCS data. • Lee-Kesler-Plöcker (LKP) is found to be the best suited thermo-package. 1400 1450 1500 1550 1600 1650 1700 33 34 35 36 37 38 39 40 Pressure(kPaA) Temp (deg C) Pure Ammonia Temp VS Pressure APR APR-NG Refinery SRK APR-LK NGL-PR API SOUR CHAO SEADER GRAYSON STREED MAXWELL BONELL LKP UNIQUAC wilson TK-WILSON NRTL VAN LAAR Actual DCS data NGL-PR Thermo Lee Kesler Plocker Thermo
  • 19. © 2012 PETROLIAM NASIONAL BERHAD (PETRONAS) Modeling Approach – Degree of Freedom 19 Unit Operation in iCON Degree of Freedom • No. of specification required for the calculation to complete • Inadequate specification  calculation will not progress • Overspecified  inconsistency error will created 2013 PETROLIAM NASIONAL BERHAD (PETRONAS)
  • 20. © 2012 PETROLIAM NASIONAL BERHAD (PETRONAS) Modeling Approach – Degree of Freedom 20 Unit Operation Typical Specification Stream Pressure, Temperature, Flow, Composition Separator With feed stream, separator will converged without having to specify anything Cooler/Heater With feed stream, user needs to specify either: 1. Temperature outlet, Delta P 2. Temperature outlet, Pressure outlet Heat Exchanger User needs to have both fluids properties (2 streams; shell and tube) Other specifications are similar to cooler/heater Compressor/Pump /Expander With feed stream, user needs to specify either: 1. Pressure outlet, Efficiency 2. Pressure outlet, Temperature outlet If with compressor curve, speed is required as specification 2013 PETROLIAM NASIONAL BERHAD (PETRONAS)
  • 24. 24 #1 Property package: Advance Peng Robinson #2 Add components: Water; Nitrogen; Carbon Dioxide; Methane; Ethane; Propane; iso-Butane; n-Butane; iso-Pentane; n-Pentane; n-Hexane; h2o;n2;co2;c1;c2;c3;ic4;nc4;ic5;nc5;nc6; 1 Water 2 Nitrogen 3 Carbon Dioxide; 4 Methane 5 Ethane 6 Propane 7 Iso-Butane 8 n-Butane 9 iso-Pentane 10 n-Pentane 11 n-Hexane
  • 25. 25 #1 Property package: Advance Peng Robinson #2 Add components: Water; Nitrogen; Carbon Dioxide; Methane; Ethane; Propane; iso-Butane; n-Butane; iso-Pentane; n-Pentane; n-Hexane; h2o;n2;co2;c1;c2;c3;ic4;nc4;ic5;nc5;nc6; 1 Water 2 Nitrogen 3 Carbon Dioxide; 4 Methane 5 Ethane 6 Propane 7 Iso-Butane 8 n-Butane 9 iso-Pentane 10 n-Pentane 11 n-Hexane
  • 26. 26 #3 Flash a material stream Unit Temperature Deg C 30 Pressure Kpa 1000 Mass Flow Kg/h 125 Water Mol % 1 Nitrogen Mol % 0.5 Carbon Dioxide; Mol % 0.5 Methane Mol % 1 Ethane Mol % 1 Propane Mol % 5 Iso-Butane Mol % 45 n-Butane Mol % 40 iso-Pentane Mol % 2 n-Pentane Mol % 2 n-Hexane Mol % 2
  • 27. 27 # 4 Flash options P-T Flash Vapor Fraction (VF) Flash Calculation P-H Flash Temperature , Pressure , Flow ,Composition Enthalpy, Pressure , Flow ,Composition Vapor Fraction, Pressure , Flow ,Composition
  • 28. 28 # 5 Pseudo component: Min data: Normal Boiling Point or Molecular Weight + Liquid Density
  • 29. 29 Getting started Starting iCON from desktop. Selecting thermo. Selecting components. Converging a stream. Units. Bubble / dew points. Phase diagram. Special properties. Making a copy • Spec from •Clone •Copy stream •Show datasheet •Table •Writing Controller • Temperature control Process Calculator •Totalizer Pseudo component Ammonia ref – choosing thermo
  • 30. © 2012 PETROLIAM NASIONAL BERHAD (PETRONAS) Modeling Approach – Data Propagation 30 • In port has a mass flow of 200 kg/hr (mole flow = 4.84 kg-mole/hr) • Since the cooler has a single In and a single Out material port: No accumulation of matter  No chemical reactions •Therefore, the: Mole Flow Mass Flow of In and Out port must be IDENTICAL 2013 PETROLIAM NASIONAL BERHAD (PETRONAS)
  • 31. © 2012 PETROLIAM NASIONAL BERHAD (PETRONAS) Modeling Approach – Data Propagation 31 • Note that even though the mole and mass flows are NOT known, the thermodynamic state of the In port IS known. • Click on the node and inspect the physical properties of the In port. • Now click on the (Mass Flow, In) cell and press the <Delete> key. • You will notice that the since the mass flow is not specified, the mole flow is automatically forgotten. 2013 PETROLIAM NASIONAL BERHAD (PETRONAS)
  • 32. © 2012 PETROLIAM NASIONAL BERHAD (PETRONAS) Modeling Approach – Data Propagation 32 • Click on the (MassFlow, Out) cell and specify a mass flow of 2000 kg/h as shown below • Hit the <Enter> key 2013 PETROLIAM NASIONAL BERHAD (PETRONAS)
  • 33. © 2012 PETROLIAM NASIONAL BERHAD (PETRONAS) Modeling Approach – Data Propagation 33 • Note that the Out port mass flow is now specified (blue background), • And the mole flow is automatically calculated at 4.84 kgmole/h. • Also, note that the available information is propagated backwards to the In port. 2013 PETROLIAM NASIONAL BERHAD (PETRONAS)
  • 34. © 2012 PETROLIAM NASIONAL BERHAD (PETRONAS) 34 Flash Calculations • Rigorous three-phase calculations except for Wilson (only vapor liquid) • Type of flash calculation based on degree of freedom concept depending on specifications imposed on the system • Independent Variables: Pressure (P), Enthalpy (H) • Dependent Variables: vapor fraction, Temperature and entropy P-T Flash • Independent Variables: Vapor Fraction (VF) and Temperature (T) or Vapor Fraction (VF) and Pressure (P) • Dependent Variables: Pressure (P) or Temperature (T) and enthalpy and entropy • Examples: • Dew Points: VF = 1.0, and either P or T • Bubble Points: VF = 0.0, and either P or T Vapor Fraction (VF) Flash Calculation • Independent Variables: Temperature (T), Pressure (P) • Dependent Variables: vapor fraction, enthalpy and entropy P-H Flash 2013 PETROLIAM NASIONAL BERHAD (PETRONAS)
  • 35. 35 Thanks for Watching Please follow me / SAJJAD KHUDHUR ABBAS