CHEMCAD 6 User Guide 2012 PDF

CHEMCAD Version 6
User Guide
Allmaterial2012Chemstations,Inc.
CHEMCAD Version 6 User Guide
Table of Contents
Chapter1IntroductiontoCHEMCAD .............................................................................................. 1
OverviewofCHEMCADandItsUses ................................................................................................ 1
CHEMCADProductsandFeatures ................................................................................................. 3
CC-STEADY STATE .......................................................................................................................................3
CC-DYNAMICS ...............................................................................................................................................3
CC-BATCH .......................................................................................................................................................3
CC-THERM.......................................................................................................................................................3
CC-SAFETY NET.............................................................................................................................................3
CC-FLASH........................................................................................................................................................3
CHEMCADFeaturesbyModule...................................................................................................... 4
UnitOpsbyModule............................................................................................................................ 5
Chapter2GettingStartedwithCHEMCAD..................................................................................... 7
InstallingtheSoftware ........................................................................................................................... 7
LicensingCHEMCAD ......................................................................................................................... 10
TypesofCHEMCADLicenses........................................................................................................ 10
LicenseSettings ................................................................................................................................. 11
UpdatingaLicense ........................................................................................................................... 13
GettingHelpwithCHEMCAD .......................................................................................................... 15
OnlineHelp ....................................................................................................................................... 15
CHEMCADCoach............................................................................................................................ 15
ProcedureDemos.............................................................................................................................. 16
TheChemstationsWebSite............................................................................................................. 16
CHEMCADVersion6UserGuide
TableofContents
ContactingChemstationsTechnicalSupport ............................................................................... 16
Chapter3TheCHEMCADInterface................................................................................................ 17
TheCHEMCADWindow ................................................................................................................... 17
TheWorkspace.................................................................................................................................. 18
TheCHEMCADExplorerPane ...................................................................................................... 18
The Recent Files Tab .......................................................................................................................................19
The Simulation Tab .........................................................................................................................................19
The Visual Basic Tab.......................................................................................................................................20
ThePalettePane ................................................................................................................................ 20
Selecting a Palette............................................................................................................................................20
Customizing Palettes .......................................................................................................................................21
TheMessagesPane ........................................................................................................................... 22
The Errors and Warnings Tab..........................................................................................................................22
The Run Trace Tab ..........................................................................................................................................22
The Notes Tab .................................................................................................................................................23
TheMainMenu................................................................................................................................. 23
TheToolbar........................................................................................................................................ 23
CustomizingtheCHEMCADScreen................................................................................................. 24
ViewingandHidingScreenElements ........................................................................................... 24
ResizingandMovingItems............................................................................................................. 24
Resizing a Pane................................................................................................................................................24
Moving a Pane .................................................................................................................................................25
PinningandUnpinningPanes........................................................................................................ 25
OtherUsefulInterfaceHints............................................................................................................... 26
UndoandRedo ................................................................................................................................. 26
VisibleGrid........................................................................................................................................ 27
AdjustingYourViewoftheWorkspace........................................................................................ 27
TheCHEMCADCoachPane .......................................................................................................... 27
Chapter4WorkingwithSimulationFiles ...................................................................................... 29
AboutCHEMCADSimulationFiles.................................................................................................. 29
UserComponentsinCHEMCAD .................................................................................................. 30
ExampleFiles..................................................................................................................................... 30
OpeninganExistingSimulation ........................................................................................................ 31
CreatingaNewSimulation................................................................................................................. 31
SavingaSimulation.............................................................................................................................. 32
SavingDifferentCasesfortheSameSimulation.......................................................................... 32
EmailingaSimulation ........................................................................................................................ 33
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WorkingwithCHEMCADFilesfromPreviousVersions .............................................................. 34
Chapter5BuildingandUsingaBasicSimulation......................................................................... 35
StartingaNewSimulation .................................................................................................................. 35
SelectingEngineeringUnits................................................................................................................ 36
DrawingtheFlowsheet........................................................................................................................ 36
AddingUnitOps ............................................................................................................................... 36
Selecting a Default Icon for a UnitOp .............................................................................................................37
Manipulating UnitOp Icons .............................................................................................................................38
UnitOp ID Numbers ........................................................................................................................................38
DrawingandConnectingaStream ................................................................................................ 39
Choosing a Stream Route ................................................................................................................................39
Rerouting a Stream ..........................................................................................................................................40
Stream ID Numbers .........................................................................................................................................40
OtherDrawingTools........................................................................................................................ 41
The Text Tool ..................................................................................................................................................41
Simple Drawing Tools: Rectangle, Ellipse, and Line ......................................................................................41
Complex Drawing Tools: Multi-line and Polygon ..........................................................................................41
SelectingChemicalComponents........................................................................................................ 42
FindingaComponent ...................................................................................................................... 43
AddingaComponent....................................................................................................................... 44
ChangingtheOrderofSelectedComponents .............................................................................. 45
RemovingItemsfromtheSelectedComponentsList ................................................................. 45
SelectingKvalueandEnthalpyOptions .......................................................................................... 46
UsingtheThermodynamicsWizard .............................................................................................. 46
Selecting Components to Ignore......................................................................................................................46
Specifying Process Conditions ........................................................................................................................46
How the Thermodynamics Wizard Makes Suggestions ..................................................................................46
Should the Thermodynamics Wizard be trusted to make design decisions? ...................................................47
ManuallySelectingThermodynamicsSettings ............................................................................ 47
DefiningStreams .................................................................................................................................. 48
ThermodynamicProperties............................................................................................................. 48
StreamComposition ......................................................................................................................... 49
TotalFlowProperties ....................................................................................................................... 49
SpecifyingEquipmentParameters..................................................................................................... 49
RunningtheSimulation....................................................................................................................... 50
ReviewingtheResults.......................................................................................................................... 51
Chapter6UsingCHEMCADforHighfidelityModeling ........................................................... 53
Whatishighfidelitymodeling?......................................................................................................... 53
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CriteriaforHighfidelityModeling ................................................................................................... 54
IntroductiontoEquipmentSizing ..................................................................................................... 54
HighfidelityModelingandSizingforCommonUnitOps ............................................................ 55
Piping.................................................................................................................................................. 55
Low-fidelity .....................................................................................................................................................55
Sizing...............................................................................................................................................................55
High-fidelity ....................................................................................................................................................56
Pumps,Compressors,andExpanders ........................................................................................... 56
Low-fidelity .....................................................................................................................................................56
High-fidelity ....................................................................................................................................................56
VesselsandTanks............................................................................................................................. 56
Low-fidelity .....................................................................................................................................................56
Sizing...............................................................................................................................................................57
High-fidelity ....................................................................................................................................................57
Valves ................................................................................................................................................. 57
Low-fidelity .....................................................................................................................................................57
Sizing...............................................................................................................................................................58
High-fidelity ....................................................................................................................................................58
Columns ............................................................................................................................................. 58
Low-fidelity .....................................................................................................................................................58
Sizing...............................................................................................................................................................58
High-fidelity ....................................................................................................................................................60
HeatExchangers ............................................................................................................................... 60
Low-fidelity .....................................................................................................................................................60
Sizing...............................................................................................................................................................60
High-fidelity ....................................................................................................................................................60
ReliefDevices .................................................................................................................................... 61
Low-fidelity .....................................................................................................................................................61
High-fidelity ....................................................................................................................................................62
LicensingConsiderationsforHighfidelityModeling.................................................................... 62
Chapter7BuildingandUsingaDynamicSimulation ................................................................. 63
Whatdowemeanbydynamics? ....................................................................................................... 63
LicensingConsiderations .................................................................................................................... 63
AdditionalInputforDynamicOperation......................................................................................... 64
StrategiesforDynamicSimulations ............................................................................................... 65
SettingUpDynamicOperation .......................................................................................................... 65
SwitchingtoDynamics .................................................................................................................... 65
SettingtheRunTime ........................................................................................................................ 66
SelectingStreamsandUnitOps ...................................................................................................... 68
RunningaDynamicSimulation ......................................................................................................... 69
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RunfromInitialState ....................................................................................................................... 69
RunfromCurrentState.................................................................................................................... 69
RunOneStepataTime ................................................................................................................... 70
OtherDynamicCommands ................................................................................................................ 70
ResettoInitialState .......................................................................................................................... 70
SaveAsInitialState .......................................................................................................................... 71
OutputfromDynamicSimulations ................................................................................................... 71
ReviewingtheFlowsheetSpecifications........................................................................................ 72
PlottingDynamicResults ................................................................................................................ 72
TextbasedDynamicReports .......................................................................................................... 72
Chapter8OutputandReports........................................................................................................... 75
TextReports .......................................................................................................................................... 75
ReportOutputSetup ........................................................................................................................ 75
StreambasedReports....................................................................................................................... 76
Stream Groups .................................................................................................................................................76
Stream Compositions.......................................................................................................................................78
Stream Properties.............................................................................................................................................79
Particle Size Distribution.................................................................................................................................80
Pseudocomponent Curves................................................................................................................................80
UnitOpbasedReports...................................................................................................................... 80
UnitOp Groups ................................................................................................................................................80
Select UnitOps.................................................................................................................................................81
Spec Sheet........................................................................................................................................................82
Distillation .......................................................................................................................................................82
FlowsheetbasedReports ................................................................................................................. 83
Topology..........................................................................................................................................................83
Thermodynamics .............................................................................................................................................83
Mass and Energy Balances ..............................................................................................................................83
DynamicsReports............................................................................................................................. 83
Batch Results ...................................................................................................................................................83
Dynamics .........................................................................................................................................................83
ConsolidatedReportsandtheCHEMCADReportWriter......................................................... 84
Choosing and Ordering Report Sections..........................................................................................................84
Selecting Flowsheet Elements .........................................................................................................................85
Formatting Report Sections .............................................................................................................................85
Naming the Report and Choosing a Destination..............................................................................................86
GraphicalReports................................................................................................................................. 87
ThermophysicalDataGraphs ......................................................................................................... 87
TPXY...............................................................................................................................................................87
Binary LLE ......................................................................................................................................................87
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Binodal Plot .....................................................................................................................................................87
Binodal/Residue Curves ..................................................................................................................................87
Residue Curves ................................................................................................................................................88
Solid/Liquid Equilibrium.................................................................................................................................88
FlowsheetbasedGraphs.................................................................................................................. 88
UnitOpbasedPlots .......................................................................................................................... 88
Column Profiles ...............................................................................................................................................88
Heat Curves .....................................................................................................................................................88
Plug Flow Reactor Profile ...............................................................................................................................88
Pipe Profile ......................................................................................................................................................88
Controller Convergence...................................................................................................................................89
DynamicPlots ................................................................................................................................... 89
UserspecifiedFile ............................................................................................................................ 89
PrintingCHEMCADReports ............................................................................................................. 89
ProcessFlowDiagrams ....................................................................................................................... 90
FlowsheetDataboxes........................................................................................................................ 90
Stream Boxes...................................................................................................................................................90
UnitOp Boxes ..................................................................................................................................................91
TP Boxes .........................................................................................................................................................91
Excel Range Boxes ..........................................................................................................................................92
UsingtheLayersFeatureforSelectiveViewingandPrinting ................................................... 93
Scenarios for Using Layers..............................................................................................................................93
Creating a New layer .......................................................................................................................................94
Assigning Objects to a Layer...........................................................................................................................95
Hiding and Viewing Layers.............................................................................................................................95
Removing an Object from a Layer ..................................................................................................................96
Deleting an Entire Layer..................................................................................................................................96
PrintingaProcessFlowDiagram ................................................................................................... 96
Chapter9CustomizingCHEMCAD ................................................................................................ 99
FlowsheetTemplates ........................................................................................................................... 99
CreatingaTemplate ....................................................................................................................... 100
ViewingaTemplatesProperties.................................................................................................. 100
ApplyingaTemplate...................................................................................................................... 100
RenamingorDeletingaTemplate................................................................................................ 100
CreatingCustomComponents ......................................................................................................... 101
AddingaSingleComponent......................................................................................................... 101
Creating the Component ................................................................................................................................101
Regressing Data into the Component ............................................................................................................104
PseudocomponentRange .............................................................................................................. 105

ImportingaNeutralFile ................................................................................................................ 106
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CreatingaCustomSymbol ............................................................................................................... 107

CustomizedCostingCalculations.................................................................................................... 109
CreatingCustomUnitOps ................................................................................................................ 109
CreatingaCustomUnitOpDialogBox ....................................................................................... 110
CustomizingThermodynamics ........................................................................................................ 111
CreatingaCustomKvalueorEnthalpyModel......................................................................... 111
CreatingaCustomMixingRule ................................................................................................... 112
VisualBasicApplications(VBA)...................................................................................................... 113
DefiningaReaction,MixingRule,orUnitOp ............................................................................ 113
UsingaVBAdefinedReaction ..................................................................................................... 113
UsingaVBAdefinedMixingRule............................................................................................... 114
UsingaVBAdefinedUnitOp ....................................................................................................... 115
Chapter10DataInterfaces ............................................................................................................... 117
ExcelDataMapping........................................................................................................................... 118
CreatinganExcelDataMap.......................................................................................................... 118
DataMapExecutionRules ............................................................................................................ 121
CreatingExcelUnitOps ..................................................................................................................... 123
SpecificationSheets ............................................................................................................................ 124
UsingCHEMCADasanOPCServer .............................................................................................. 125
OPCApplications ........................................................................................................................... 125
OPCCompliance............................................................................................................................. 125
EnablingCHEMCADasanOPCServer ..................................................................................... 125
ReadingandWritingValuestoCHEMCADUsingOPC ......................................................... 126
OPCServerOperations.................................................................................................................. 126
CHEMCADOPCNamespace ....................................................................................................... 127
COMInterfaces ................................................................................................................................... 128
ConnectingExcelandCHEMCAD:ASimpleCOMInterface ................................................. 128
Using the VBClient Example ........................................................................................................................129
A Peek under the Hood..................................................................................................................................129
Chapter11CHEMCADTutorials ................................................................................................... 131

CCSTEADYSTATETutorial ........................................................................................................... 132
Overview.......................................................................................................................................... 132
StartingaNewSimulation ............................................................................................................ 133
SelectingEngineeringUnits .......................................................................................................... 133
DrawingtheFlowsheet .................................................................................................................. 133
Placing UnitOps.............................................................................................................................................133
Drawing Streams ...........................................................................................................................................136
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SelectingComponents.................................................................................................................... 136
SelectingThermodynamicOptions.............................................................................................. 138
DefiningtheFeedStreams............................................................................................................. 140
EnterUnitOpParameters .............................................................................................................. 142
First Heat Exchanger .....................................................................................................................................142
Second Heat Exchanger.................................................................................................................................143
Flash Drum ....................................................................................................................................................143
Valve..............................................................................................................................................................143
Stabilizer Tower ............................................................................................................................................144
RuntheSimulation ......................................................................................................................... 144

ReviewtheResultsandPrintasNeeded..................................................................................... 144
Checking the Cricondentherm Dewpoint.......................................................................................................144
Checking the Bottoms Stream Purity.............................................................................................................147
Re-running the Simulation.............................................................................................................................148
Producing a Text Report................................................................................................................................149
Generating a Process Flow Diagram..............................................................................................................150
CCTHERMTutorial .......................................................................................................................... 153

OverviewoftheHeatExchangerSizingProcess ....................................................................... 154
IdentifytheTubesideStream....................................................................................................... 154
GeneratetheHeatCurve ............................................................................................................... 155
DefineGeneralSpecifications ....................................................................................................... 156
SetTubeSpecifications................................................................................................................... 157
SetShellSpecifications ................................................................................................................... 157
SetBaffleSpecifications.................................................................................................................. 158
Baffle Spacing ...............................................................................................................................................158
Baffle Cut Percent .........................................................................................................................................158
SetNozzleSpecifications ............................................................................................................... 159

SetClearanceSpecifications .......................................................................................................... 159
SetMaterialSpecifications............................................................................................................. 160
SetMiscellaneousSpecifications................................................................................................... 160
RunSizingCalculations ................................................................................................................. 161
ReviewResultsandCreatePlots .................................................................................................. 161
CCBATCHTutorial .......................................................................................................................... 164
DescriptionoftheProblem............................................................................................................ 164
OverviewoftheBatchDistillationProcess ................................................................................. 165
CreatingaNewSimulation ........................................................................................................... 166
SelectingEngineeringUnits .......................................................................................................... 166
DrawingtheFlowsheet .................................................................................................................. 166
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Placing UnitOps.............................................................................................................................................166
Drawing Streams ...........................................................................................................................................167
SelectingComponents.................................................................................................................... 168
SelectingThermodynamicOptions.............................................................................................. 168
SpecifyingPotCharge.................................................................................................................... 170
SpecifyingtheDistillationColumn .............................................................................................. 172
DefiningtheOperatingSteps........................................................................................................ 173
Operating Step 1 ............................................................................................................................................173
Operating Step 2 ............................................................................................................................................174
Operating Step 3 ............................................................................................................................................174
Operating Step 4 ............................................................................................................................................175
Operating Step 5 ............................................................................................................................................175
The Run Time Information Dialog Box.........................................................................................................175
RunningtheSimulation ................................................................................................................. 176

ReviewingandPrintingResults ................................................................................................... 177
Plotting the Results ........................................................................................................................................177
Generating Text Reports................................................................................................................................178
Generating a Full Report ...............................................................................................................................178
PipingTutorial .................................................................................................................................... 180

ControlValveSizingExample ...................................................................................................... 180
Problem Statement.........................................................................................................................................180
Rating Case....................................................................................................................................................181
Flow Rate as a Function of Pressure..............................................................................................................183
SimpleFlowExample..................................................................................................................... 186
Creating the Simulation .................................................................................................................................186
Using Controllers to Simplify the Problem ...................................................................................................188
Calculating NPSHa........................................................................................................................................189
BranchedFlowExample ................................................................................................................ 190

Creating the Simulation .................................................................................................................................190
Running the Simulation .................................................................................................................................193
Selecting a Pump ...........................................................................................................................................193
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Chapter 1
Introduction to CHEMCAD
WelcometoCHEMCADVersion6,apowerfulandeffectivesoftwaretoolfor
chemicalprocesssimulation.WhetheryoureaneworexperiencedCHEMCADuser,
youllappreciatetheprogramsuserfriendly,featurerichinterface.Creating
flowsheetsandrunningsimulationsisfastandeasywithCHEMCAD,andthe
programishighlycustomizabletofityourneedsandthewayyouwork.
ThismanualwillhelpyougetupandrunningwithCHEMCAD,from
installationandlicensingtotutorialsthatwalkyouthroughrealworldexamples.
Overview of CHEMCAD and Its Uses

Todayschemicalprocessingindustry(CPI)facesnumerouschallenges:risingfuel
andfeedstockcosts,reducedengineeringstaff,shorterproductlifecycles,increased
globalcompetition,andincreasedregulation.ThesechallengesrequirethatCPI
companiesseekoutandusethebesttoolstoincreaseproductivityandimprove
engineeringdecisions.
CHEMCADisapowerfulandflexiblechemicalprocesssimulationenvironment,
builtaroundthreekeyvaluesofinnovation,integration,andopenarchitecture.
ThesevaluescreateimportantadvantagesforCHEMCADusers:
Thelatestchemicalengineeringtechniquesatyourfingertips
Allfunctionalityunitedinasinglesoftwareenvironment
Seamlessconnectiontothechemicalengineeringcomputingenvironment,with
linkstotoolssuchasMSExcelandWordandinterfacessuchasCOM,DCOM,
OPC,CAPEOPEN,andXML
IntroductiontoCHEMCAD
CHEMCADcombinesastateoftheartgraphicaluserinterface(GUI),an
extensivechemicalcomponentdatabase,alargelibraryofthermodynamicdata,and
alibraryofthemostcommonunitoperationstogiveuserstheabilitytoprovide
significantandmeasurablereturnsontheirinvestment.Inaddition,theprogramis
customizabletoallowcustomchemicals,thermodynamics,unitoperations,
calculations,andreportingallingredientsforapowerfuluserexperience.
CHEMCADiscapableofmodelingcontinuous,batch,andsemibatchprocesses,
anditcansimulatebothsteadystateanddynamicsystems.Thisprogramisused
extensivelyaroundtheworldforthedesign,operation,andmaintenanceofchemical
processesinawidevarietyofindustries,includingoilandgasexploration,
production,andrefining;gasprocessing;commodityandspecialtychemicals;
pharmaceuticals;biofuels;andprocessequipmentmanufacturing.
Withinalloftheseindustries,chemicalengineersworkeverydaywith
CHEMCADtoaddressavarietyofchallenges:
Initialdesignofnewprocesses
Optimizationordebottleneckingofexistingprocesses
Performancemonitoringofprocesses
Designandratingofprocessequipmentsuchasvessels,columns,heat
exchangers,piping,valves,andinstrumentation
Evaluationofsafetyreliefdevices
Heatexchangersizing
Pressureandflowbalancingofcomplexpipingnetworks
Reconciliationofplantdata
Economiccomparisonsofprocessalternatives
Advancedprocesscontrol(APC),includingmodelpredictivecontrol(MPC),
realtimeoptimization(RTO),andoperatortrainingsystems(OTS)
Scaleupofprocessesfromlabscaletopilotscale,andfrompilotscaletofull
scale
Binaryinteractionparameter(BIP)regressionfromprocessorlabdata
Batchreactionrateregressionfromprocessorlabdata
Nomatterhowcomplexyourprocess,CHEMCADiscapableofdeliveringthe
resultsyouneedtostaycompetitiveinanincreasinglyfastandfluidglobalmarket.
Easytolearnandhighlycustomizable,CHEMCADcanputfutureproofsolutions
withineasyreachofyourengineeringstaff.
CHEMCAD Products and Features

TheCHEMCADsuiteconsistsofseveralmodulesthatservespecificpurposes.
Dependingonyourparticularneeds,youmayhavepurchasedsomeorallofthese
modules.ThefollowingarebriefdescriptionsofthevariousCHEMCADmodules
andtheirmostcommonuses.
CC-STEADY STATE
ThemainCHEMCADproduct,knownasCCSTEADYSTATE,enablesyouto
designnewprocesses,rateexistingprocesses,andoptimizeprocessesinsteadystate.
CC-DYNAMICS
ThemoduleknownasCCDYNAMICSmakesitpossibletodesignandrateexisting
processesusingadynamicsimulation.Thismoduleisfullyintegratedwith
CHEMCADtomakeswitchingbetweensteadystateanddynamicseasyand
intuitive.UsingCCDYNAMICS,youcaneasilysimulateeverythingfromsimple
vesselaccumulationtocomplexcontrolsystemsoncolumns.Thismodulealso
providestoolsforsimulationofcontinuousstirredtankreactors(CSTRs),including
complexreactionrateandpressurecalculation.
CC-BATCH
TheCCBATCHproductenablesyoutodesign,rate,oroptimizeabatchdistillation
column.CCBATCHincludesaschedulinginterfacetoallowanoperationstep
approachtosimulationofbatchcolumns.
CC-THERM
TheCCTHERMproductletsyoudesignasingleheatexchanger,orvetavendors
heatexchangerdesign.Itisalsoidealforcustomerswhowanttorateexisting
exchangersinnewservice,ortoperformcalculationsonhypotheticalsituations.CC
THERMcansimulateshellandtube,aircooled,plateandframe,anddoublepipe
exchangers.FullintegrationwithCHEMCADmakesitpossibletocalculateexit
conditionsfromexchangergeometryforhighfidelitysimulations.
CC-SAFETY NET
TheCCSAFETYNETproductprovidesthecapabilitytodesignorratepiping
networksandsafetyreliefdevicesandsystems,inbothsteadystateanddynamic
systems.ThesteadystatefeaturesofCCSAFETYNETareincludedwithCC
STEADYSTATE.Thisproductenablesuserstomakesimultaneousflowand
pressurebalancedsimulationseveninreverseflowsituationsforsingleor
multiphaseflow.
CC-FLASH
TheCCFLASHmoduleprovidesphysicalpropertyandphaseequilibriumdata,as
wellaspropertypredictionandregression.CCFLASHisasubsetofCCSTEADY
STATE,andismeantforcustomerswhodonotneedfullflowsheetsimulationtools.
CHEMCAD Features by Module
Sensitivity/optimization
Sizing (line/valve/orifice/vessel)
Run steady state
Run dynamics
Run recycles
Costing
Reconciliation
Sizing columns
Sizing heat exchangers
CC-FLASH
CC-SAFETY NET
CC-THERM
CC-DYNAMICS
VB/COM/OPC/Data Map
CC-BATCH
CC-STEADY STATE
Thefollowingmatrixliststhefeaturesassociatedwitheachcomponentofthe
CHEMCADsuite.Foramoredetailedexplanation,ortoinquireaboutaparticular
componentorfeature,pleasecontactChemstationsoryourCHEMCADdistributor
(seecompletecontactinformationatwww.chemstations.com/contact.htm).
Economics
Reports (incl. Excel)
DIERS
CO2 solid
Hydrates
Depress
TOC/COD
Pure regression
BIP regression
Electrolyte regression
Rate regression
Units calculator
Execute parser
Environmental report
Simple calculator
Spec sheet
UnitOps by Module
Batch column
Batch reactor
Calculator
Centrifuge
Component separator
Compressor
Control valve
Controller
Crusher/grinder
Crystallizer
Cyclone
Divider
Dynamic vessel
Electrostatic precipitator
Equilibrium reactor
Excel unit
Expander
Fired heater
Flash
Gibbs reactor
Heat exchanger
Hydrocyclone
Kinetic reactor
Liquid/liquid extractor
LLV flash*
LNGH exchanger
CC-FLASH
CC-SAFETY NET
CC-THERM
CC-BATCH
CC-DYNAMICS
Baghouse filter
CC-STEADY STATE
Theavailabilityofcertainunitoperations,orUnitOps,inCHEMCADsimulationsis
afunctionofwhichmodulesyouhavelicensed.Thefollowingmatrixlistsall
availableUnitOpsandtheCHEMCADmodulesassociatedwiththem.
9
9
9
CC-SAFETY NET
CC-FLASH
Mixer
Node
Phase generator*
PID controller
Pipe simulator
Pump
Ramp controller
Recorder*
Run subflowsheet META unit
SCDS distillation column
Screen
Sedimentator
Shortcut column
Solids dryer
Solids washer
Stoichiometric reactor
Stream reference
CC-THERM
CC-DYNAMICS
Loop
CC-BATCH
CC-STEADY STATE
Polymer reactor
Tank
Time delay
Time switch
Tower distillation column
Tower plus distillation column
User-added module
Vacuum filter
Valve
Venturi scrubber
Vessel*
9
9
* These UnitOps will be phased out eventually.
Chapter 2
Getting Started with CHEMCAD
NowthatyouhaveCHEMCADinhand,youprobablywanttogetstartedright
away.Letsgetdirectlytothepoint,withstepbystepinstructionsforinstallingand
licensingtheprogram.
Installing the Software

StartbyensuringthatyourPCmeetstheminimumsystemrequirements,aslisted
below.Itsalsoagoodideatofindoutbeforeyoubeginwhetheryourcopyof
CHEMCADwillrelyonanetworklicense;ifitwill,makesuretoaskyournetwork
administratorforallthe
informationthatyoullneed
CHEMCAD System Requirements
wheninstallationiscomplete
Processor speed: 500 MHz or higher
anditstimetosetup
Operating system: Windows 2000, XP, Vista, 7, 8
licensing.
RAM: 256 MB
Video card: 128 MB or higher video memory
Display resolution: 1024 x 768 or higher
Hard disk space: 500 MB (750 MB during
installation)
Productivity software: Some features require
Microsoft Office
Onceyouveestablished
thatyourcomputerisready
forinstallation,insertthe
CHEMCADinstallationdisc
intoanavailableCDmedia
driveandwatchforthe
CHEMCADsplashscreento
appear.
Note: IfyouinsertthediscandclosetheCDmediadrivedoor,butnothinghappens
withinoneminute,thenyoursystemisnotconfiguredtolaunchtheCDcontent
automatically.Tolaunchtheinstallationprogrammanually,gotoMyComputer,
doubleclicktheiconforyourcomputersCDmediadrive,andthendoubleclickthe
filecalledSetup.exe.
ClickInstallCHEMCADtolaunchtheInstallShieldWizard.InstallShield
inspectsyourcomputerforsoftwarecomponentsthatCHEMCADwillneed,and
promptsyoutoinstallanyneededcomponentswithascreensimilartoFigure201.
Figure 2-01: InstallShield Wizard screen listing software components to be installed
ClickInstalltocontinue.Followthepromptsonallotherscreensuntilyousee
theCHEMCADSuiteInstallShieldWizardscreen,showninFigure202.
Note:DependingonhowmanysoftwarecomponentsInstallShieldidentifies,there
maybequiteafewscreens,andtheprocedurecouldtakeseveralminutes.Once
thesecomponentsareinstalledonyourcomputer,however,youwillnotneedto
reinstallthemwithfutureCHEMCADupdates.
Figure 2-02: The CHEMCAD Suite InstallShield Wizard screen
ClickNexttobegintheinstallationprocess.TheLicenseAgreementscreen
appears,listingtheCHEMCADstandardlicense.Onceyouvereadandunderstood
thetermsofthelicense,youllneedtoclicktheIacceptthetermsinthelicense
agreementbuttonbeforeyoucanclickNextagaintoproceed.Notethatyouhavethe
optiontoprintacopyofthelicenseagreementfromthisscreen.
Figure 2-03: The Standard License screen
FollowingthestandardCHEMCADlicenseagreement,asimilarscreenappears
withthelicensetermsoftheMicrosoftVisualStudiotools.Again,youllneedtoclick
theIacceptthetermsinthelicenseagreementbuttonandthenclickNexttoproceed.
TheDestinationFolderscreenappearsnext,displayingthenameofthefolder
intowhichtheCHEMCADfileswillbeinstalledbydefault.Normally,this
destinationisC:\ProgramFiles\Chemstations\CHEMCAD,anditisrecommended
thatyouusethislocationunlessyouhaveaspecificneedtoinstalltheprogram
elsewhere.ClicktheChangebuttonifyouwanttochangethefiledestination,or
clickNexttoacceptthesuggesteddestinationandproceed.
TheSetupTypescreennowappears,offeringachoicebetweencompleteand
custominstallation.Eachtypeofinstallationisdescribedonthescreen.Eitheraccept
thedefaultsettingofCompleteorclickCustomtoselectspecificcomponentsto
install,thenclickNexttoproceed.
TheReadytoInstalltheProgramscreennowappears.Notethatonthisscreen,
andinfactonanyscreenintheinstallationprocess,youcanclickBacktoreturntoa
previousscreenandverifyorchangeyourinstallationsettings.Ifyouaresatisfied
withyoursettingsastheyare,clickInstalltostarttheinstallation.
TheInstallingCHEMCADSuitescreenappears,showingtheprogressofyour
installationwithagreenstatusbar.
Figure 2-04: Status bar showing the progress of CHEMCAD installation
Wheninstallationiscomplete,youllseeonefinalscreen,whichstatesthatthe
InstallShieldWizardhascompletedinstallationoftheCHEMCADSuite.Ifyou
wouldliketostartCHEMCADnow,checktheLaunchCHEMCADSuiteboxbefore
clickingFinish.
Licensing CHEMCAD
BeforeyoucanuseCHEMCAD,youllneedtosetupalicensingschemeofsome
type.Dependingonyourparticularlicensingagreement,youwilluseoneofseveral
typesoflicensestorunCHEMCAD.
Types of CHEMCAD Licenses

ThevarioustypesofCHEMCADlicensesaredesignedtofitdifferentusers
software,hardware,andnetworkingneeds.Mostlicensesrequiretheuseofa
hardwaredevice,commonlyknownasadongle,toruntheprogram.
ThedonglesimplyplugsintoeitheraUSBportoraparallelportonthe
computer,andmustbepluggedinanytimetheprogramruns.Ifyouworkona
networkwithotherCHEMCADusers,yourlicensemayrelyonadongleplugged
intoanetworkserverelsewhereinyourorganization,ratherthanoneplugged
directlyintoyourcomputer.
10
Youoryourorganizationmayuseoneofthefollowingtypesofdongles:
SuperProsingleuserdongle(parallelorUSBconnection)
SuperProNetdongle(parallelorUSBconnection)
Insomeinstances,softwarelicensingisaccomplishedwithouttheuseofa
hardwaredevice:
RMSLicenseManagersoftware,whichrunsoveralocalorwideaccess
network
SystemAuthorization,amethodthatauthorizesasingleusermachinefor
alimitedtime(usedforsoftwareevaluation)
License Settings
TorunCHEMCADforthefirsttime,makesurethatyourdongle(ifapplicable)is
pluggedinproperly,andthenstarttheprogram.FromtheWindowsStartmenu,
selectAllPrograms>Chemstations>CHEMCAD.
Theprogramopens,displayingaCHEMCADsplashscreen.Afterafew
moments,thatscreenisreplacedbytheCHEMCADLicenseMonitordialogbox,
whichdisplaysinformationaboutthelicense(s)thatyourcomputerisusingtorun
CHEMCAD.
Figure 2-05: The CHEMCAD License Monitor dialog box
Note:Insomecases,theCHEMCADscreenthatappearsmaydisplayaNoLicense
Foundmessage,whichindicatesthatCHEMCADhasnotyetdetectedavalidlicense.
Ifyourcomputerisexperiencingslowcommunicationwiththelicenseserver
system,CHEMCADmaysimplyneedmoretimetodetectthelicense(s).Assoonas
anyvalidlicenseisfound,CHEMCADwilldisplaytheCHEMCADLicenseMonitor
screen.
11
Normally,thisdialogboxremainsinviewforonlyafewseconds,listingall
productlicensesthatCHEMCADhasobtained.Duringthattime,youcanclick
anywhereinthedialogboxtokeepitopen.Ifyoudonotclickinthedialogbox,it
disappearsfromview,butyoucanbringitbackupatanytimebyselectingTools>
Options>Licensing.
WhiletheCHEMCADLicenseMonitordialogboxisopen,youcanviewthe
variousCHEMCADlicensesdetectedforyoursystemandseewhatmethod(and
whereapplicable,whichserver)isbeingusedtoobtainthoselicenses.Ifyour
organizationusesRMSLicenseManager,youcanalsoseewhichotherusers
currentlyholdvariousproductlicenses.
Fornetworklicenses,youcanrightclickaservernameunderaparticular
productandselectalicensingpreference(ondemand,always,ornever)asshown
below.
Figure 2-06: Selecting a licensing preference
Youcanusethealwaysorneversettingtoturnlicensingforaproductabsolutely
onoroff,respectively.Theondemandsettingsecuresalicenseonlywhenyoubegin
touseaspecificCHEMCADfeaturecontrolledbyacertainproduct.Thissettingis
idealinmostsituations,asitleavesunneededlicensesavailableforotherusers.
ToclosetheCHEMCADLicenseMonitorscreen,clicktheContinuebutton,or
clicktheXinthetoprightcornerofthescreen.
12
Updating a License
CHEMCADdonglesrequirereprogrammingonaregularbasis,eitheronceayear
ormoreoftendependingonyourlicensingagreement.Thisisasecuritymeasureto
reducethelikelihoodthatyourdonglewillbestolenandmisused.
Thedonglethatyouuseisprogrammedtoworkonlythroughthelicensedtime
period,andwhenthattimehaselapsed,thedonglemustbeupdatedbeforeyoucan
continueusingCHEMCAD.
Updatingadongleisarelativelysimpleprocedure.Beforeyourlicense
expiration,youoryoursoftwareadministratorshouldreceiveanemailfrom
Chemstations,withwhatsknownasaconfigurationfileincludedasanattachment.
YoushouldsavethisfiletoyourWindowsdesktopassoonasyoureceiveit.
Note:Ifyouveupdatedthesamedongleinthepast,thenewconfigurationfile
shouldhavetheexactsamefilenameasthepreviousone.If,whilesavingthefileto
yourdesktop,youseeaWindowsmessageaboutanexistingfilewiththesame
name,youshouldoverwritetheoldfile(whichinanycasecannotbeusedagain),
replacingitwiththenewone.
Itsimportanttoensurethatyourconfigurationfilematchesyourdongle.The
configurationfileshouldbea.DNGfilewhosenameincludesafourorfivedigit
code;thiscodemustmatchthenumberstampedontoyourdongle.Ifthenumbers
dontmatch,contactyoursoftwareadministratororChemstationssupporttoresolve
theissue.
Theupdateemailalsospecifiesthedateonwhichyoullneedtoupdateyour
dongle.Beforethatdatearrives,followthisproceduretoperformtheupdate:
1. StarttheCHEMCADprogramandselectTools>Options>Licensing.This
bringsuptheCHEMCADLicenseMonitordialogbox,whichdisplaysthe
statusofallapplicableCHEMCADproductlicenses,alongwithyourdongle
typeandnumber.
Figure 2-07: The CHEMCAD License Monitor dialog box
13
2. ClicktheSetupbuttontobringuptheLicenseSetupdialogbox,thenclick
Updatedongleasshownbelow.
Figure 2-08: Clicking Update dongle within the License Setup dialog box
3. Thedialogboxnowlistsalllicensingdonglesanddisplaysafieldfor
enteringthefullpathandfilenameforthedongleupdatefile.Clickthe
Browsebuttontonavigatetotheupdatefile.
Figure 2-09: Browsing for the dongle update file
4. IntheOpendialogbox,navigatetothelocationwhereyousavedthe.DNG
configurationfile.Normally,thisistheWindowsdesktop;ifyousavedyour
configurationfilethere,clickDesktoptotellCHEMCADwheretolookfor
thefile,thenclickOpen.
5. TheLicenseSetupdialogboxnowdisplaysthedirectorypathandfilename
fortheselected.DNGfile.ClickOKtoupdatethedongle.
Figure 2-10: Updating the dongle with the selected update file
14
6. CHEMCADreprogramsthedongle,andthendisplaysapopupwindow
statingthattheupdateiscomplete.
Figure 2-11: Successful re-programming of a CHEMCAD dongle
7. ClickOKtoclosethepopupwindow.IftheCHEMCADLicenseMonitor
screenappears,clickContinuetocloseit.
YoushouldnowbeabletoproceednormallyinCHEMCAD.
Note:ForSuperProNetdonglesonly,youwillneedtostopandrestarttheWindows
servicecalledSentinelProtectionServerafterupdatingthedongle.
Getting Help with CHEMCAD

IfyoufindthatyouhavequestionsthatarenotaddressedinthisUserGuide,you
canturntoseveralresourcesforCHEMCADhelp.
Online Help
AtanytimewhilerunningCHEMCADinanactivewindow,youcanpressthe[F1]
keytobringuptheCHEMCADHelpscreenthatsmostappropriatetothetaskyou
arecurrentlyperformingorthedialogboxcurrentlydisplayed.
Insomesituations,pressing[F1]willbringupthemainCHEMCADHelp
windowinsteadofaparticularhelpscreen.Fromthere,youcanclicktheContents,
Index,orSearchtabintheupperleftcorneroftheCHEMCADHelpwindow,and
usethesetoolstofindtheinformationyouneed.
YoucanalsogodirectlytothemainCHEMCADHelpwindowbyselectingHelp
>HelpTopicsfromtheCHEMCADmainmenu.Regardlessofhowyouopen
CHEMCADHelp,italwaysopensinaseparatewindowthatdoesnotinterferewith
theoperationoftheCHEMCADprogram.
CHEMCAD Coach
TheCHEMCADCoachpaneisatoolthatyoucanopenwithinCHEMCADtoview
conciseinstructionsforcommonprocedures.Toseealistofavailabletopics,select
Help>CHEMCADCoach.ThenclickonanylinkintheCHEMCADCoachwindow
toviewtheinstructionsforaspecifictask.
15
Procedure Demos
Animateddemonstrationsofcommontasksareavailabletohelpyougetstarted
usingtheCHEMCADprogram.ThedemofilesareinstalledalongwithCHEMCAD.
Toaccessthesedemos,selectStart>AllPrograms>Chemstations>Demos,and
thenbrowsethelistofavailabletopics.Whenyouselectademofromthemenu,it
willstartplayingautomatically.
The Chemstations Web Site

TofindthemostrecentupdatesoftheCHEMCADsoftware,manuals,andvarious
trainingtools,gotowww.chemstations.com.Thereyoullfindthefollowingitems
availablefordownload:
ThelatestreleaseofCHEMCAD
Alistofupdatesimplementedinthemostrecentrelease
CHEMCADdocumentationanddemos
ProgrammingguidesforinterfacingwithCHEMCAD
Contacting Chemstations Technical Support

Ifyouareunabletosolveaproblemorfindtheanswertoaquestionusingthis
manualortheothertoolslistedhere,youcancontactChemstationstechnical
supportstaffforassistance.
Ourtechnicalsupportengineers
areavailableviaemail,orbyphone
MondaythroughFriday,7:00AM
through6:00PMCentralStandard
Time.
Phone:
713.978.7700
Toll-free (U.S. and Canada): 800.243.6223

FAX:
E-mail:
713.978.7727
support@chemstations.com
OutsideoftheUnitedStates,pleaseseewww.chemstations.comforregional
contactinformation.
16
Chapter 3
The CHEMCAD Interface
ThischaptertakesyouonatouroftheCHEMCADscreen,includingthemenusand
toolbars,themainareasofthescreen,andtheflowsheetdrawingtools.Italsoshows
yousomewaysthatyoucancustomizethescreenlayoutsothatitbestsuitsyour
ownwayofworking.
Note:WiththereleaseofVersion6.0,theCHEMCADinterfaceunderwentamajor
transformation.Forthisreason,usersupgradingfromCHEMCAD5willbenefit
fromareviewoftheprogramsscreenlayoutandthelocationofimportantfeatures.
The CHEMCAD Window

WhenyoulaunchtheCHEMCADprogramforthefirsttime,youllseeascreenwith
alargewhiteareainthemiddleandvariouspanes,orspecializedareas,attheedges
ofthescreen.
Workspace
CHEMCAD
Explorer pane
Palette pane
Messages pane
17
TheCHEMCADInterface
The Workspace
Theareainthemiddleofthescreenisknownastheworkspace.Thisisthemainfocus
oftheCHEMCADwindow,theplacewhereyoullbuildandeditflowsheets,view
graphs,andrunandtweakprocesssimulations.
WhenyoufirstlaunchCHEMCAD,theworkspaceissolidwhite.Whenyoustart
tobuildaflowsheetoropenanexistingsimulation,theflowsheetdisplaysinthe
workspace.
Theworkspaceusestabstoenableyoutoswitchbetweenyouropensimulation
andanyopenExcelDataMapsand/ordataplots.Atthebottomoftheworkspace
area,youllseeoneormoretabswheneverasimulationisopen.Eachtabincludesa
buttonmarkedwithanX;tocloseanytab,firstclickthetabandthenclicktheX
button.
Figure 3-01: The bottom of the workspace area, showing several tabs and their
buttons
Notethatanytimeyouveclosedasimulationandhaventyetopenedanother
one,theworkspacedisplaysasablankgrayspace.
The CHEMCAD Explorer Pane

AlongtheleftedgeoftheCHEMCADwindow,youllseeanareawithatitlebarat
thetopthatreadsCHEMCADExplorer.AtthebottomoftheCHEMCADExplorer
panearethreetabscalledRecentFiles,Simulation,andVisualBasic.Toviewthe
contentsofatab,simplyclickitsname.
Figure 3-02: CHEMCAD Explorer tabs
TheCHEMCADExplorertabsarepresentedinwhatsknownasatreeformat,
withitemsorganizedintoamultilevelhierarchy.Thedefaultviewshowsonlytop
levelitems,butyoucanexpandeachitemtoviewsecondlevelitems,thirdlevel
items,andsoforth.
Attheleftofeachtoplevelitemisasmallboxwithaplussign.Toexpandan
item,clicktheplussign.Twothingshappensimultaneouslywhenyouclick:thetree
expandstoshowthatitemscontents,andtheplussignbecomesaminussign.You
canhide(orcollapse)thelowerlevelitemsagainbyclickingtheminussign,which
thenturnsbackintoaplussign.Figure303showsanexampleofaCHEMCAD
Exploreritemincollapsedandexpandedview.
18
TheCHEMCADInterface
Figure 3-03: Clicking the plus sign to expand an item (left); the resulting view (right)
ExpandingandcollapsingitemsintheCHEMCADExplorertabsisonewaythat
youcanmakethebestuseofyourscreenspacewhenworkinginCHEMCAD.
The Recent Files Tab

TheRecentFilestabisselectedbydefaultwhenyoufirstlaunchCHEMCAD.This
tablistsallofthesimulationfilesthatyouhaveopenedlately,startingwiththemost
recent.WhenyoufirstinstallCHEMCAD,thelistisempty,butwithevery
simulationthatyouopennewfilesorexistingonessuchasbuiltinexamplesthe
listwillgrow,providingconvenientaccesstofilesthatyouusefrequently.
ToopenasimulationfromtheRecentFileslist,simplydoubleclickonthefile
nameinthelist.
The Simulation Tab

TheSimulationtabdisplaysbydefaultanytimeasimulationisopen.Itprovidesa
seriesofshortcutstocommoncommandsandsettings,including:
Components:Includesoneclickaccesstocomponent,electrolyte,andsolids
selection,aswellasdistillationcurves
Thermodynamics:Providesquickaccesstothermodynamicsettingsand
transportproperties
Flowsheet:AllowsquickeditingofUnitOpandstreamdata
SensitivityStudies:Providesaconvenientwaytocreate,edit,andrun
sensitivitystudies
DataMaps:EnablesyoutocreateorsetexecutionrulesforaDataMap
withoutusingthemenu
19
TheCHEMCADInterface
SavedCharts:Providesquickaccesstopreviouslysavedchartsforthis
simulation
Groups:ProvidesaneasywaytocategorizeUnitOps,streams,and
components
Layers:Allowsselectedpartsoftheflowsheettobedisplayedorhiddenfor
viewingandprinting
Templates:StoresandorganizesstreamandUnitOpspecificationsthatyou
cancloneforreuse
Expandanyoftheseitemstoseeandusespecificfeatures,whicharedescribedin
furtherdetailintheappropriatechaptersofthisuserguide.
The Visual Basic Tab

IfyouuseVisualBasictocustomizeCHEMCAD,thistabprovidesquickandeasy
accesstoyourVisualBasiccode.YoucanexpandtheReactions,Properties,or
UnitOpsitemtoviewavailablesubroutinesforthatcategory.Clickingthenameofa
subroutineopensaVisualBasiceditorinaseparatewindow.
The Palette Pane

AlongtherightsideoftheCHEMCADwindowisapanetitledPalette,whichisa
repositoryforthevariousunitoperationiconsandothertoolsneededtodraw
flowsheets.
Selecting a Palette
TheseUnitOpiconsandtoolsaregroupedintopalettesaccordingtofunctionor
equipmenttype.ThedefaultpaletteiscalledAllUnitOps,anditincludesevery
availableUnitOpiconanddrawingtool.Toselectadifferentpalette,simplyclickits
titlebar.Theselectedpaletteexpandsinplace,asshowninFigure304.
Figure 3-04: The expanded Piping and Flow palette
20
TheCHEMCADInterface
Customizing Palettes
AtthetopofthePalettepaneisafieldcalledSearchforUnitOp(s).Typeasearch
termhereandthenclickGo!tolocatealloftheUnitOpiconsassociatedwiththat
term.TheresultsfromthesearchappearinanewpaletteatthebottomofthePalette
pane.Figure305showsthesearchresultsforthewordvessel.
Figure 3-05: Search results showing all vessel UnitOps
PerformingaUnitOpsearchcreateswhatisknownasauseraddedpalette.This
typeofpaletteisdesignatedwithaspecialiconattheleftendofthepaletteheading.
Thepalettecontainingyoursearchresultsremainsavailableuntilyouclose
CHEMCAD.Youcanmakeyouruseraddedpaletteavailablepermanentlybyright
clickingthenewpalettestitlebarandselectingSave.
Figure 3-06: Saving search results for future use
21
TheCHEMCADInterface
Youcandothefollowingwithuseraddedpalettes:
Renameanyuseraddedpalettebyrightclickingitstitlebarandselecting
Rename.Intheresultingdialogbox,typethenameyouwantandthenclick
OK.
Deleteauseraddedpaletteatanytimebyrightclickingandselecting
Remove.
AddindividualUnitOpsortoolstoanexistinguseraddedpalette.Simply
rightclicktheiconfortheitemyouwanttoadd,selectInsertintoPalette,
andthenclickthenameoftheuseraddedpalette.
Removeanitemfromauseraddedpalettebyrightclickingtheiconand
selectingRemovefromPalette.
Createauseraddedpalettewithoutasearch.Rightclickthefirsticonthat
youdliketoincludeonanewpaletteandselectInsertintoPalette>New
Palette.TypeanameintheresultingdialogboxandclickOK.Thenaddas
manyothericonsasyoudlikeusingthemethoddescribedjustabove.
Youcannotchangethenameoriconselectionforabuiltinpalette,asyoucan
withauseraddedpalette.Youcan,however,makeacopyofabuiltinpalette,
renamethecopy,andthenaddanddeleteiconsuntilthepalettehasjustwhatyou
want.
Tocopyanypalette(whetherbuiltinoruseradded),simplyrightclickthe
paletteheadingandselectSaveCopyAs.Typeanameforthenewpaletteandclick
OK.
The Messages Pane

TheMessagespaneislocatedatthebottomedgeoftheCHEMCADworkspace.At
thebottomofthispanearethreetabs:ErrorsandWarnings,RunTrace,andNotes.
The Errors and Warnings Tab

Thistabdisplaysarunninglistoferrorandwarningmessagesthathavebeen
generatedwhilethecurrentsimulationfilehasbeenopen.Theoldestmessages
displayatthetopofthelist.Whentherearetoomanycumulativemessagesto
displayinthepane,themostrecentmessagesdisplayandtheoldermessagesscroll
offthetopedgeofthepane.Ifneeded,youcanusetheverticalscrollbarontheright
sideofthepanetoscrollupandreviewearliermessages.
The Run Trace Tab

ThistabdisplaysdiagnosticmessagesfromeachUnitOpeachtimeasimulationis
run.Thisinformationishelpfulintroubleshootingasimulationthatisnotworking
properly.
ThetextontheRunTracetabisnotsavedwiththesimulation,butrefresheswith
eachrunandclearswhenyouclosethesimulation.
22
TheCHEMCADInterface
The Notes Tab

Thistabprovidesahandyplacetostoreadditionalinformation,intextform,about
thesimulation.Youcanuseittolistanydetailsaboutthesimulation,suchasits
originandanyassumptionsthatarebeingmade.
Anynotesthatyouaddorchangearesavedaspartofthesimulation.Todelete
textfromanote,simplyclickanddragtoselectthetextandthenpress[DELETE]on
yourkeyboard.
The Main Menu

ThemainCHEMCADmenuislocatedjustunderthetitlebaratthetopofthe
programwindow.SomeitemsonthemainmenuarecommontonearlyallWindows
programsnamelyFile,Edit,Format,andHelpwhileothermenuitemssuchas
ThermophysicalandSizingaremorespecifictochemicalprocesssimulation.
Touseamenucommand,clicktherelevantmainmenuitemandthenclickthe
commandinthedropdownlistthatappears.
Toexecutemenucommandswithoutusingthemouse,youcanholddownthe
[ALT]keyonyourkeyboardasyoupresstheletterkeythatcorrespondstothe
underlinedletterinthedesiredmenuitem,forexample[ALTF]fortheFilemenu.
Youcanthenusetheupanddownarrowkeystoselectanitemonthemenuand
press[ENTER]toexecutetheselectedcommand.
The Toolbar
TheCHEMCADtoolbarprovidesbuttonsthatarecommontomostWindows
applications,suchasNew,Open,Save,andPrint,alongwithbuttonsthatare
specifictochemicalprocesssimulation.
Todiscovertheuseofaparticularbutton,simplypointyourmousecursoratthe
buttonandwatchforthetooltiptoappear,asshowninFigure307.
Figure 3-07: Viewing a buttons tooltip
Toolbarbuttonsprovidequick,oneclickaccesstofrequentlyusedcommands
thatarealsoavailableviatheCHEMCADmenus.
23
TheCHEMCADInterface
Customizing the CHEMCAD Screen

WhenyoufirstinstallCHEMCAD,thescreenislaidoutwiththeCHEMCAD
Explorerpaneontheleft,thePalettepaneontheright,andtheMessagespanebelow
theworkspace.
Ifhavingalloftheseitemsvisibleleavesyoulessworkspacethanyouwould
prefer,orifthelocationofoneormorepanesislessthanoptimalforthewaythat
youwork,youcanhideormovepanestocustomizeyourCHEMCADscreen.
Viewing and Hiding Screen Elements

YoucanvieworhideanyoftheCHEMCADscreenspanes,aswellasgroupsof
toolbarbuttons,tomakeoptimaluseofyourscreenspace.
Totoggleapaneonoroff,selecttheViewmenuandthenchooseCHEMCAD
Explorer,Palette,orMessages.Itemswithacheckmarkarecurrentlydisplayed,
whileitemswithnocheckmarkarecurrentlyhidden.Youcanalsochoosetoviewor
hidethestatusbaratthebottomoftheCHEMCADwindow.
Toselectivelyvieworhidegroupsoftoolbarbuttons,selectView>Toolbars.In
theToolbarsdialogbox,eachgroupofbuttonsislistedunderadescriptivename;
initially,allofthesegroupshavecheckmarks,indicatingthattheyarecurrently
displayed.Tohideanygroupofbuttons,clicktoremovethecheckmarkandthen
clickClosetoreturntothemainCHEMCADwindow.
Resizing and Moving Items

Nowthatyouhavedeterminedwhichpanesandtoolbarbuttongroupstodisplay,
youcanfurthercustomizeyourCHEMCADwindowtodetermineexactlywhere
eachoftheseitemswillappear.
Resizing a Pane
Thesimplestwaytoaltertheappearanceofapaneistoresizeit.Youcanmakethe
CHEMCADExplorerandPalettepaneswiderornarrower,ormaketheMessages
paneshorterortaller,bymovingtheinsideedge,orwall,ofthepanetowardor
awayfromtheedgeofthemainwindow.
Toresizeapane,startbypositioningyourmousecursorattheinsidewallofthe
panethatis,therightedgeoftheCHEMCADExplorerpane,theleftedgeofthe
Palettepane,orthetopedgeoftheMessagespane.Whenthecursorisinthecorrect
positionforresizing,thenormalpointerwillbereplacedwithatwoheadedarrow
asshowninFigure308.
24
TheCHEMCADInterface
Figure 3-08: The two-headed arrow cursor used for resizing panes
Whenyouseethetwoheadedarrow,clickanddraginthedirectionyouwantto
movethepanewall.Athickgraylineshowsapreviewofthenewpanesize;when
youreleasethemousebutton,theresizedpaneappears.
Moving a Pane
Inadditiontoresizing,youcanalsomoveanyofthepanesintheCHEMCAD
window,eithertoadifferentedgeofthescreenortothemiddleofthescreen.You
canalsomovegroupsofbuttonsfromtheirdefaultpositionsonthetoolbar.
Initially,allofthepanesandbuttongroupsaredocked,meaningthattheyare
snappedintoanedgeofthescreenorthetoolbararea.Whenyouundockanitem,
youcanputitinthelocationofyourchoosing,awayfromthescreenedge.
Toundockapane,clickanddragthepanestitlebar,thatis,thebluebaratthe
topofthepanethatshowsthepanename.Toundockabuttongroup,youllneedto
clickanddragtherowoffourdotsrunningalongtheleftedgeoftheleftmostbutton
inthegroup.
Note:InthecaseoftheMessagespane,thetitlebarrunsalongtheleftedgeofthe
pane,andthenameisnotvisiblewhenthepaneisdocked.
Ifyoudragthepaneorbuttongroupintotheworkspacearea,youllseeagray
boxrepresentingthepositiontheitemwilloccupywhenyoureleasethemouse
button.Ifyoudontlikethenewposition,youcanclicktheitemstitlebaranddrag
itelsewhere,includingitsoriginalposition.
Youcanalsodockapanetoadifferentedgeofthescreen,ormovebutton
groupsaroundwithinthetoolbararea,insteadofundockingtheseitems.
Pinning and Unpinning Panes

Inadditiontomovingandresizingthevariouspanes,theresanotherwaythatyou
cancustomizeyourCHEMCADscreen:pinningandunpinningtheCHEMCAD
ExplorerandPalettepanes.
Thesetwopanescantakeupafairamountofhorizontalscreenspace,and
makingthemverynarrowisntanidealwaytowork.Pinningandunpinning
provideawaytoviewfullwidthCHEMCADExplorerandPalettepaneswhenyou
needthesetools,whilealsofreeingupspacewhenyouarentusingthem.
25
TheCHEMCADInterface
Whenevereitherofthesepanesisdockedatanedgeofthescreen,itisinoneof
twostates:
Pinned,meaningthatthepaneisalwaysvisible
Unpinned,meaningthatthepaneismostlyhiddenfromview,andappearsonly
ondemand
Bydefault,allCHEMCADpanesareinitiallypinnedinplace.Youcanchooseto
unpinapaneifyouprefertohavesomeextraspaceonthescreen.Tounpinapane,
findthetinypushpiniconinthepanestitlebar,nexttotheXiconthatenablesyou
toclosethepane.Ifthepaneisstationary,youllseethatthepinisuprightwithits
pointdown.
Figure 3-09: The icon indicating a pinned, or stationary, pane
Ifyouclickthepinicon,thepanesuddenlydisappearsfromviewbutitisnt
gone.Instead,asmallgraytabbearingthenameofthepaletteappearsattheedgeof
thescreenwherethepaneisdocked.Toseethepanereappear,youonlyhavetoroll
yourmouseoverthattab.Whenthepaneappears,youllnoticethatthepushpin
iconisnowpointedtotheside.UsethetoolsontheCHEMCADExplorerorPalette
normally;then,whenyounolongerneedthepane,justmovethemousepointer
elsewhere.Thepanewillautomaticallyhideitselfuntilthenexttimeyourollthe
mouseoverthetab.
Figure 3-10: An unpinned pane in use; note the sideways pin icon
Torepinanunpinnedpane,pointtothetabtomakethepaneappearandthen
clickthepinicon.Thepinturnssothatitisonceagainupright,andthepaneisonce
againapermanentfixtureontheCHEMCADscreen.
Other Useful Interface Hints

ThefollowingarehelpfulitemsthatcanhelptomakeyourCHEMCADexperience
easierandmoreefficient.
Undo and Redo

AswithmostWindowsbasedprograms,CHEMCADallowsyoutobackoutof
actionsyouhavejusttakenwhileworkingwithafile.YoucanusetheUndo
26
TheCHEMCADInterface
commandtoreversethelastchangeyoumade;simplyselectEdit>Undo,orusethe
keycombination[CTRLZ].
YoucanusetheUndocommandtoretractuptothelast99actionsthatyou
performedsincethelasttimeyouopenedthecurrentsimulationfile.
Visible Grid
Youcanturnonaworkspacegridtouseasaguidewhilecreatingyourflowsheet.
SelectView>GridVisibletotogglethisfeatureonoroff.
OthergridoptionsincludeView>SnaptoGrid,whichhelpswithalignmentof
objectsontheflowsheet,andView>ChangeGridSize,whichenablesyouto
customizethehorizontalandverticalspacingofgridlines.
Adjusting Your View of the Workspace

TheView>ZoomOptionsmenuoffersawholeseriesofoptionsformovingand
resizingyourviewoftheCHEMCADworkspace.
SelectIntoviewtheworkspacefromcloserin,orOuttoviewfromfartheraway.
SelecteitherInataPointorOutataPoint,andthenclickapointonthe
workspace,tozoominoroutwiththatpointasafocus.
SelectZoomRectangle,andthenclickanddragontheworkspace,todesignatea
specificareathatyouwanttoview.
SelectZoomPercentagetochooseaspecificdisplaysizefortheworkspace.
SelectZoomtoFittoviewatthelargestsizethatstillpermitsalloftheexisting
flowsheetelementstoremaininthevisibleworkspace.
Ifyourcomputermouseisequippedwithascrollwheelbetweentheleftand
rightmousebuttons,youcanzoominandoutontheCHEMCADworkspacewitha
touchofyourfinger.Tozoomin,rollthewheelupthatis,pushyourfingertip
away,towardthetopedgeofthemouse.Tozoomout,rollthewheeldowntoward
thebottomofyourmouse,pullingyourfingertiptowardyourpalm.Whenyou
zoominandoutthisway,thefocalpointforthezoomisthelocationofthemouse
pointer.
Note:Youcanalsoclickandholdthemousewheeltopanacrosstheworkspace.
The CHEMCAD Coach Pane

TheCHEMCADCoachpaneisnotdisplayedbydefault,butyoucanaccessitatany
timebyselectingHelp>CHEMCADCoach.ThepurposeofCHEMCADCoachisto
provideconciseinstructionsforcommonprocedures.Ifyouvelearnedhowto
performacommonprocedureinCHEMCADbuthaveforgottentheexactmenu
commandtouse,CHEMCADCoachcanhelpjogyourmemoryandputyouonthe
righttrack.
27
TheCHEMCADInterface
YoucandragtheCHEMCADCoachwindowtoanylocationonthescreen,
simplybyclickinganddraggingthetitlebaratthetopofthewindow.
IfyouhavefinishedusingtheCHEMCADCoachtoolandwanttocloseit,just
clicktheClosebutton(theredX)intheupperrightcorneroftheCHEMCADCoach
window.NotethatifthemainCHEMCADwindowwasmaximizedbeforeyou
openedtheCHEMCADCoachtool,youmayneedtomaximizetheCHEMCAD
windowagaintorestoreittofullscreensize.
28
Chapter 4
Working with Simulation Files
AlloftheworkthatyoudowithCHEMCADisstoredinsimulationfiles.Beginning
withCHEMCAD6,eachdiscretesimulationispackagedintoasinglefilethatis
portableandeasytohandle.AllthedetailsofthesimulationfromUnitOp
specificationstostreamcompositiontothermodynamicsareincludedinthisfile.
ThischapterdescribesthevariouswaysthatyoucanaccessandmanageCHEMCAD
simulationfiles.
About CHEMCAD Simulation Files

SimulationscreatedinCHEMCAD6usethefileextension.CC6,whichdistinguishes
themfromotherfilesonyourcomputer,includingsimulationfilescreatedusing
earlierversionsofCHEMCAD.
Oneofthemostnotabledifferencesbetween.CC6filesandpredecessorssuchas
.CCXfilesistheirportability.A.CC6simulationfileisaseasytoworkwith,
transport,andshareasanMSWorddocumentoranExcelspreadsheet.Whereas
CHEMCADsimulationsoncerequiredextrastepsbeforetheycouldbeemailedor
moved,simulationscreatedwithCHEMCAD6canbehandledasstandalonefiles.
29
WorkingwithSimulationFiles
Figure 4-01: Stand-alone CHEMCAD 6 files in the My Simulations directory
User Components in CHEMCAD

AnotherdeparturefrompreviousversionsofCHEMCADisthatsimulations
areselfcontainedwithrespecttothedataneededtorunthem.Customcomponents
thatyoucreatecanbestoredinacommondatabasesothatyoucanusethemin
manydifferentsimulations.Usercomponentsarealsostoredwithinthesimulations
thatusethem,soyounolongerhavetoworryaboutlosingusercomponentswhen
movingasimulationfromplacetoplace.
Eachtimeyouopenasimulation,CHEMCADcomparesanyusercomponentsin
thesimulationwiththecopiesofthosesamecomponentsinthedatabase.Ifthetwo
copiesdonotmatch,youwillbeofferedachoice:youcankeepusingthelocalcopy
storedinthesimulation,orusetheupdatedcopyfromthedatabase.
YourcopyofCHEMCADcannowhavemultipleuserdatabases,andevenshare
themonnetworkswithotherusers.Tolearnmoreaboutusercomponentsandbest
practicesformanagingandsecuringusercomponentdatabases,seeChapter10,
CustomizingCHEMCAD.
Example Files
EspeciallyifyourenewtoCHEMCAD,itsagoodideatoopenandpractice
workingwithsomeexamplefilesbeforecreatingyourownsimulations.Forthis
purpose,wevecreatednumerousexamplesofsimulationsfortypicalchemical
processes.Youcanopen,view,andeditanyexamplefile,andevensaveacopyin
anotherlocationtojumpstartasimulationofyourown.
TheCHEMCADexamplefilesareautomaticallycopiedtoyourcomputerwitha
completeCHEMCADinstallation.Theexamplesareorganizedbyprocesstypeand
locatedinthe\MyDocuments\MySimulations\Examplesdirectory.
30
Opening an Existing Simulation

SelectFile>OpentobringuptheOpendialogbox.Navigatetothefolderwherethe
simulationislocated,selecttheappropriate.CC6file,andclickOpen.
IfyouuseCHEMCADonanetworkandsharefileswithotherusers,itspossible
thatyoucouldtrytoopenasimulationthatisalreadyopenforeditingbyanother
user.Ifyoushouldattempttoopenasimulationthatisunavailableforediting,a
messageboxwillappear.Youcanchoosetosavethesimulationwithanewname
and/orlocation,openareadonlycopyofthesimulation,orcanceltheopen
operation.
Figure 4-02: Notification that a simulation is already in use
Ifyoushouldhavetroublelocatingaparticularsimulation,youcansearchyour
harddriveornetworkforallfileswitha.CC6fileextension.
Creating a New Simulation

WhenyoufirstopenCHEMCAD,youllseeablanksimulationwindowand
[Untitled]inthetitlebar.
Youcanbeginbuildingyoursimulationrightaway,butitsrecommendedthat
yousaveandnamethesimulationbeforeyouproceedveryfar.Thelongeryouwait
tosavethesimulation,themoreyourisklosingyourworkifanunforeseen
computerornetworkproblemshouldoccur.
Ifyoualreadyhaveasimulationfileopenandwanttostartanewsimulation,
firstsaveyourworkifapplicable.ThenselectFile>NeworclicktheNewtoolbar
button,toclosethecurrentfileandbringupanewblanksimulationscreen.Note
thatifyouhaveunsavedchangesinyourexistingfile,CHEMCADwillaskyouto
saveordiscardyourchangesbeforeopeningthenewsimulation.
31
Saving a Simulation
Tosaveallchangesinasimulationthatyouhavealreadynamed,selectFile>Save
orclicktheSavebuttononthetoolbar.
Note:Insomecases,suchasthebuiltinCHEMCADexamplefiles,existingfilesmay
besetasreadonlytopreventaccidentaloverwriting.Youcansaveacopyofaread
onlyfileusingadifferentfilenameand/orfilelocation.
Tosaveanewsimulationthatyouhaventyetnamed,selectFile>SaveAs.The
SaveAsdialogboxappears,withCHEMCAD6(*.cc6)asthedefaultfiletype.Leave
thefiletypeasitis,givethefileauniquename,andifnecessarynavigatetoanew
filelocation.ClickSavetoclosethedialogboxandreturntothesavedsimulation.
Figure 4-03: Giving a new simulation a unique name
Note:UnlikepreviousversionsofCHEMCAD,thechangesyoumaketoasimulation
arenotsaveduntilyouusetheSaveorSaveAscommand.Thisoffersyougreater
flexibilityinchoosingwhichchangestosaveordiscard.
Savingandstoringallofyoursimulationsinthesamedirectoryhelpsprevent
thelosttimeandfrustrationthatcanresultwhenfilesarescatteredindifferent
locations.ItisrecommendedthatyoustoreyoursimulationsintheMySimulations
folder,whichiscreatedautomaticallywithintheMyDocumentsfolderat
installation.
Saving Different Cases for the Same Simulation

Incertainsituations,youmayneedtocreateagroupofsimulationsthatarenearly
identicaltooneanother;previousversionsofCHEMCADreferredtosuchgroupsof
similarsimulationsascases.InCHEMCAD6,eachsimulationisafreestandingfile,
butyoucanstilleasilyclonesimulationsandmakeminorchangesforcomparison
cases.
32
Todothis,simplycreateasimulation,saveit,andthenselectFile>SaveAsto
renamethenextcase.Maketheneededchangesforthatcase,saveit,andcontinuein
thatveintocreateasmanyclonesofyouroriginalsimulationasneeded,with
whateverdifferencesyourequire.
E-mailing a Simulation
WithCHEMCAD6,emailingasimulationisasimplematterofaddingafile
attachment.Justopenyourpreferredemailprogram,createanewmessage,choose
yourrecipientsandaddyourtext,thenusetheprogramscommandforattachinga
file.Navigatetothefolderwherethesimulationislocated,selecttheappropriate
.CC6file,andaddthefileasanattachment.
Figure 4-04: Adding a .CC6 file as an attachment in MS Outlook
Beforeyouemailasimulation,youshouldensurethatyouhavesavedany
recentchanges.Also,itsagoodideatocheckthesizeofthefilebeforeaddingthe
attachment,assimulationfilescaninsomecasesbequitelarge.
33
Working with CHEMCAD Files from Previous Versions

YoucanuseCHEMCAD6toopensimulationsthatwereoriginallycreatedwith
CHEMCAD5.Whenyoudothis,CHEMCADcreatesacopyoftheoriginal
simulation,andmakesthatcopycompatiblewithallCHEMCAD6functionality.The
flowsheetandsimulationdatainthecopyarenotalteredinanyway,andthe
originalfileisleftintact.
TobringanexistingsimulationuptodatewithCHEMCAD6,selectFile>Open,
selectthesimulation,andclickOpen.Amessagewillappear,notifyingyouthatthe
simulationwillbecopied.
Figure 4-05: Converting a CHEMCAD 5 file to the .CC6 format
ClickSavetobringuptheSaveAsdialogbox,whereyoucaneitherkeepor
changethefilesnameandselectalocationfortheCHEMCAD6copy.ClickSaveto
createandopenthenewfile.
34
Chapter 5
Building and Using a Basic Simulation
AlthoughthetypesofsimulationsyoucancreateusingCHEMCADaremanyand
varied,thebasicprocedureforcreatingasimulationcanbebrokendownintothe
followingcommonsteps:
1. Startanewsimulation.
2. Selectengineeringunitsforthesimulation.
3. Createaflowsheetwiththeappropriatestreamsandunitoperations.
4. Selectchemicalcomponentsfortheprocess.
5. SelectKvalueandenthalpyoptionsfortheprocess.
6. Definethefeedstreamsusedintheprocess.
7. Enterspecificationsfortheunitoperations.
8. Runthesimulation.
9. Reviewtheresultsofthesimulation.
Starting a New Simulation

LaunchCHEMCADandthenselectFile>SaveAs.IntheSaveAsdialogbox,
specifyanameandlocationforthesimulationfile.
WhenyoufirstinstallCHEMCAD,thedefaultlocationforsavingnew
simulationsisafoldercalledMySimulations,locatedwithinyourcomputersMy
Documentsfolder.Youcansaveyournewsimulationtothatfolder,ortoany
accessibledirectoryonyourcomputerornetwork.AsyoullnoticeintheSaveAs
dialogbox,thefileextensionforCHEMCADsimulationfilesis.CC6.
35
BuildingandUsingaBasicSimulation
Selecting Engineering Units

Tospecifyengineeringunitsforthissimulation,selectFormat>EngineeringUnits.
ThisbringsuptheEngineeringUnitSelectiondialogbox,whereyoucanselectthe
unitstobeusedforeverythingfromtimeandtemperaturetosurfacetension.The
majorityoftheoptionsinthisdialogboxarelocatedontheUnitsselectiontab,but
youcanclickasecondtabcalledOptionsandreferencesformoreoptions.
ThebuttonsalongthebottomoftheUnitsselectiontabenableyoutosetallof
theunitstoEnglish,alternativeSI,SI,ormetric.Ifyourdesiredunitsdonotfitneatly
intooneofthesecategories,youcanchoosetheclosestoneandthenmanuallyselect
differentunitsforanyitemsyoulike.
Ifyoudofindyourselfcustomizingyourlistofunits,youcansaveyour
selectionsasaset,orprofile,thatyoucanquicklyduplicateforfuturesimulations.To
dothis,firstsetalloftheunitsthewayyouwantthem,thentypeanameforthis
profileandclicktheSaveProfilebutton.
YoumaynotnoticeanythinghappeningwhenyouclickSaveProfile,butyou
canverifythatyournewprofilehasbeensavedbyclickingtheLoadProfilebutton.
Thisisthebuttonthatyouwilluseforfuturesimulations,toapplyyourcustom
unitsprofilewithasingleclick.YoushouldseeaSelectItemscreenthatshowsthe
nameyougavetheprofile.IfyouclicktheprofilenameandthenclickOK,youll
loadyourcustomunitsprofile.
BackontheEngineeringUnitSelectiondialogbox,clickOKtoapplyyour
engineeringunitselectionsandcontinuecreatingyoursimulation.
Drawing the Flowsheet

Tocreatetheflowsheetforyoursimulation,youllneedtoaddtheappropriateunit
operationiconstoyourworkspaceandconnectthoseUnitOpstooneanotherwith
streams.ThisconnectedgroupofstreamsandUnitOpsformsthebasisforthe
simulation.
ThetoolsfordrawingaflowsheetarelocatedinthePalettepane,whichby
defaultdisplaysontherightmarginoftheCHEMCADwindow.ThePalettepaneis
dividedintoUnitOpcategories,oryoucanviewalloftheavailableUnitOpiconsat
onceusingtheAllUnitOpsview.
Adding UnitOps
ToplaceaUnitOpicononyourflowsheet,followthesesteps:
1. OntheAllUnitOpspalette,findtheappropriateUnitOpiconforthe
equipmentyouwanttorepresent.Whenyoupointtotheiconwiththe
mouse,theboxaroundtheiconlightsup.ClicktheicontoselecttheUnitOp.
2. Moveyourmousecursortotheworkspacearea,notingthatthepointer
displaysanoutlineoftheUnitOpiconyouveselected.Pointtothelocation
36
ontheworkspacewhereyouwanttoplacetheselectedUnitOp,andthen
clickandreleasetheleftmousebutton.TheiconfortheselectedUnitOp
appearswhereyouclicked.
3. RightclicktodeselecttheUnitOpdrawingtoolandreturntoanormal
pointer.Youcannowclickintheworkspaceareawithoutdrawingduplicate
UnitOps.
Selecting a Default Icon for a UnitOp

ForcertainUnitOps,youcanselectadefaulticontocustomizethewaythattypeof
equipmentlooksonyourflowsheet.
Note:Iconsthatarealreadyinplaceontheflowsheetwillnotbeaffectedwhenyou
selectanewdefaulticon.
YoucanseewhichiconsofferthisfeaturebymovingyourcursorovertheAll
UnitOpspalette,notingtheboxesthatlightuparoundtheicons.AUnitOpthat
offersachoiceofdefaulticonswillhaveablacktriangleinthelowerrightcorner
whenyoupointtoitsbox.
Figure 5-01: Black triangle showing that the Divider UnitOp offers a choice of icons
ToselectanewdefaulticonforaUnitOp,clicktheblacktriangletoseeapopup
selectionboxwithallavailableicons.Clicktheiconyouwanttouse;thaticon
replacesthepreviouslydisplayedicononthepalette.Youcanchangethedefault
iconforaUnitOpasoftenasyoulike.
Figure 5-02: Selecting a new default Divider UnitOp icon
37
Manipulating UnitOp Icons

AfterdrawingaUnitOpicononaflowsheet,youcanmove,resize,ordeletetheicon
asneeded.
1. Verifythatthemousepointercurrentlydisplayedisanormalarrow.Ifthe
pointerdisplaysasaUnitOpiconoutline,rightclicktoturnoffUnitOp
drawing.
2. ClicktheUnitOpiconsothatitsfoursizinghandles(blackboxesateach
corner)appear.
3. ManipulatetheUnitOpiconasneeded:
TomovetheUnitOp,clicktheiconanddragtoitsnewlocation.
ToresizetheUnitOp,clickanysizinghandleanddraginwardor
outwardtoachievethedesiredsize.
TodeletetheUnitOp,rightclickandselectDelete,orsimplypressthe
[DELETE]keyonyourkeyboard.
UnitOp ID Numbers
WhenyouplaceUnitOpsonyourflowsheet,CHEMCADassignseachoneaUnitOp
IDnumberthatisuniquewithinthesimulation.TheUnitOpIDnumberisan
importantidentifierfortheunit,andisusedinvariousreportsandchartsasyou
workwiththesimulation.Bydefault,yourUnitOpswillbenumbered,startingat1,
intheorderinwhichyoucreatethem;alltypesofequipmentsharethesamepoolof
IDnumbers.
IfyouwanttogroupyourUnitOpsnumericallybyequipmenttype,youcanuse
theStartingIDsfeaturetoaccomplishthis.
SelectFormat>StartingIDs,whichbringsuptheStreamandUnitOpStarting
IDsdialogbox.HereyoullseeeachtypeofUnitOpavailableinCHEMCAD,each
withadefaultsettingof1.ThismeansthatanynewUnitOpwillbeassignedanID
fromthesamenumberpoolthenextnumber(1orgreater)thathasnotbeenused
yetinthissimulation.
Tosetupseparaterangesofnumbersfordifferentequipmenttypes,youcanedit
thevaluesintheStreamandUnitOpStartingIDsscreen.Forexample,youcouldset
theHeatExchangervalueto200,thePumpvalueto300,thePipevalueto400,and
soon,usinganystartingvaluesthataremeaningfultoyou.AnyUnitOptypeyou
dontassignastartingvaluewillpullIDnumbersfromthepoolstartingwith1,
skippinganynumbersthatarealreadyassigned.
38
Drawing and Connecting a Stream

Beforeyoucanaddastreamtoaflowsheet,youmustalreadyhavedrawnthe
UnitOpsthatthestreamwillconnect.Followthesestepstoaddastream:
1. ClicktheStreamtoolintheupperrightcorneroftheAllUnitOpspalette.
2. Movethecursorontotheworkspace,notingthatthepointernowappearsas
asmallplussign.FindtheiconfortheUnitOpwherethestreamwillstart,
andpointattheiconsothattheblueinletdotsandredoutletdotsarevisible.
IfthisUnitOpoffersmorethanoneoutletlocation,decidewhichoneyouwill
use.
3. Pointattheredoutletdotsothatthepointerturnsintoasmallblackarrow.
Clickandreleasetheleftmousebuttontostartdrawingthestream.
4. MovethecursortowardtheUnitOpwherethestreamwillend.Asyou
approachtheUnitOpicon,theinletandoutletdotsonthaticonwillbecome
visible.Ifmorethanoneinletlocationisavailable,decidewhichoneyouwill
use.
5. Whenyoureachtheblueinletdot,clickthemouseagaintocompletethe
stream.
Afteryoudrawastream,theStreamtoolremainsactivesothatyoucandraw
anotherstreamrightawayifdesired.Toturnoffstreamdrawing,simplyclickon
anyblankareaoftheworkspace;thisreturnsyourpointertothenormalwhite
arrow,whichyoucanusetoselectandmanipulateitemsontheflowsheet.
Choosing a Stream Route

IfyoudrawastreambyclickingonlyattheUnitOpoutletandinlet,CHEMCAD
choosestheshortestandmostdirectpathforthestream.Insomesituationswhena
UnitOpisinthedirectpathofthestream,forexampleyouwillneedtochoosea
deliberaterouteforyourstream.
Todothis,clickthemouseasyoumovefromoutlettoinlet,whereveryouwant
thestreamtomakeaturn.Eachtimeyouclick,thestreamfreezesinplace,andfrom
thereyoucanmakea90turntoeithertheleftortheright.Youcanaddasmany
detoursasyouliketoastreambeforebringingitintoaUnitOpinlet.
39
Figure 5-03: Stream 2 with automatic routing (above) and deliberate routing (below)
Rerouting a Stream
Evenafteryouvecompletedyourflowsheetandaddeddetailedinformationabout
yourstreams,youcanstillrerouteastreamifneeded.Todothis,clickthestreamto
selectit,thenrightclickandselectReroutestream.Theoldstreamdisappears,
replacedbythebeginningofanewstreamoriginatingatthesameoutlet.
Youcannowclicktocreate90turns,thesamewayyouwouldwithanew
stream,toroutethestreamexactlywhereyouwantit.Yourlastclickmustcomplete
thestreamatthesameinletyouusedbefore.Afterastreamisrerouted,itretainsall
ofthestreamdetailthatyouhadpreviouslyentered.
Stream ID Numbers
Whenyoudrawstreamsinyourflowsheet,CHEMCADassignseachoneastream
IDnumberthatisuniquewithinthesimulation.Thestreamnumberisanimportant
identifierforthestream,andisusedinvariousreportsandchartsasyouworkwith
thesimulation.Bydefault,yourstreamswillbenumbered,startingat1,intheorder
inwhichyoucreatethem.
IfyouwanttocreateaseriesofstreamswithaseparaterangeofIDnumbers
fromtherestofyoursimulation,youcanusetheStartingIDsfeaturetoaccomplish
this.
SelectFormat>StartingIDs,whichbringsuptheStreamandUnitOpStarting
IDsdialogbox.ThenscrolldowntotheStreamoptionandclicktheadjacentnumber
column.EnterthenumberthatwillbethestartofyourseparatestreamIDpool,and
40
clickOK.IfyoulaterneedtodrawmorestreamswithIDnumbersinthenormal
range,youcanreturntothisdialogboxandreloadthedefaultsetting.
Forexample,todrawaseriesofutilitystreamswithIDnumbersstartingat300,
youwouldsetthestreamstartingIDoptionto300anddrawthestreamsinquestion.
Thosestreamswouldbenumbered300,301,302,andsoforth.Afterdrawingallof
yourutilitystreams,youwouldthensettheStreamIDoptionbackto1,sothatthe
nextnewstreaminthemainflowsheetwouldbeassignedthenextavailablestream
IDfromtheregularpoolofnumbers.Youcanresetthestreamoptionnumberas
manytimesasneededwhileyoucreateandedityoursimulation.
Other Drawing Tools

InadditiontotheStreamtoolandthevariousUnitOpicons,thePalettepaneoffersa
texttool,aswellastoolsfordrawingrectangles,ellipses,lines,multipartlines,and
polygons.
The Text Tool

Toplacetextonaflowsheet,selecttheTexttool(whichdisplaysalargeletterT)on
theAllUnitOpspalette.Whenyoumoveyourcursorovertheworkspace,youll
nowseethatyourpointerhasbecomeaverticalline.Clickthemousetoplacea
blinkingcursorontheflowsheet.
Starttypingthetextthatyouwanttoadd.Youwillseethetextappearwherever
youclickedthemouse.Whenyoufinish,clickanywhereintheworkspacetoturnoff
theTexttool.
Youcannowclickanddragyournewblockoftextaroundtheworkspace.You
canalsoselectFormat>ColororFormat>Fonttoaccessvariousstandardtextand
objectformattingtools.
Simple Drawing Tools: Rectangle, Ellipse, and Line

Youcandrawvariousshapesasneededonaflowsheet.Thesimplestoftheseshapes
todrawarerectangles,ellipses,andlines.
Toaddanyoftheseshapestoaflowsheet,simplyclickthecorrespondingtoolin
theAllUnitOpspalette.Then,thenclickanddragintheworkspacetodrawthe
shape,releasingthemousebuttonwhenyouhaveachievedthedesiredsizeand
shape.
Notethattomakeaperfectsquareorcircle,youcanholddownthe[SHIFT]key
asyoudrawwiththeRectangleorEllipsetool,respectively.
Complex Drawing Tools: Multi-line and Polygon

Inadditiontothesestraightforward,clickanddragshapes,youcanalsocreatemore
complexshapesandlinesonaflowsheet.
Tocreateanyopenfigurewithanirregularshape,selecttheMultilinetoolinthe
AllUnitOpspalette.Moveyourcursortotheworkspaceandclickintheareawhere
41
youwanttostartdrawing.Thenmovethecursorandclickagaintocreatethe
shapesfirstline.Keepclickingandmovingthemouseuntilyouvecreatedthe
shapeyouwant,andthendoubleclicktocompletetheshapeandturnofftheMulti
linetool.
Tocreateanirregularclosedpolygon,selectthePolygontoolandthenmove
yourcursortotheworkspace.Clickwhereyouwanttostartdrawing,andthenclick
asecondtimetocreatethefirstsideofyourpolygon.Afterthesecondclick,youll
begintoseetheopenareabeingcreated.Continuemovingthecursorandclicking
untilyouarereadytoplaceyourlastpoint,andthendoubleclicktocompletethe
shapeandturnoffthePolygontool.
Notethatyoucanholddownthe[SHIFT]keywhileusingthePolygontoolto
createarighttriangle.
Selecting Chemical Components

Youcanselectchemicalcomponentsforyoursimulationatanypointwhilecreating
theflowsheet,oryoucanwaituntilyouvedrawntheentireflowsheetbeforeadding
components.Beforeyoucanrunthesimulation,youwillneedtolistevery
componentinvolvedinyourchemicalprocesssothatCHEMCADcanworkwith
thosecomponentsproperties.
ThesechemicalcomponentsarepulledfromCHEMCADscomponentdatabase,a
masterlistofthousandsofchemicalswiththeirassociatedproperties.Whenyoure
readytolistcomponentsforyoursimulation,selectThermophysical>Select
ComponentstoopentheSelectComponentsdialogbox.Notethatyoucanalsoopen
thisdialogboxbyclickingtheSelectcomponentsbuttononthetoolbar.
Figure 5-04: The Select components button
42
Figure 5-05: The Select Components dialog box
TheAvailableComponentscolumnliststhecontentsoftheCHEMCAD
componentdatabase,whiletheSelectedComponentscolumnliststhecomponents
currentlyincludedinthissimulation.Foranewsimulation,theSelected
Componentslistisemptyatfirst.
Everychemicalthatwillbepartoftheprocess,whetheritsafeedstream,
product,orutility,mustbelistedonthissimulationscomponentlist.
Finding a Component
BecauseofthelargenumberofcomponentsintheCHEMCADcomponentdatabase,
scrollingupanddownthelistofavailablecomponentscanbetimeconsuming.To
findaspecificcomponentquickly,usetheSearchfieldatthebottomoftheSelect
Componentsdialogbox.
TypethenameofthechemicalyouwanttofindintheSearchfield.Witheach
letterthatyoutype,CHEMCADsuggestspossiblematchesintheAvailable
Componentslist.Inthefollowingexample,typingtheletterswaintheSearchfield
hashighlightedtheWatercomponent.
43
Figure 5-06: Using the Search field to locate the Water component
Notethatinsomesituations,thefirstresultmaynotbetheoneyouwant.For
example,typingethaneintheSearchfieldbringsuptheMethanecomponentat
first.Toseethenextmatchforyourtext,clickNext;continueclickingthisbuttonas
neededuntilyoufindthedesiredcomponent.
TheSearchfieldacceptsbothtextandnumericentries.Bydefault,CHEMCAD
willsearchforyourentryamongallchemicalnames,chemicalformulas,and
CHEMCADdatabaseIDs;ifyoulike,youcanalsosearchbyCASnumber.Toturn
anyofthesesearchoptionsonoroff,clicktheOptionsbuttonbelowtheSearchfield.
ThisbringsuptheSearchOptionsdialogbox,whereyoucanspecifywhichdatato
includeinyourcomponentsearches.
Figure 5-07: Selecting which data to include in component searches
Note:YoucanaddyourowncustomcomponentstotheCHEMCADcomponent
database.Formoredetailsaboutthisfeature,seeChapter10ofthismanual.
Adding a Component
OnceyouvelocatedthecomponentyouwantintheAvailableComponentslist,
simplydoubleclickthecomponenttoaddittotheSelectedComponentslistforyour
simulation.
YoucanalsoselectmultiplecomponentsintheAvailableComponentslistand
thenclicktherightarrowbutton,locatedbetweenthetwocolumns,toaddthe
44
componentstoyoursimulation.Toselectmultiplecomponents,useWindows
standardselectionmethodsofholdingdown[SHIFT]toselectcontiguousitemsor
holdingdown[CTRL]toselectnoncontiguousitems.
Figure 5-08: Adding multiple components using the right arrow button
Ifyouwouldliketoduplicatethecomponentlistfromanexistingsimulation,
clickCopyFromAnotherSimulation.IntheresultingOpendialogbox,navigateto
thedesiredsimulation,selectthatsimulation,andclickOpen.TheSelected
Componentslistisnowpopulatedwiththecomponentsusedinthesimulationyou
selected;youcanaddordeleteitemstocustomizethelist.
Changing the Order of Selected Components

WhenyourSelectedComponentslistforasimulationisparticularlylong,youmay
findithelpfultoplacecertaincomponentsateitherthetoporthebottomofthelist.
Youcanaddcomponentsinanyorder,andthenmovethemaroundinthelistas
needed.
TomoveacomponenttoanewpositionintheSelectedComponentslist,click
thecomponenttoselectitandthen:
ClickToptomoveittothefirstpositiononthelist.
ClickUptomoveituponeposition.
ClickDowntomoveitdownoneposition.
ClickBottomtomoveittothelastpositiononthelist.
Removing Items from the Selected Components List

ToremoveasinglecomponentfromtheSelectedComponentslist,clickthe
componenttoselectitandthenclickDeleteinthebottomrightareaoftheSelect
Componentsdialogbox.
45
ToremoveallcomponentsfromtheSelectedComponentslistandbeginagain,
clickClear,justtotherightofDelete.Ifyouhavechangedyourmindaboutadding
componentsatthistime,youcansimplyclickCanceltobackoutofcomponent
selection.
Selecting K-value and Enthalpy Options

ThefirsttimeyoucompletetheComponentSelectiondialogbox,youllbetakento
theThermodynamicsWizarddialogbox.Atthispoint,youcaneitherclickCancelto
skipthewizardandenterthermodynamicsmanually,orenterparametersinthe
dialogboxandclickOKtoseewhichmethodsthewizardsuggests.
Using the Thermodynamics Wizard

Properselectionofthermodynamicsisgenerallythemostimportantstepina
processsimulation.Apoorthermodynamicsselectionmayleadtounrealistic
simulationresults.
TheThermodynamicsWizardmakesgeneralsuggestions,basedonyour
componentlistandthespecifiedrangesfortemperatureandpressure.
Selecting Components to Ignore

Intheupperportionofthewizardscreen,usethedropdownboxestoindicateany
componentsthattheThermodynamicsWizardshouldnotconsider.Thismayaffect
theresultsformodelsuggestion.Forexample,ifyouareusingwaterasacoolant
andyourothercomponentsarealkanes,theThermodynamicsWizardwillchoose
UNIFAC.Ifyouspecifythatwatershouldbeignored,thewizardwillignorethe
waterandselectSRK.
Specifying Process Conditions

Inthelowerportionofthewizardscreen,specifytheapproximatetemperatureand
pressurerangesforthisprocess.Enteringaccurateinformationinthesefieldswill
helptheThermodynamicsWizardreturnamoreusefulrecommendation.
IntheBIPDataThresholdfield,entertheminimumpercentageofpossible
binaryinteractionparameters(BIPs)whichmustbepresentinaBIPactivity
coefficientmodel(NRTL,Wilson,etc).WithoutBIPs,activitycoefficientmodels
simplifytoRaoultslaw.
How the Thermodynamics Wizard Makes Suggestions

CHEMCADsThermodynamicsWizardfollowsalogictreetochooseamodel.The
logictreeassumesthatallyourcomponentsaremixedinavessel,withconditions
fallingintothespecifiedtemperatureandpressureranges.
46
Ifallcomponentsarehydrocarbons,thewizardwilllikelysuggestan
equationofstate.
Ifwaterispresent,thewizardwilllikelyselectanactivitycoefficientmethod.
Ifwaterandhydrocarbonsarepresent,thewizardwilllikelyselectUNIFAC.
Ifwaterandstrongelectrolytes(HCl,NaOH,etc.)aredetected,thewizard
willsuggestelectrolytemodels.
Temperatureandpressurerangewillaffecttheselectionofmodel.Ifpressureis
high,CHEMCADismorelikelytosuggestanequationofstate.Ifpressureis
atmosphericandtemperatureisbelowthenormalboilingpointofallcomponents,
CHEMCADmaychoosealiquidactivitymodeloridealvaporpressure.
Should the Thermodynamics Wizard be trusted to make design decisions?

Usethewizardasastartingpointforyourdecision.Properselectionof
thermodynamicsistheengineersresponsibility.Yoursimulationmaycallforthe
useofadifferentthermodynamicmodelthanwhattheThermodynamicsWizard
suggests.
Manually Selecting Thermodynamics Settings

Tosetupthermodynamicsforyoursimulationmanually,followthesesteps:
1. SelectThermophysical>ThermodynamicSettings,orclickthebuttonbythe
samenameonthetoolbar.
Figure 5-09: The Thermodynamic Settings button on the toolbar
2. ThisopenstheThermodynamicSettingsdialogbox.Startbydetermining,
basedonyourprocessknowledge,whetheryoursystemhastwoliquid
phasesorasingleliquidphase.IntheGlobalKValueModelfield,selecta
methodthatcancalculatethephasebehaviorrelevanttoyoursystem.
3. Basedonthespecificcircumstancesofyourprocess,makeanyneeded
alterationstotheoptionsdisplayedontheKvalueModelstab.Notethatthe
optionsappropriatetoyourselectedKvaluemethodaredisplayedinblack,
whileirrelevantoptionsaredisplayedingray.
4. ClicktheEnthalpyModelstab,selectthemostappropriatemodelinthe
GlobalEnthalpyModelfield,andmakeanyotherchangestotheoptionson
thistabasneededforyourprocess.
5. ClicktheTransportPropertiestabandverifythatthesettingsthereare
appropriateforthissimulation.Changeanysettingsasneededandthenclick
OKtoclosetheThermodynamicSettingsdialogbox.
6. Ifyouvemadeanychanges,amessageboxappears:Allstreamsshouldbe
reinitialized.Proceedwithreinitialization?ClickYestoreinitializeallstreams
now,orNoifyoudprefertowaitandreinitializethestreamslater.
47
Defining Streams
Thestreamsthatyouhavedrawnonyourflowsheetarestilljustlineswithnodata
behindthem,sothenextstepistoeditthesestreams,populatingthemwith
compositiondataandotherproperties.
Note:Inmostsituations,thestreamsyoullneedtodefinewillbethefeedstreamsin
yourprocess.Othertypesofstreams,suchasrecyclecutstreams,mayalsorequire
definition.
Youcaneditasinglefeedstreamusingeitherofthesemethods:
Doubleclickthestream.
OntheSimulationtabintheCHEMCADExplorer,expandFlowsheetand
thenStreams,rightclickthestreaminquestion,andselectEditStream.
Youcaneditallfeedstreamsintheflowsheetatonceusingeitherofthese
methods:
SelectSpecifications>FeedStreams.
ClicktheEditFeedStreamstoolbarbutton(justtotheleftofthegreenRun
Allbutton).
Whichevermethodyouchoose,youllseetheEditStreamsdialogbox,with
eitherasinglecolumnofdataoracolumnforeachfeedstreamintheflowsheet.In
thisdialogbox,specifypropertiesforeachfeedstreamlisted.
Thermodynamic Properties
Youmustspecifyexactlytwoofthefollowingthreevariables:
Temperature
Pressure
Vaporfraction
CHEMCADwillcalculatethethirdvariableandenthalpy,basedonthetwo
variablesyouspecifyandthethermodynamicsmethodyouveselected.
48
Stream Composition
Todefinethestreamcomposition,youllneedtospecifyacompositionunitandthe
amountofeachcomponentthatispresentinthestream.
SelectaunitfromtheCompunitdropdownlist,andthenbasedonthat
selection,populatethefieldforeachcomponentwiththeappropriateamount,
percentage,orfraction.
Forstreamcompositionsexpressedasapercentageorfraction,youcanenter
valuesthatdonottotal100%.Inthiscase,CHEMCADwillnormalizethe
compositiontofractionalvaluesthattotal1.Topreviewthenormalizedvaluesthat
CHEMCADassignstothecomponents,clickFlash.
Total Flow Properties

Ifthecomponentflowengineeringunitusedforastreamisdimensionless(i.e.,mole
fraction,weightfraction,orvolumefraction),youmustspecifythefollowingflow
properties:
Totalflow
Totalflowunit
Ifyouenteryourcomponentamountsasfractions,thenyoumustalsoentera
totalflowrate.Ifyouentercompositionamountsusingquantitativeflowunits,
CHEMCADcalculatesthetotalflowrateforyou.
Specifying Equipment Parameters

Onceyouhavespecifiedthenecessarystreampropertiesforyoursimulation,the
nextstepistoenterspecificationsfortheUnitOps.Youcaneditthepropertiesofa
UnitOpusinganyofthefollowingmethods:
DoubleclicktheUnitOpiconontheflowsheet.
ClicktheUnitOpiconandthenselectSpecifications>EditUnitOps>Select
UnitOps.
OntheSimulationtabintheCHEMCADExplorer,expandFlowsheetand
thenUnitOps,rightclicktheUnitOpinquestion,andselectEditUnitOp
Data.
ThedialogboxthatdisplayswhenyougotoeditaUnitOpspropertieswill
dependonthetypeofUnitOp.TheStreamMixerUnitOp,forexample,hasonlyone
specificationthatyoucanset,whiletheSCDSDistillationColumnUnitOphasfive
tabbedpagesofdetailedsettings.
49
Figure 5-10: Two different UnitOps that require very different amounts of input
ThedetailedinformationaboutthespecificationsforeachtypeofUnitOpis
containedintheCHEMCADHelpsystem,whichyoucanaccessfromany
CHEMCADscreenbypressingthe[F1]key.
Thesespecificationscreensdo,however,havecertainrulesincommon:
Itemswithgreentextlabelsarerequiredentries.
Allotherentriesareoptional.
ClickingOKsavesyourspecificationchanges;clickingCanceldiscardsthem.
AfteryouclickOK,CHEMCADchecksyourdataforinternalconsistencyand
thenreturnserrorsorwarningsaswarranted.TheseitemsdisplayintheMessages
paneintheCHEMCADwindow.
Running the Simulation

NowthatyouvedrawntheflowsheetandaddeddetailtothestreamsandUnitOps
thatmakeuptheflowsheet,youcanrunthesimulation.YoucaneitherselectRun>
Run>RunAllorsimplyclickthegreenRunAllbuttononthetoolbar.
Whenyourunasimulation,CHEMCADcalculatesmaterialandenergybalances
throughouttheentireflowsheetandreturnsanyerrorsorwarningsdiscoveredin
theflowsheet.Iftheruncompletessuccessfully,aRunfinishedmessageappearsat
thefarleftofthestatusbar,attheverybottomoftheCHEMCADwindow.
Note:ForpreliminarychecksofindividualUnitOpsorgroupsofUnitOps,youcan
selectRun>Run>RunSelectedUnitOps,orrightclickanyUnitOponthe
flowsheetandselectRunthisUnitOp.
50
Reviewing the Results

Afterasimulationhasrun,youcancallupanynumberofindividualtextbased
reportsorgraphicalplots,eitherforonscreenviewingorforprinting.Reportscan
providedataonanysinglestreamorUnitOp,oranygroupofstreamsorUnitOps,in
asteadystateordynamicsimulation.Youcanalsorequestaconsolidatedreportthat
providescomprehensivedataonthestreamsandUnitOpsyouselect.
Note:CHEMCADreports,plotting,andplotprintingarecoveredindetailin
Chapter8,OutputandReports.
51
52
Chapter 6
Using CHEMCAD for High-fidelity Modeling
UnitoperationspecificationsinCHEMCADvarygreatlyindetail,fromvagueand
conceptualtoextremelyspecificandrealistic.Dependingonthedemandsofyour
processandwhatyouretryingtoachievewithyoursimulation,youmayworkwith
whatwecalllowfidelitymodeling,highfidelitymodeling,orboth.
ThischapteraddressesCHEMCADscapacityforhighfidelitymodelingand
howtoachieveahighlevelofrealismwithyourUnitOps.
What is high-fidelity modeling?

Withlowfidelitymodeling,youspecifywhatyouwant,orwhatyouhaveobserved,
andCHEMCADmakesitscalculationsbasedontheassumptionthatyoucan
achievewhatyouvespecified.Itscommontospecifyobservedpropertiessuchas
temperatureand/orpressurecomingoutofaUnitOp,orcomponentpuritycoming
outofaseparationunit.Specifyingtemperaturecomingoutofaheatexchangerisan
exampleoflowfidelitymodeling.
Highfidelitymodeling,ontheotherhand,requiresthatyouenternumerous
extensivevariables.CHEMCADcalculatestheresultingconditionsbasedonthese
detailedentries.Withhighfidelitymodeling,youreoftenrequiredtospecify
geometryrelatedvariablesforaUnitOpsothatCHEMCADcancalculateprecise
conditionsattheequipmentsoutlet.
Heresthekeydistinctionbetweenlowfidelityandhighfidelitymodelingin
CHEMCAD:
Lowfidelity:YouspecifythedesiredresultsandCHEMCADassumesthatyou
canachievethoseresultswiththeequipmentyouhave.
53
UsingCHEMCADforHighfidelityModeling
Highfidelity:YouspecifyenergyandequipmentparametersandCHEMCAD
calculatestheactualresults.
Criteria for High-fidelity Modeling

TotakeadvantageofCHEMCADshighfidelitymodelingcapabilities,youmust
providedetailedspecificationsforyourequipment.Todothis,mostUnitOpsrequire
thatyouselectacalculationmodethatallowsforentryofhighfidelitycaliberdetail.
Forexample,ifyouhaveapumpthatissettothedefaultmodeofSpecifyoutlet
pressure,youllgetalowfidelityresultfromthispumpthatis,thesimulationwill
usetheoutletpressurethatyouspecify,butwithoutconsiderationforthesizeofthe
pump,theamountoffluidenteringthepump,orinletpressure.
IfyouswitchthepumptoSpecifyperformancecurve,ahighfidelitymode,youll
needtoenterdatapointsfromthepumpsperformancecurve,eitherforasingle
speedlineorformultiplespeedlines.Usingthismode,CHEMCADwillcalculate
thechangeofpressureheadbasedontheperformancedataandtheinletvolumetric
flowrate.Thisprovidesarealisticpressureincreasefortheactualpumpthatyour
processuses.
NoteverytypeofCHEMCADUnitOplendsitselftohighfidelitymodeling.The
followingsectionsdiscussvarioustypesofUnitOpsthatdoofferhighfidelity
calculationmodes,andprovidesomebasicinformationabouthowtousethose
modes.
Introduction to Equipment Sizing

EquipmentsizinginCHEMCADisoptional.ItentailsusingtheSizingmenu
options,generallyafterrunningasimulation,tocalculateapproximatesizesfor
pipes,vessels,valves,orifices,andotherequipment.
Figure 6-01: The Sizing menu, showing heat exchanger sizing options
Equipmentsizingcancomplementlowfidelityresults,andoftenprovidesan
excellentstartingpointforhighfidelitymodeling.Youcanusecertainsizingresults
asinputforhighfidelitymodelsofUnitOpsinyoursimulation.Specifying
geometricparametersforUnitOpscanhelpyouobtainmorerealisticresults.
Notethatforlowfidelitymodeling,sizingdoesnotchangeconvergedflowsheet
results.Also,forsomeUnitOps,certaingeometryparametersmustbeentered
regardlessoftheselectedcalculationmode.
54
High-fidelity Modeling and Sizing for Common UnitOps

HighfidelitymodelingdoesnotapplytoallCHEMCADUnitOps.Thissection
summarizesthoseUnitOpsforwhichyoucanusehighfidelitymodeling,and
comparesthatapproachforeachUnitOptypetolowfidelitymodeling.Where
applicable,UnitOpsizingisalsodiscussedasitrelatestolowfidelityversushigh
fidelitymodelingoftheseUnitOptypes.
Piping
Youcanuseeitherloworhighfidelitymodelingforpipinginyoursimulation.
Pipelinesizingisdonebasedonthecompositionofaselectedstream.
Low-fidelity
Forlowfidelitymodelingofpiping,youarerequiredtospecifypipediameterand
lengthinmostmodes;designmodesthatcalculatediameteraretheobvious
exceptiontothis.Thepressuredropthroughthepipeiscalculatedbasedon
diameter,length,andflowratethroughthepipe.
Sizing
Toperformsizingcalculations,selectSizing>Piping.Selectoneormorestreams,
theninthePipeSizingdialogbox,selectasizingoptionandclickOKforlinesizing
results.Youcanusetheseresults,suchassuggestedpipethicknessanddiameter,to
specifygeometryforaPipeUnitOp,orsimplyreviewthemfortheinformationyou
need.
Figure 6-02: Line sizing results from the Pipe Sizing dialog box
55
High-fidelity
Inhighfidelitypipingmodels,PipeUnitOpsinteractwithNodeUnitOpstobalance
pressureandflowrateshydraulicallyamongconnectedpiecesofflowbased
equipment.NodesmustbeplacedonbothsidesofallPipeUnitOpstobeincluded
inhydraulicbalance;pressureandflowconstraintsaresetatthenodes,notinthe
pipes.
Ahighfidelitypipingmodelcanshowchangesinflowratebasedonback
pressurewheretwopipesmix,whereasalowfidelitymodelwouldsimplyassign
theloweroftwospecifiedpressurestotheoutletwithoutconsiderationforback
pressure.
Pumps, Compressors, and Expanders

Youcancreatepump,compressor,andexpanderUnitOpsusingeitherlowfidelity
orhighfidelitymodeling.
Low-fidelity
Fortheseequipmenttypes,CHEMCADcalculatespowerusageandthermaleffects
onthefluid,basedonspecifiedoutputpressureorpressureincrease.Other
parameters,suchasefficiency,areoptionalbutdoaffectresults.
High-fidelity
Toproduceahighfidelitymodelfortheseequipmenttypes,youmustselectthe
operationmodeinwhichyouspecifyperformancecurvesthatis,pressurechange
asafunctionofvolumetricflowrate.Thisperformanceinformationisgenerally
availablefromtheequipmentvendor.Basedonthevolumetricflowenteringthe
UnitOp,CHEMCADcalculatesoutletpressure.
Aswithpiping,highfidelitymodelingforpumps,compressors,andexpanders
canbeusedwithnodesaspartofahydraulicflowbalancednetwork.
Vessels and Tanks

Youcanaddvesselsandtankstoyoursimulationsusinghighfidelitymodeling,or
performlimitedapproximationoftheseequipmenttypeswithlowfidelityinsteady
state.Sizingisavailableforcertaintypesofvessels.
Low-fidelity
Withlowfidelitymodelingofavesselortank,astreamenterstheFlashUnitOpand
separatesintovaporandliquid;CHEMCADdoesnotconsiderholduporliquid
levelinthetank.Ifyouwanttotakeasteadystatesnapshotofthevessel,youcan
manuallyadjusttheflowrateand/orthermalconditionstomakevolumetricflow
ratesmatchthevolumeofthevessel.
Note:TheTankUnitOpisspecificallyintendedforusewiththeBatchColumn
UnitOp.Itdoesnotrepresentastandardstoragetankforgeneralpurposes.
56
Sizing
Tocalculatesizingforavessel,selectaFlashUnitOpandthenselectSizing>Vessel.
ChooseeitherLVVessel(liquidvaporvessel)orLLVVessel(liquidliquidvapor
vessel),dependingonyourneeds.Intheresultingdialogboxes,enterthe
appropriatevaluesforyourvesselandclickOK.
Figure 6-03: Sizing a vessel in CHEMCAD
TheresultsthatCHEMCADreturnsincludebasicvesselgeometrysuchasheight
anddiameter.
Youcanalsoperformvesselsizingonaconvergeddistillationcolumnto
calculategeometryforarefluxdrumorsimilarpieceofequipment.
High-fidelity
Youcanperformhighfidelitymodelingonlyonbatchreactorsanddynamicvessels,
andonlywithaCCDYNAMICSlicense(fordynamicvessels,aCCSAFETYNET
licensewillsuffice).IfyouspecifythegeometryofyourvesselanduseCHEMCADs
dynamicsmode,youcanstudywhathappensinthevesselovertimeasmaterialis
addedorwithdrawn.
Unlikesimpleflashvessels,batchreactorsanddynamicvesselsdoconsider
holdup,liquidlevel,andvariablepressureovertime.
Valves
ValvemodelinginCHEMCADcanbeeitherlowfidelityorhighfidelity.Youcan
sizeacontrolvalvebasedonanyflowsheetstream.
Low-fidelity
TheVALVUnitOpisusedforlowfidelitymodelingofavalve.Forthistypeof
UnitOp,youspecifyoutletpressureorpressuredecreasethroughthevalve.
57
Sizing
SelectSizing>ControlValve,thenselectastream.IntheControlValveSizing
dialogbox,specifytheoutletpressureforthetheoreticalvalve,andenterother
specificationsasappropriate.WhenyouclickOK,CHEMCADreturnsinformation
suchascapacitycoefficient(Cv)andvalvesize.
Figure 6-04: The Control Valve Sizing dialog box
High-fidelity
TheCVALUnitOpisusedforhighfidelityvalvemodeling.Decidewhichvalues
youwillprovideandwhichvaluesCHEMCADwillcalculate,andselectthe
appropriateoperatingmodeintheControlValvedialogbox.ProvidethevalvesCv
value,andanyotherspecificationsasneeded.
Controlvalvescanbeusedwithnodesaspartofahydraulicflowbalanced
network.
Columns
ColumnsinCHEMCADcanbemodeledaseitherlowfidelityorhighfidelity.You
canperformsizingonanyconvergedcolumn.
Low-fidelity
Forlowfidelitymodelingofcolumns,usetheTower,TowerPlus,orSCDSUnitOps.
Specifyidealstagesandtheconditionsatthereboilerandcondenser,asapplicable.
Alowfidelitycolumnmodeldoesnotconsidermasstransfereffectsorcolumn
internals.
Differentcolumnspecificationscanprovidemorerealismwithouttaking
geometryintoaccount.Specifyingtoppurityisaverylowfidelitymodel,while
specifyingrefluxratioorcondenserdutycanbringyourresultsclosertoreality.
Sizing
Afterrunningyoursimulation,clicktheUnitOprepresentingthedistillationcolumn
andselectSizing>Distillation;chooseeitherTraysorPacking,basedonthetypeof
column.
58
Theresultingdialogboxespromptyoutoenterinformationaboutyourtraysor
packingandthecalculationmethodsyouwanttouseforcolumnsizing.Youwill
generallyneedtoentersomegeometryandhydraulicparameterstocomplete
columnsizing.
Figure 6-05: Specifying high-level tray data for distillation column sizing
Figure 6-06: Specifying detailed tray data
Basedonflowsheetvaluesandyoursizinginput,CHEMCADreturnscolumn
geometryinformationsuchasheightanddiameter.Italsoprovideshydraulic
performanceinformationsuchaspredictedamountofflooding.
Note:Theresultsofcolumnsizingcalculationsdonotinteractivelychangetheresults
oftheflowsheetsimulation.
59
High-fidelity
Toperformhighfidelitymodelingofadistillationcolumninsteadystate,usethe
SCDSUnitOpandselecteitherofthemasstransfersimulationmodelsforthe
column.
Youwillneedtospecifygeometryforthecolumnandchooseacalculation
methodfortheselectedmasstransfermodel.CHEMCADcalculatescolumn
performancebasedonyourpackingortrayspecifications.
Forcolumns,masstransferbasedmodelingperformsrigorousnonequilibrium
mixingofvaporandliquid,whereaslowfidelitymodelingassumesidealmixing.
Toperformhighfidelitymodelingofadistillationcolumnindynamics,specify
thegeometryofthecolumnanddetailsaboutthecontrolsystem.Thisdynamic
distillationcanconsidercolumnholdupandtheeffectofvariableschangingover
time.
Note:TheShortcutColumnUnitOpisnotarigorouscalculationmodel.Unlessyour
systemsatisfiestheconstantmolarunderflowassumption,youshouldconsider
usingadifferenttypeofdistillationcolumn.
Heat Exchangers
Whenspecifyingaheatexchangerinasimulation,youcanuseeitherloworhigh
fidelitymodelingaswellassizing,dependingonthetypeofheatexchanger
involved.
Low-fidelity
Whencreatingasimulation,youcanusealowfidelityapproachbysimply
specifyingthethermalconditionscomingoutoftheexchanger.Specifyingheatduty
insteadofmerelyanoutlettemperaturebringsyourresultsclosertoreality,butthis
approachstilldoesntconsidergeometry.
Sizing
YoucanusetheCCTHERMmoduleforrigorouscalculationofheattransfer
coefficient(U)basedonheatexchangergeometry.Inratingmode,CCTHERM
determineswhethertheuserspecifiedheatexchangeriscapableoftheflowsheet
heatexchangerperformance.Indesignmode,CCTHERMcalculatesanexchanger
designthatiscapableoftheflowsheetperformance.
High-fidelity
Forsomeexchangercategoriesspecificallyshellandtubeanddoublepipeyou
canusetherigorousCCTHERMmodeltocalculateheatexchangerperformance.
TheflowsheetresultsarebasedonrigorouslycalculatedUvalueandthespecified
exchangergeometry.Youcanalsodetermineapproximatefoulingofaunitifactual
outlettemperaturesareknown.
60
Figure 6-07: Heat exchanger summary report generated as an Excel worksheet
Relief Devices
Forreliefdevices,sizingisnotnecessarilydistinctfromlowfidelitymodeling.To
modeldynamicreliefofavessel,youcaninsteadusehighfidelitymodeling.
Low-fidelity
Tomodelasteadystatesnapshotofareliefdevice,selectSizing>ReliefDevice,
specifyratingordesignmode,andselecttheappropriateoptionsforyourrelief
scenario.WhenyouclickOK,CHEMCADreturnsareliefdevicecalculation
summary.
IfyouselecttheRigorousintegralanalysisdesignmethodwhensizingarelief
device,youwillobtainamoredynamicresult.
Figure 6-08: Selecting the rigorous integral analysis method for relief device design
61
High-fidelity
YoucanperformhighfidelityreliefdevicemodelingfortheBatchReactorand
DynamicVesselUnitOps.Youcanspecifythereliefdevicenozzlearea,aswellas
otherspecificationsforyourreliefscenario.Thisenablesyoutostudythedynamic
reliefofthevessel.
Licensing Considerations for High-fidelity Modeling

Tousetheheatexchangersizingfunctionality,youmustcurrentlyhaveavalid
licensefortheCCTHERMmoduleofCHEMCAD.Tousebatchreactors,youllneed
avalidlicensefortheCCDYNAMICSmodule.Fordynamicvessels,alicensefor
eitherCCDYNAMICSorCCSAFETYNETisrequired.
Eachofthesemodulesislicensedindependently.Tovieworchangethe
dispositionofyourvariousproductlicenses,seetheCHEMCADLicenseMonitor
screen(Tools>Options>Licensingwhenasimulationisopen,orLicense>
Licensingwhennosimulationisopen).
Ifyoudontcurrentlyhaveaccesstotheheatexchangersizingordynamics
featuresandwanttoaddanyofthesemodulestoyourcopyofCHEMCAD,contact
thepersonwithinyourorganizationwhohandlessoftwarelicensing,orif
appropriate,youcancontactChemstationsoraCHEMCADdistributordirectly.For
acompletelistofChemstationscontactsforallpartsoftheglobe,seeourwebsite
(www.chemstations.com).
62
Chapter 7
Building and Using a Dynamic Simulation
Whilesteadystatemodelingcanprovidealloftheinformationyouneedformany
purposes,itsofteninformativetolookcloselyatthechangesovertimethataffect
yourstreamsandequipment.CHEMCADsCCDYNAMICSmodulemakesit
possibletosimulateaprocessovertime.
What do we mean by dynamics?

Weusethetermdynamicstodescribemodelingachemicalprocessoverasetperiod
oftime.Duringthecourseofarealworldchemicalprocess,factorssuchasutility
temperature,feedcomposition,andliquidlevelstendtochange.Modelingthe
responseofyourprocesstothesechangescanhelpyouunderstandandpredictwhat
mighthappenwithyourprocessovertime.
Givenaflowsheet,alengthoftimetorun,andthecalculationintervaltouse,
CHEMCADcanreturndetailedresultsthattakeintoaccountthesetypesofchanges.
Theprogramcanconsiderthematerialholdupwithinprocessequipmentsuchas
tanks,reactors,andpipes.ItalsoenablesyoutomodelcontrolsystemssuchasPID
controllers.
Licensing Considerations
Tousethefunctionalitydescribedinthischapter,youmusthaveavalidlicensefor
theCCDYNAMICSmoduleofCHEMCAD.Tovieworchangethedispositionof
yourCCDYNAMICSproductlicense,seetheCHEMCADLicenseMonitorscreen
(Tools>Options>Licensingwhenasimulationisopen,orLicense>Licensing
whennosimulationisopen).
63
BuildingandUsingaDynamicSimulation
IfyoudontcurrentlyhaveaccesstothedynamicsfeaturesandwanttoaddCC
DYNAMICStoyourcopyofCHEMCAD,contactthepersonwithinyour
organizationwhohandlessoftwarelicensing,orifappropriate,youcancontact
ChemstationsoraCHEMCADdistributordirectly.Foracompletelistof
ChemstationscontactsandCHEMCADdistributorsforallpartsoftheglobe,seeour
website(www.chemstations.com/contact.htm).
Additional Input for Dynamic Operation

Beforeyoucreateadynamicsimulation,youllneedtogathertherelevant
informationaboutyourUnitOpsandstreams,asyouwouldwithanysimulation.In
addition,youneedtobeabletoanswerthefollowingdynamicsspecificquestions:
Howlongwillthesimulationrun?
Whatwillbetheinterval(deltatime/stepsize)betweencalculations?
Whatisthechangethatyouwanttostudyovertime?
Ifapplicable,whatistheinitialcompositionandchargeofanydynamic
vesselsorbatchreactors?
Thebasicstepsforadynamicsimulationarelargelythesameasthosefora
steadystatesimulation,withafewvitaldifferences:
1. Createanewsimulation.
2. Selectengineeringunits.
3. Drawtheflowsheet.
4. Selectcomponents.
5. Selectthermodynamicsoptions.
6. Specifyfeedstreamsandinitialstreamconditions.
7. SetspecificationsforUnitOps.
8. Runthesimulationinsteadystatetoobtaintimezerovalues.
9. Switchthesimulationtodynamics.
10. Specifydynamicssettings,suchasruntimeandinitialcharge(s).
11. Runthesimulationindynamics.
12. Reviewtheresults.
13. Rerunorextendthesimulationasneeded.
14. Generateplotsandreportsasneeded.
Beforeyoustartworkingonadynamicsimulation,itsimportanttohaveas
muchinformationaboutyourprocessaspossible,aclearideaofwhatyouwantto
findout,andastrategyforproducingtheresultsyouneed.
64
Strategies for Dynamic Simulations

Whenyoustartplanningadynamicsimulation,itsvitalthatyouknowwhat
questionorquestionsyouaretryingtoanswer.Togetuseful,informativeresults,
youshouldstartwithasimplequestionandthenrefinethesimulationandrunit
again.
Forexample,todiscoverhowheataffectsavesselstemperatureovertime,you
mightstartbyapplyingconstantheattothevesselforthedurationofyourdynamic
simulation.Youcanthensaveacopyofthatsimulation,changeittousevariable
heat,andreviewtheresultstoseehowtheydifferfromtheoriginal.Basedonthat
secondsimulation,youcanmakeanothercopy,andthistimetryvariableheatwitha
controlsystemtoattempttomaintainaconsistenttemperature.Eachofthese
dynamicsimulationswouldbringyouclosertowhatyouactuallywanttodiscover.
Eachsubsequentsimulationrequiresmoreinformationfromyoutorunandreturn
theresultsyouwant.
Whilethereisnorequirementthatyouapproachdynamicsproblemsthisway,
itsasoundpracticethatwillsaveyoutimeandfrustrationinthelongrun.
Setting Up Dynamic Operation

Beforeyoucanrunadynamicsimulation,youneedtoprovideparameterssuchas
runtimeandstepsize.First,however,youmustactivateCHEMCADsdynamics
mode.
Switching to Dynamics
Followthesestepstoswitchasimulationfromsteadystatetodynamicoperation:
1. OpenthesimulationandselectRun>Convergence.Thisbringsupthe
ConvergenceParametersdialogbox.
2. Inthelowerrightportionofthedialogbox,clickintheSteady
State/DynamicsfieldandselectDynamics.
Figure 7-01: Switching to dynamics
65
3. ClickOKtosavethechangesandclosethedialogbox.
Afteryouswitchtodynamics,youllnoticethatafewthingshavechangedon
theCHEMCADscreen:
ThestatusbaratthebottomofthemainCHEMCADwindowchanges.Afew
inchesfromtherightedgeofthescreen,insteadofthewordsSteadyState,
youllnowseeDTimeandatimecounterdisplayingthenumberofminutes
yoursimulationhasrun.Beforeyourunthesimulation,theDTimesetting
displays0:00min.
ThesteadystateRunAllbuttononthetoolbarisdisabled,andthedynamics
buttonsarenowactivated.Thesebuttons,showninFigure702,are(leftto
right)SetRunTime,ResettoInitialState,RunDynamicSimulation,Plot
DynStreams,andPlotDynUnitOps.
Figure 7-02: Toolbar buttons for dynamics
YoucannowselectRun>DynamicstobringuptheDynamicsMenu.This
windowprovidesconvenientaccesstoalldynamicssettingsandcommands.
Figure 7-03: The Dynamics Menu
Setting the Run Time

Thenextstepistosettheruntimeforthesimulation.Firstdecidewhetheryourrun
willrequireasinglestepormultiplesteps.
AstepinthiscasereferstoatimeperiodduringwhichCHEMCADwillcapture
datafromthesimulationatuniformintervals.Forexample,youmightsetupa
singlestepdynamicrunof60minutes,withastepsizeofoneminute,foratotalof
60datapointsfortherun.Ifthisisallthatyouneedtodo,yourruncanbe
accomplishedinasinglestep.
If,ontheotherhand,youneedtorunyourprocessfor60minutescapturingdata
atoneminuteintervals,andthenswitchtocapturingdataevery30secondsforthe
next20minutes,youllneedtousetwosteps.Ifyouwanttorecorddataeveryfive
minutesforthefirsthour,everyminuteforthesecondhour,andevery30seconds
forthethirdhour,youllneedtousethreesteps.
66
Thestepsizethatyouselectwillhaveanimpactontheaccuracyoftheresults
andthespeedofthecalculation.Smallertimestepsproducemorepreciseresults,but
alsorequiremoretimetomaketherun.Smallerisntalwaysbetter,however,as
extremelysmalltimestepscanleadtosignificantroundofferror.
Onceyouknowhowmanystepsyouneedtouseandwhatyourdatacapture
intervalwillbeforeachstep,followthesestepstosettheruntimeparameters:
1. ClickSetRunTimeontheDynamicsMenu,orclicktheSetRunTime
buttononthetoolbar.ThisbringsuptheDynamicRunTimeScheduledialog
box.
Figure 7-04: The General tab on the Dynamic Run Time Schedule dialog box
2. OntheGeneraltab,setthenumberofoperationstepsyouplantouse,or
leavethedefaultsettingof1.Themaximumnumberofstepsthatyoucan
specifyis10.
Note:Whenyouinitiallysetupdynamicsforasimulation,theCurrenttimedisplay
fieldonthistabwillbeempty.Afterthesimulationhasrun,thisfielddisplaysthe
totaltimeofacompletedrunorthecurrenttimeofaninterruptedrun.
3. NowclicktheStep1tabandspecifytheparametersforthisportionofthe
dynamicrun.EnterthetotaltimeforthisdynamicstepintheRuntimefield,
andtheintervalinminutesintheStepsizefield.
Figure 7-05: The Step 1 tab on the Dynamic Run Time Schedule dialog box
67
4. Ifyouhaveotherstepstospecify,clickeachtabinturnandentertheRun
timeandStepsizeinformation.
5. Whenyouhavespecifiedallsteps,clickOKtoreturntothemain
CHEMCADwindow.
TheDynamicRunTimeScheduledialogboxalsoallowsforconditionsother
thantimetodeterminethedurationofadynamicoperationstep.Ifyouselect
StreamorEquipmentinsteadofthedefaultTimeoption,youcanspecifyastream
orUnitOpparameterthatwilltriggertheendofthisstep,ifthatparameteris
reachedbeforethestepsruntimeisup.
Selecting Streams and UnitOps

Nowthatyouhavespecifiedhowlongyourdynamicprocesswillrun,youneedto
tellCHEMCADwhatstreamandUnitOpdatatorecordduringtherun.
1. IftheDynamicsMenuisnotalreadyopen,selectRun>Dynamicstoopenit,
thenclicktheRecordStreamsbutton.
2. IntheRecordStreamsdialogbox,dooneofthefollowing:
ChecktheSelectstreamsfromflowsheetbox,clickOK,andthenusethe
mousetoaddstreamstotheSelectStreamsdialogbox.
TypethenamesofstreamsyouwanttorecordintheIDboxes.
Figure 7-06: The Record Streams dialog box
3. Whenyouhaveselectedallthestreamsyouwanttorecord,clickOKto
returntotheDynamicsMenu.
4. NowclicktheRecordUnitOpsbutton.IntheRecordUnitOpsdialogbox,
selectUnitOpsinthesamewaythatyouselectedstreamsinstep2.
5. ClickOKtoreturntotheDynamicsMenu.
68
Note:InboththeRecordStreamsandRecordUnitOpsdialogboxes,youcanusethe
RunTimePlotcheckboxestoincludeselecteditemsinarealtimeplot.Selecting
itemsforruntimeplottingleadstoanotherdialogbox(eitherDynamicStreamPlot
OptionsorDynamicEquipmentPlotOptions),whereyoucanselectplotspecificsfor
eachstreamorUnitOp.Itisrecommendedthatyouuseruntimeplottingin
moderation,astoomanystreamsandUnitOpscanbecomevisuallyconfusingand
slowdowncalculationsconsiderably.
Running a Dynamic Simulation

Nowthatyouhavesettheruntimeandrecordingparameters,youcanrunthe
simulation.WhenyourunadynamicsimulationinCHEMCAD,acalculationofthe
entireflowsheetrunsforeachstepinthetimerangethatyouselect.
Indynamicsmode,youhavethreeoptionsforrunningasimulation:runfrom
thesimulationsinitialstate,runfromthesimulationscurrentstate,oradvancethe
simulationonetimeintervalatatimemanually.
Note:Atanypointduringadynamicrun,youcanpressthe[ESC]keyonyour
keyboardtostoptherunafterthecurrentcalculation.Whenyoudothis,youwillsee
aPrograminterruptedmessage.ClickOKtoclosethemessagebox,andtheneither
inspectyourrunresultsorselectaruncommandtocontinue.
Run from Initial State

Thisoptionresetstheflowsheettoitsinitialconditionsandbeginsthedynamic
simulation.Whenyourunasimulationthisway,allresultsfromprevious
simulationsarediscarded.
Tousethisoption,useeithertheRunfromInitialStatebuttonontheDynamics
MenuortheRunDynamicSimulationbuttonontheCHEMCADtoolbar.
Run from Current State

Whenyouusethisoption,thedynamicrunbeginsfromthecurrentconditions.
Thoseconditionsmightbetheinitialstateoftheflowsheet,theendofaprevious
run,orthemiddleofaninterruptedrun.Selectingthisoptioncontinuesthe
simulationfromthecurrentstate,i.e.,fromthelastcalculatedresult.
Youcanusethisoptiononlywhensomecalculationsremaintoberun.This
meansthatunlessyouhaveinterruptedtherunusing[ESC]orthestepbystep
methoddescribedinthenextsection,youmustscheduleoneormoreadditional
stepsusingtheDynamicRunTimeSchedulebeforecontinuing.
UsetheRunfromCurrentStatebuttonontheDynamicsMenutorunthe
simulationstartingfromcurrentconditions.
69
Run One Step at a Time

Ifyouwanttogetadetailedviewofyourdynamicrunasitunfolds,youcanchoose
torunoneintervalatatime.Withthisoption,thedynamicrunwillstopaftereach
discretetimestep.Torunthenexttimestep,youwillneedtousetheRunDynamic
SimulationtoolbarbuttonortheRunfromCurrentStatebuttonontheDynamics
Menu.
Tousethisframebyframeapproachtodynamics,selectRun>Convergence
andthenchecktheboxcalledRunonetimestepfordynamicsimulation.ClickOK
toconfirmthischange.Toturnoffthisfeature,returntotheConvergence
Parametersdialogboxtoclearthischeckbox.
Figure 7-07: Convergence Parameters setting to run one step at a time
Other Dynamic Commands

Inadditiontotheoptionsfordynamicrunsetupanddynamiccommands,the
DynamicsMenuofferstwootheritems:ResettoInitialStateandSaveasInitial
State.
Reset to Initial State

Inadynamicsimulation,youcanchangestreamandUnitOpspecificationsonly
whenthedynamictimeissettozero.Duringorafterarun,ifyouattempttoeditthe
specificationdialogboxforaUnitOp,youwillfindtheOKbuttondisabledanda
messageinstructingyoutorestorethesimulationtoitsinitialstate.
Figure 7-08: A UnitOp specification dialog box during a dynamic run
70
Toreturnthesimulationtoitsinitialstatealsoknownastimezeroclickthe
ResettoInitialStatebuttonontheDynamicsMenu,orusetheResettoInitialState
buttononthemainCHEMCADtoolbar.
Note:Anadvancedfeaturetoallowspecificationeditingatanytimeisavailable,but
shouldbeusedwithextremecautiontoavoidconfusionandunintendedresults.
ThisfeatureiscontrolledbyacheckboxontheConvergenceParametersdialogbox.
Save As Initial State

TheSaveasInitialStatecommandsetsthecurrentconditionsofthedynamicrunas
thenewinitialstate.Itdiscardsallparametersfromthepreviousinitialstate,and
makesitimpossibletorecoverthepreviousinitialstatedata.
Anexampleofadynamicruncanillustratetheusefulnessofthiscommand.
Supposethatyourunasimulationforfiveminutesandthetemperatureinavessel
increasesfrom50Cto70C.Youdecidethat70Cisabetterstartingpointforthis
vessel,andyouwanttocapturealloftheothervaluesthatcorrespondtothat
temperatureinthisvessel.Youcanachievethisbysavingthecurrentconditionsas
theinitialstate.
Todothis,clicktheSaveasInitialStatebuttonontheDynamicsMenu.Youwill
seeamessagewarningyouthatyouwilllosetheoriginalstateconditionsifyou
continue.Ifyouarepreparedtodothis,clickYes.Forourexample,thiswouldmean
losingthefirstfiveminutesofyourpreviousrun,alongwiththe50Cstarting
temperatureforthevessel.
Afteryousaveanewinitialstate,theRunfromInitialStateandResettoInitial
Statecommandsbothreferenceyournewinitialstatesettings.
Output from Dynamic Simulations

Theresultsfromdynamicsimulationsaremarkedlydifferentfromthoseproduced
bysteadystatesimulations,primarilyinthattheyrecorddatatrendsovertime
insteadofastaticsnapshotofafixedprocess.Withdynamicsimulations,
comparisonsofslightlydifferentprocessspecifications,andofthesameprocessat
differentpointsduringarun,canbeveryuseful.
Forthisreason,youmayfindthatgraphicalreportsprovidethemostuseful
informationwhenyoureworkingwithdynamicsimulations.CHEMCADprovides
aseriesofdynamicsplottingoptionstomeetthisneed;youcanalsogenerate
varioustextbasedreports,andviewcalculatedflowsheetvaluesatanypointduring
adynamicrunorafteraruniscomplete.
71
Reviewing the Flowsheet Specifications

Asnapshotofflowsheetvaluesfromadynamicrundoesntprovideasmuchvalue
asitwouldforasteadystaterun,butitcancomeinhandyinmanysituations.
Afterrunningadynamicsimulation,youcanviewthedatabehindany
flowsheetstreamorUnitOptoseetheeffectsoftheruncalculations.Doubleclick
anystreamorUnitOpontheflowsheettoreviewitsendofrunvalues.
Youcanalsostoptoreviewflowsheetdatainthemiddleofarun,eitherbyusing
theRunonetimestepfordynamicsimulationoptionorbypressing[ESC]topause
arun.Oncetherunhasstopped,youcandoubleclickanystreamorUnitOpto
reviewitscurrentvalues.
Plotting Dynamic Results

YoucanplottheresultsofdynamicsimulationsusingeitherthePlotmenuorthe
dynamicsbuttonsonthemainCHEMCADtoolbar.
Dynamicplotsdisplayselectedvaluesovertime.Thefollowingdynamicplots
areavailable:
BatchReactor/DVSLHistory:Thisplotdisplaysselectedvaluesforabatch
reactorordynamicvessel,includingcompositionofthevesselcontentsover
time.Thedialogboxusedtogeneratethisplotisuserfriendlyandfocuseson
themostcommonlyusedvariablesforthesetypesofequipment.
DynamicColumnHistory:Thisplotdisplaysselectedvaluesforadynamic
column,includingcompositionoftrays,distillate,andbottoms.
DynamicUnitOpHistory:ThisplotdisplaysselectedUnitOpparameters
fromanyrecordedUnitOp.YoucanalsogeneratethisreportusingthePlot
DynUnitOpstoolbarbutton.
StreamHistory:Thisplotdisplaysselectedstreampropertiesfromany
recordedstream.YoucanalsogeneratethisreportusingthePlotDyn
Streamstoolbarbutton.
Note:FortheStreamHistoryandDynamicUnitOpHistoryplots,besuretorecord
thestreamsandUnitOpsthatyouwanttostudy.Youcanonlyrequesttheseplots
forrecordedstreamsorUnitOps.
Text-based Dynamic Reports

Basedonthegraphicalresultsofyourdynamicsimulationrun,youmaydecideto
makechangestoyourprocess,runparameters,orboth,andthenrerunthe
simulation.Whenyouhavefinetunedyoursimulationandobtainedsatisfactory
results,youcanviewthoseresultsintextformaswellasgraphicalform,foramore
detailedlookatexactvalues.
72
Toaccesstextbaseddynamicreports,selectReport>Dynamicsandthenselect
oneofthefollowingreports:
DynamicColumnHistory:Thisreportprovidesdynamiccolumnresultsfor
aselectedcolumn.ThePrintReportOptionsdialogboxoffersthemost
relevantitemsfordynamiccolumnreporting.
DynamicStreamHistory:Thisreportprovidesstreamhistoriesforaspecific
streamthatyouselect,basedontheintervalthatyouspecifyandincluding
thecompositions,components,andstreampropertiesthatyouselect.
DynamicUnitOpHistory:Thisreportprovidesdetailedinformationabouta
dynamicUnitOpinthesimulation,basedontheintervalthatyouspecifyand
includingtheUnitOpparametersthatyouselect.
Note:FortheDynamicStreamHistoryandDynamicUnitOpHistoryreports,besure
torecordthestreamsandUnitOpsthatyouwanttostudy.Youcanonlyrequest
thesereportsforrecordedstreamsorUnitOps.
73
74
Chapter 8
Output and Reports
OneofCHEMCADsgreateststrengthsisitscapacitytoprovidedetailed,
customizedinformationaboutequipment,streams,andprocesses.Youcancreate
customreportsfromsimulations,specsheetsforUnitOps,anddataboxesforprocess
flowdiagrams,andyoucanplotorprintanyoftheseitemsinthemostappropriate
format.
Text Reports
CHEMCADcanproduceawidearrayofcustomizabletextbasedsimulationreports,
basedonstreamdata,UnitOpdata,flowsheetdata,ordynamics.Youcanalsouse
CHEMCADspowerfulReportWriterfeaturetoproducecustomizedconsolidated
reportsincorporatinganycombinationofavailabletextreports.
Report Output Setup

Beforeyourun,view,orprintreports,youshouldcheckthesettingsthatdetermine
whichprogramsCHEMCADwillusetodisplayandprintyourreports.
Forindividualtextreports,youcanuseCHEMCADsdefaultinternalreport
viewer,orelecttodisplayreportsusingMSWordPadorExcel.Toswitchtooneof
theseoptionalprogramsforreportviewing,selectTools>Options>Preferences,
thenclickReportViewerinthePreferencesdialogbox.
Here,youcandesignateapathtoMSWord(usedbytheinternalreportviewer)
orWordPad,andspecifythedefaultreportdestination.ClickOKtoreturntothe
mainCHEMCADworkspace.
75
OutputandReports
Inadditiontoindividualreports,youcancreateconsolidatedreports,whichare
customizablecombinationsofdifferentindividualreports.Foranygiven
consolidatedreport,youcanusethedestinationoptionyouvesetupinthe
Preferencesdialogbox,orchangetoanyviableoutputformat:CHEMCADsinternal
reportviewer,MSWord,WordPad,orExcel.
Tochooseadefaultprogramforconsolidatedreportoutput,selectReport>
FormatConsolidatedReport.OntheFormattab,chooseanoptioninthe
Destinationdropdownlist.ClickOKtoapplyyourchange.Notethatyouwillhave
theoptiontooverridethisdefaultdestinationforanygivenconsolidatedreportthat
youcreate.
Stream-based Reports
AnumberofCHEMCADreportsareavailabletoanalyzestreamdatafroma
simulation.Toaccessanyofthefollowingreports,selecttheappropriateitemfrom
theReportmenu.Theresultswilldisplayaccordingtothewayyouhaveconfigured
CHEMCADtohandletextreports.
Note:Bydefault,thesereportswillusetheengineeringunitsyouselectedwhen
buildingthesimulation.Youcan,however,usedifferentflowrateunitswhen
runningreports.Tochangeflowrateunitsforreporting,selectReport>SetFlow
Units.IntheViewFlowRateUnitdialogbox,selecttheunitsyouwanttouseand
thenclickOK.Thenexttimeyourunstreamcompositionorpropertyreports,the
unitsthatyouveselectedherewillbethedefaultsetting;youcanchangetheflow
rateunitsasoftenasneeded.
Stream Groups
Forstreamcompositionandpropertyreports,youcancreatecustomstreamgroups
withinasimulationtostreamlineyourreportrequests.
Forexample,ifyouhaveaprocessthatinvolvestendifferentfeedstreams,and
youfrequentlyrunreportsonthisgroupofstreams,youcansetupagroup
consistingofjustthosestreams.Then,wheneveryouwanttoobtaincompositionor
propertydataforthosestreams,yourejustafewclicksawayanytimethesimulation
isopen.
76
OutputandReports
ThequickestwaytosetupanygroupistousetheCHEMCADExplorer.Follow
thesestepstocreateastreamgroup:
1. IntheCHEMCADExplorerpane,findthetoplevelitemcalledGroups.Click
theplussignnexttoGroupstoexpandthisitem.
Figure 8-01: Expanding the Groups item in CHEMCAD Explorer
2. NowclicktheStreamsitemunderGroups,tobringuptheNewGroup
dialogbox.Replacethedefaultname(suchasGroup1)withadescriptive
nameforyourgroup,thenclickOK.
Figure 8-02: Naming the new stream group
3. IntheEditStreamGroupdialogbox,selectthestreamsforthisgroup,either
bytypinginthestreamnumbers(oneperline)orbyclickingonstreamsin
theflowsheet.ClickOKtoclosethedialogbox.
4. Assoonasyoufinishcreatingthegroup,itsnameappearsunderStreamsin
theCHEMCADExplorer.Fromhere,youcanrightclickthegroupnameand
selectanyofthefollowing:
View/Edit:OpentheEditStreamGroupdialogbox,whereyoucanadd
ordeletestreamnumberstoincludeinthegroup.
Rename:OpentheRenameGroupdialogbox,whereyoucantypeanew
nameforthestreamgroup.
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OutputandReports
Copy:OpentheCopyGroupdialogbox,whereyoucantypeanew
groupnametomakeanexactcopyofthestreamgroup.Afteryouclick
OK,youcantheneditthenewcopyofthegrouptofityourneeds.
Delete:Removethisstreamgroupfromthesimulation.Ifyouresure
aboutdeletingthegroup,clickYesinthedialogboxthatappears.
Composition:Runaninstantstreamcompositionreportforthestreams
inthegroup.
Properties:Runaninstantstreampropertiesreportforthestreamsinthe
group.
Figure 8-03: Right-click menu options for custom stream group
Note:Thecommandstocreate,edit,andremovestreamgroupsarealsoofferedon
theReportmenu,underbothStreamCompositionsandStreamProperties.
Stream Compositions
Youcanrunastreamcompositionreportbasedonallstreams,oryoucanspecify
whichstreamstoinclude.Torunastreamcompositionreport,selectReport>
StreamCompositionsandthenselectfromthefollowingoptions:
78
SelectStreams:ChoosethestreamsyouwanttoincludeintheSelectStreams
dialogbox,eitherbytypinginthestreamnumbers(oneperline)orby
clickingonstreamsintheflowsheet.ClickOKtoclosethedialogboxand
displaythereport.
AllStreams:Thisreportdisplaysallstreamcompositiondatafortheentire
flowsheet.
OutputandReports
FeedStreams:Thisreportdisplaysstreamcompositiondataonlyforstreams
issuingfromaFeediconontheflowsheet.
ProductStreams:Thisreportdisplaysstreamcompositiondataonlyfor
streamsterminatinginaProducticonontheflowsheet.
UnitStreams:Thisreportdisplaysallinletandoutletstreamcomposition
dataforaspecifiedUnitOpontheflowsheet.IfnoUnitOpiconisselected
whenyourunthereport,youllseetheSelectUnitOpsdialogbox;typethe
UnitOpIDorclicktheUnitOpontheflowsheetandthenclickOKtodisplay
thedata.IfyouselectaUnitOpiconbeforerunningthereport,thedatawill
displaywithoutfurtherinput.
Youcanquicklydisplaystreamcompositionforasinglestreamatanytime,
simplybyrightclickingthestreamintheflowsheetandselectingView
Composition.
Stream Properties
Beforerunningreportsonstreamproperties,youllneedtospecifywhichproperties
toinclude.Todothis,selectReport>StreamProperties>SelectProperties.This
openstheViewPropertyOptionsdialogbox,whereyoucanreviewwhich
propertiesarecurrentlyselected.
Ifyouwanttoaddanyproperties,checktheappropriateboxes;toremove
properties,clickoncheckedboxestoclearthem.BesuretoclickthePage2taband
makeanyappropriatechangesthereaswell.Whenyouarefinished,clickOKto
returntothemainCHEMCADwindow.
Torunastreampropertiesreportforthepropertiesyouvespecified,select
Report>StreamPropertiesandthenselectfromthefollowingoptions:
SelectStreams:ChoosethestreamsyouwanttoincludeintheSelectStreams
dialogbox,eitherbytypinginthestreamnumbers(oneperline)orby
clickingonstreamsintheflowsheet.ClickOKtoclosethedialogboxand
displaythereport.
AllStreams:Thisreportdisplaysallstreampropertydatafortheentire
flowsheet.
FeedStreams:Thisreportdisplaysstreampropertydataonlyforstreams
issuingfromaFeediconontheflowsheet.
ProductStreams:Thisreportdisplaysstreampropertydataonlyforstreams
terminatinginaProducticonontheflowsheet.
UnitStreams:Thisreportdisplaysallinletandoutletstreampropertydata
foraspecifiedUnitOpontheflowsheet.IfnoUnitOpiconisselectedwhen
yourunthereport,youllseetheSelectUnitOpsdialogbox;typetheUnitOp
IDorclicktheUnitOpontheflowsheetandthenclickOKtodisplaythe
79
OutputandReports
data.IfyouselectaUnitOpiconbeforerunningthereport,thedatawill
displaywithoutfurtherinput.
Youcanquicklydisplaystreampropertiesforasinglestreamatanytime,simply
byrightclickingthestreamintheflowsheetandselectingViewProperties.
Particle Size Distribution

Foraparticlesizedistributionreport,selectReport>ParticleSizeDistribution.In
theSelectStreamsdialogbox,chooseoneormorestreamsforwhichaparticlesize
distributionexists(oneperline),eitherbytypinginstreamnumbers(oneperline)or
byclickingonstreamsintheflowsheet.ClickOKtodisplaythereport.
Pseudocomponent Curves
Foratextreportonpseudocomponentcurves(alsoknownasdistillationcurves),
selectReport>PseudocomponentCurves.Selectoneormorestreamscontaining
hydrocarbons,eitherbytypinginstreamnumbers(oneperline)orbyclickingon
streamsintheflowsheet.ClickOKtodisplaythereport.
UnitOp-based Reports
CHEMCADcanalsorunreportstoanalyzeUnitOpdata.Toaccessthesereports,
selecttheappropriateitemfromtheReportmenu.Theresultswilldisplayineither
WordPadorExcel,dependingonhowyouveconfiguredCHEMCADtohandletext
reports.
UnitOp Groups
FortheUnitOpsreport,youcancreatecustomUnitOpgroupswithinasimulation.
Muchliketheirstreambasedcounterparts,UnitOpgroupscansaveyoutimeand
effortwhenrequestingreports;inaddition,youcanusethesegroupswhenrunning
yoursimulation,toisolateandrunonlyselectedUnitOpsfordiagnosticorother
reasons.
Note:BecauseofthisotherfunctionalityofUnitOpgroups,theorderinwhichyou
listUnitOpIDswhensettingupthesegroupsisimportant.
ThequickestwaytosetupanygroupistousetheCHEMCADExplorer.Follow
thesestepstocreateaUnitOpgroup:
1. IntheCHEMCADExplorerpane,underGroups,clicktheUnitOpsitem.
ThisbringsuptheNewGroupdialogbox.
2. Replacethedefaultname(suchasGroup1)withadescriptivenameforyour
UnitOpgroupandthenclickOK.
80
OutputandReports
Figure 8-04: Naming the new UnitOp group
3. IntheEditUnitOpSequenceGroupdialogbox,selecttheUnitOpsforthis
group,eitherbytypingintheUnitOpIDs(oneperline)orbyclickingon
UnitOpiconsintheflowsheet.AddUnitOpsintheordertheyruninthe
simulation.ClickOKtoclosethedialogbox.
Assoonasyoufinishcreatingthegroup,itsnameappearsunderUnitOpsinthe
CHEMCADExplorer.Fromhere,youcanrightclickthegroupnameandselectany
ofthefollowing:
View/Edit:OpentheEditUnitOpSequenceGroupdialogbox,whereyou
canaddordeleteUnitOpsorreordertheexistinglist.
Rename:OpentheRenameGroupdialogbox,whereyoucantypeanew
nameforthegroup.
Copy:OpentheCopyGroupdialogbox,whereyoucantypeanewgroup
nametomakeanexactcopyoftheUnitOpgroup.AfteryouclickOK,you
cantheneditthenewcopyofthegrouptofityourneeds.
Delete:RemovethisUnitOpgroupfromthesimulation.Ifyouresureabout
deletingthegroup,clickYesinthedialogboxthatappears.
Run:RunthesimulationonlyforthoseUnitOpsincludedinthisgroup.
View:DisplayasummaryreportoftheUnitOpsincludedinthisgroup.
Specifications:BringuptheUnitOpspecificationdialogboxesforeachitem
intheUnitOpgroup,startingwiththefirstUnitOplisted.
Note:Thecommandstoadd,edit,andremoveUnitOpgroupsarealsoofferedonthe
ReportmenuunderUnitOps.
Select UnitOps
TorunareportthatcoversjusttheUnitOpsyouspecify,selectReport>UnitOps>
SelectUnitOps.IntheSelectUnitOpsdialogbox,specifytheUnitOpsyouwantto
includeinthereport,eitherbytypingintheUnitOpIDs(oneperline)orbyclicking
onUnitOpsintheflowsheet.ClickOKtoclosethedialogboxanddisplaythereport.
IfyouselectaUnitOpiconbeforerunningthereport,thedatawilldisplay
withoutfurtherinput.
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OutputandReports
Spec Sheet
TheSpecSheetcommandexportsdetailedinformationaboutaUnitOpintoa
preformattedExcelworksheet.Thisreportisusefulfortaskssuchassolicitinga
manufacturingquoteforapieceofequipment.
TocreateaspecsheetforallUnitOpsontheflowsheet,selectReport>Spec
Sheet>AllUnits.
TocreateaspecsheetonlyforspecificUnitOps,selectReport>SpecSheet>
SelectUnit.ChoosetheUnitOpsyouwanttoincludeintheSelectUnitOps
dialogbox,eitherbytypingintheUnitOpIDs(oneperline)orbyclickingon
UnitOpiconsintheflowsheet.ClickOKtoclosethedialogboxanddisplay
thespecsheet.
ForasingleUnitOpspecsheet,youcanselecttheUnitOpiconbefore
runningthereport;Excelwillopenandthedatawilldisplaywithoutfurther
input.
Note:ForspecsheetsthatincludemultipleUnitOps,CHEMCADcreatesaseparate
worksheetforeachUnitOpsdatawithintheExcelfilethatCHEMCADcreates.
Distillation
Torunadistillationreport,selectReport>Distillationandthenselectoneofthe
following:
82
ColumnProfiles:Generatesareportdetailingtemperature,pressure,and
flowrateforadistillationcolumn
TrayCompositions:Createsareportthatshowsthevaporflowrate,liquid
flowrate,andKvalueofeachcomponentoneachstageofadistillation
column
TrayProperties:Reportsoncurrentlyselectedstreampropertiesforeach
stageofadistillationcolumn
TowerMassTransfer(SCDS):ForanSCDSdistillationcolumnthatusesa
masstransfermodel,providesmasstransfercoefficients,heightoftransfer
units,andestimatedheightoftheoreticalplates(HETP)
DynamicColumnHistory:Providesdatafromasingledynamicrunofa
column(describedindetailinChapter7,BuildingandUsingaDynamic
Simulation)
ColumnDiagnosis:Forcolumnsthathavenotsuccessfullyconverged,
providesrecommendationsforchangingcolumnsettingstoachieve
convergence
OutputandReports
Flowsheet-based Reports
InadditiontoreportsthatfocusonparticularUnitOpsandstreams,CHEMCAD
offerstextreportsthatprovideinformationaboutthesimulationasawhole.To
accessanyofthesereports,selecttheappropriateitemfromtheReportmenu.
Topology
ThisreportprovidesalistingofallUnitOpsintheflowsheet,aswellasallstream
originsanddestinations.
Thermodynamics
Thisreportlistsallcomponentsusedinthesimulationandprovidesvital
informationaboutthethermodynamicsmethodsused.
Mass and Energy Balances

Inadditiontomassandenergybalances,thisreportgivestheorderinwhich
UnitOpsarecalculated,calculationmodesused,andinformationaboutrecycle
loops,cutstreams,andconvergence.
Dynamics Reports
TheReportmenuprovidesaccesstotheBatchResultsandDynamicscommands,
whichprovidereportsaboutnonsteadystateprocesses.
Batch Results
Thisreportsummarizestheresultsofabatchdistillationcolumnsimulationatthe
endofeachoperatingstep.
Dynamics
YoucanaccessthreedifferentreportsbyselectingReport>Dynamics:Dynamic
ColumnHistory,DynamicStreamHistory,andDynamicUnitOpHistory.These
reportsaredescribedindetailinChapter7,BuildingandUsingaDynamicSimulation.
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OutputandReports
Consolidated Reports and the CHEMCAD Report Writer

Youcanrunanycombinationofthetextbasedreportsdescribedaboveasasingle
operation,byselectingReport>ConsolidatedReport.ThisbringsuptheReport
Writerdialogbox.
Figure 8-05: The CHEMCAD Report Writer
Fromhere,youcanclickGeneratetobringupadefaultconsolidatedreportthat
includestopology,convergence,massandenergybalances,andtheotherreports
listedinthedialogboxsleftcolumn.Ifthisreportisadequatetoyourneeds,simply
clickCancelaftergeneratingtheconsolidatedreport,toclosetheReportWriter
dialogbox.
Ifyouwantsomethingotherthanthedefaultconsolidatedreport,youcanalso
usetheReportWritertocustomizewhichindividualreportstoinclude,whatorder
toputthemin,whichflowsheetelementstoinclude,andmuchmore.Youcanfine
tuneyourreportsettingswithoutclosingthisdialogbox,andthensaveyourreport
configurationwithanewnamesothatyoucanrunitagaininthefuture.
Choosing and Ordering Report Sections

TocustomizeyourConsolidatedReport,firstdecidewhichreportsectionsyouwant
toinclude.TheCurrentReportSectionsarealistsitemsintheordertheywillappear
whenyouruntheConsolidatedReport.
Ifyourwishlistofreportsectionslookslargelylikethedefaultlistshownin
Figure805,youcanbeginwiththatlistandmakesomechanges;ifnot,youcanstart
withablankslateandbuildyourConsolidatedReportonereportsectionatatime.
84
OutputandReports
Youcandoanyofthefollowingtoaltertheexistingsectionlist:
AddasectionbydoubleclickinganyitemintheAddNewReportSection
areaoftheFormattab.Thenewitemappearsattheendofthereportlist.
RemoveasectionbyselectingitintheCurrentReportSectionslistandthen
clickingDelete.
MoveasectiontoadifferentpositionwithintheConsolidatedReportby
selectingitintheCurrentReportSectionslistandthenclickingtheUpor
Downbuttonasneeded.
Ifyouprefertobuildthesectionlistyourself,youshouldaccesstheReport
WriterbyselectingReport>NewfromtheCHEMCADtoolbar.Thisbringsupthe
ReportWriterscreenwithablankleftcolumn,readyforyoutoaddjustthereport
sectionsthatyouwantinwhateverorderyouchoose.
Selecting Flowsheet Elements

ToselectflowsheetelementsforinclusioninaConsolidatedReport,clicktheSelect
Streams&UnitOpstabwithintheReportWriter.Thistab,liketheFormattab,is
visibleonlywhenConsolidatedReportisselectedintheleftcolumnoftheReport
Writerscreen.
Initially,theSelectStreamsandSelectUnitOpscheckboxesonthistabare
empty,andtheAllStreamsandAllUnitOpscheckboxesarecheckedanddisabled.
ToexcludestreamsorUnitOpsfromyourreport,checktheappropriateboxat
thetopofthetab;thisenablestheotheroptions.YoucanclickSelectFrom
FlowsheettoselectstreamsorUnitOpsusingyourmouse,orcleartheAllStreams
orAllUnitOpsboxtoaccessoptionsforselectingflowsheetitemsbytypesoruser
createdgroups.
Formatting Report Sections

CertainreportsectionsthatyoucanincludeinaConsolidatedReporthave
formattingoptionsthatyoucanchangebeforerunningthereport.Theseoptions
include:
ForUnitOps,asectionspecificUnitOpsselectiontabandtheoptiontolimit
thenumberofcolumnsforExcelreportoutput
ForStreamProperties,asectionspecificstreamselectiontabandtheoption
tochangethedefaultlistofstreampropertiestoincludeinthereport
ForStreamComposition,asectionspecificstreamselectiontab,theoptionto
changethedefaultflowoptions,andalternativesettingsforcompositiondata
formatandprecision
ForParticleSizeDistribution,asectionspecificstreamselectiontab
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OutputandReports
ForTrayProfile,asectionspecificUnitOpselectiontabandanoptionto
changethedefaultflowunits
ForHeatCurves,asectionspecificUnitOpselectiontabandtheoptionto
chooseacuttingmethodandnumberofcutpoints
Naming the Report and Choosing a Destination

WhenyoufinishcustomizingaConsolidatedReportparticularlyifyouvedonea
significantamountofcustomization,orifyoususpectyoullwanttorunthesame
reportparametersagainyoushouldconsidersavingthereportforfutureuse.
Todothis,firstgivethereportadistinctivenameusingtheReportNamefield.
ThisfieldisvisibleintherightportionoftheReportWriterdialogboxwhenyou
clickthetoplevelitemunderCurrentReportSections.
NotethatConsolidatedReportisthedefaultreportname;whenyoutypeanew
nameasinFigure806,boththetoplevelitemontheleftandthetitleovertheright
portionofthedialogboxchangetoreflectthereportname.
Figure 8-06: Results of typing a new name into the Report Name field
Onceyouhavenamedthereport,youcanclickSavetosavethereportlocally
(thatis,onlyforthissimulation),orclickSaveAstosavethereportunderMy
Simulations\MyReports\GlobalReports.SavingintheGlobalReportsdirectory
makesthereportavailabletoanysimulationyoumayopeninthefuture.
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OutputandReports
Togenerateareportthatyouhavesavedlocally,selectReport>Simulation
Reports;selectthereportbynameandclickGenerateReport.Otheroptionshereare
EdittoopenthereportintheReportWriter,Exporttocopyittoagloballocation,or
Deletetoremoveitfromthemenu.
Figure 8-07: Generating a report that has been saved locally
Notethattogenerateoraccessagloballysavedreport,youcanselectReport>
Global/PoolReports.
Graphical Reports
Inadditiontotextbasedreports,CHEMCADoffersawidevarietyofgraphicalplots
thatyoucanviewonscreenorprintforreview.
Thermophysical Data Graphs

CHEMCADoffersanumberofgraphicalreportsthatrelatespecificallytothe
selectedcomponentsandthermodynamicsoptions.Toaccessanyoftheseplots,
selecttheappropriateitemfromthePlotmenu.
TPXY
Thisselectiongeneratesvaporliquidequilibriumcurvesbetweenanytwo
components,withanoptionalthirdcomponent.YoucanincludeTPXY,TXY,activity
coefficient,andfugacitycoefficientcurves.
Binary LLE
Thisselectiongeneratesliquidliquidequilibriumcurvesbetweenanytwo
components.
Binodal Plot
Thisselectiongeneratesaternaryphasediagramshowingthedistributionofthree
selectedcomponentsintwoliquidphases,includingtielinesandplaitpoint.
Binodal/Residue Curves
Thisselectioncreatesaplotthatcombinesthecurvesfromabinodalplotanda
residuecurveplot.Thisisusefulwhenworkingwithheterogeneousazeotropic
distillation.
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OutputandReports
Residue Curves
Thisselectiongeneratesandplotsagraphicaldisplayofdistillationzones,
azeotropes,andresiduecurvesassociatedwithauserspecifiedternarymixture.
Solid/Liquid Equilibrium
Thisselectiongeneratessolidliquidequilibriumcurvesbetweenanytwo
components.
Flowsheet-based Graphs
Toviewgraphicalreportsthatreflectyouroverallsimulation,selectoneofthe
followingfromthePlotmenu:
StreamProperties:Plotsoneselectedstreampropertyforaselectedstreamin
theflowsheet
PhaseEnvelopes:Plotsaphaseenvelopeforagivenstream,highlightingthe
criticalpointofthemixture;canincludeplotsatvaporfractionsotherthan0
(bubblepointcurve)and1(dewpointcurve)
CompositeCurves:Plotscompositeheatcurvesfortheentireflowsheet,as
wellasoptionalheatcurvesforindividualUnitOps
PseudocomponentCurves:Displaysaplotofoneormoredistillationcurves
forastream
UnitOp-based Plots
CHEMCADoffersseveralplotsthatdisplaydataforasingleUnitOp.Toaccessany
oftheseplots,selectPlot>UnitOpPlotsandthenselectoneofthefollowing
options.
Column Profiles
Thisselectionplotscompositions,temperature,andflowprofilesfordistillation
columns.
Heat Curves
Thisselectionplotsheatingandcoolingcurvesforaselectedheatexchanger.
Plug Flow Reactor Profile

Thisselectionplotsthetemperatureorcompositionprofilesalongtheaxiallengthof
akineticplugflowreactor.
Pipe Profile
ThisselectionplotsfluidpropertiesforpipeUnitOpsalongtheaxiallengthofthe
pipe.Thisplotrequiresthatthepipecontainmultiplesegments.
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OutputandReports
Controller Convergence
Forcontrollersthathavenotconverged,thisplotenablesyoutodiagnosethe
controllerbehaviorthatispreventingconvergence.Theplotshowshowthe
controllererrorfunctionchangeswithiteration.
Dynamic Plots
CHEMCADoffersaseriesofplotsforusewithdynamicoperations.SelectPlot>
DynamicPlotstoaccessanyofsixgraphicaldynamicsreports.
TheseplotsaredescribedindetailinChapter7,BuildingandUsingaDynamic
Simulation.
User-specified File
IfyouhavecustomizedCHEMCADusingVBA,C++,orotherprogramming
languages,youcansaveplotdataintoatextfileandusethisfeaturetodisplaythat
dataasacurve.
SelectPlot>UserSpecifiedFiletobringupamessageboxthatprovides
instructionsonhowtoformatthetextfile.ClickOKtocontinuetoanOpendialog
box,whereyoucanselectthetextfileyouwanttouse.WhenyouclickOpen,the
curveisplottedanddisplayed.
Printing CHEMCAD Reports

YoucanprintanytextreportfromwithinCHEMCADsinternalreportviewer,or
fromwithinanotherprogramthatyouhaveselectedtoviewreports.
IfareportisdisplayedinaCHEMCADtab,youcanselectFile>Printtobring
upthestandardPrintdialogbox,whereyoucanchooseadifferentprinter,selecta
pagerange,orspecifythenumberofcopiestoprint.ForashortcuttothePrint
dialogbox,clickthePrintbuttoninthetoolbar.
Ifyouvesetupanotherprogramasyourreportdestination,simplybringupthe
PrintdialogboxinWord,WordPad,orExcelbyselectingFile>Print.Eachofthese
programsalsooffersaPrintbuttononthetoolbarforyourconvenience.
Forgraphicalreports,youcanprintdirectlyfromCHEMCAD,justasyouwould
printatextreport.Plotsaresetuptoprintinlandscape(horizontal)orientation,as
thisisthebestfitforthehorizontalplotlayout.
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OutputandReports
Process Flow Diagrams

CHEMCADprovideseasytousetoolsforcreatingprintedprocessflowdiagrams.
Youcanaddvarioustypesofdataboxestoaccompanyyourflowsheet,andthen
selectivelyviewandprintgroupsofitems,includingdataboxes.
Flowsheet Databoxes
CHEMCADoffersfourtypesofdataboxes:
StreamBox:Liststhestreamsthatyouselectinasingletable,alongwiththe
streampropertiesthatyouchoosetoinclude
UnitOpBox:GeneratesaseparatedataboxforeachselectedUnitOp
TPBox:Generatesseparatesummarydataboxesforselectedstreams
ExcelRangeBox:ReferencesarangeofcellsfromanExcelworksheet
Stream Boxes
Tocreateastreamdatabox,startbyselectingFormat>AddStreamBox.Fromthe
SelectStreamsdialogbox,followthesesteps:
1. Determinewhichstreamstoincludeinthedatabox,usingoneofthree
methods:
ChecktheAllstreamsboxtoincludeallstreamsonyourflowsheet,then
clickOK.
Typethenumbersofthestreamsyouwanttoincludeintotheboxes
provided(onenumberperline),thenclickOK.
Choosethestreamsyouwanttoincludebyclickingtheactualstream
lineswithyourprimarymousebutton.Streamnumbersthatyouselect
willappearintheSelectStreamsdialogbox;totoggleaselectedstream
off,justclickitagain.Whenyouveselectedallthestreamsyouwant,
clickOKtocontinue.
2. AnyoftheseselectionmethodswillbringyoutotheDataboxProperty
Optionsdialogbox.Here,youcanselectwhichstreampropertiesyouwant
toincludeonthestreamdatabox.Youcankeepthedefaultsettings,orturn
anycheckboxonorofftocustomizeyourdatabox.
Note:Theselectionsyoumakeherewillbethedefaultselectionsthenexttimeyou
createastreamdataboxforthissimulation.
InadditiontothemainGeneraltab,notetheCrude/Solidtab,whichyoucan
clicktoselectcrudeoilstreampropertiesorsolidstreamproperties.When
youveselectedthestreampropertiesyouwant,clickOKtocontinue.
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OutputandReports
3. IntheDataboxSettingsdialogbox,youcanchoosewhethertoinclude
horizontallinesorhorizontalsectiondividersinthedatabox.ClickOKto
placethedataboxonyourworkspace.
Aswithflowsheetelements,youcanmove,stretch,orresizeadataboxusing
yourmouse.
UnitOp Boxes
TheprocedureforcreatingUnitOpdataboxesissimilartothatusedtocreatestream
databoxes,withthechiefdifferencebeingthatthereisnoselectionofUnitOp
properties.
BeginbyselectingFormat>AddUnitOpBox,andtheneithertypeinUnitOp
IDsorclickUnitOpsontheflowsheet.Notethatyoudonthavetheoptionof
automaticallyincludingallUnitOps,asyoudidwithstreams;toincludeallUnitOps
inthedatabox,clickablankareaoftheflowsheetandthenpress[CTRLA]toaddall
UnitOpIDstothelist.
WhenyoucompleteyourselectionsandclickOK,theDataboxSettingsdialog
boxappears,withthesameformattingoptionsthatareavailableforstream
databoxes.Changeanysettingsyouwanthere,andthenclickOKtoplacethe
requesteddataboxesonyourworkspace.
Unlikeastreamdatabox,whichdisplaysdataformultipleitemsinasinglebox,a
UnitOpdataboxdisplaysdataonlyforasingleUnitOp.Ifyouselectedthree
UnitOpsintheUnitOpIDsdialogbox,youllseethreeseparatedataboxesappear
whenyouclickOK.Ifyouseeonlyonedataboxatfirst,trymovingthatboxto
anotherpartofthescreentoseeiftheothersarehiddenbehindit.
TP Boxes
CHEMCADcancreatedataboxes,calledTPboxes,whichdisplayanycombinationof
temperature,pressure,andflowrateforallstreamsorselectedstreamsona
flowsheet.
ToaddTPdataboxes,selectFormat>AddTPBox.IntheTPBoxSettingsdialog
box,firstselectanoptionatthetop,todeterminewhethertoaddTPboxesforall
streamsoronlyforthestreamsyouselect.
IntheDisplaycolumn,selectitemsfromthedropdownlistineachfieldto
determinewhichstreampropertiestodisplayandinwhatorder.UseNoselection
asappropriateifyouwanttodisplayfewerthanfourproperties.
IntheNumberformatcolumn,makeaselectionineachfieldtodeterminehow
numberswilldisplayintheTPboxes.IntheDigitscolumn,typethenumberof
digitstodisplayafterthedecimalpoint.Youcanalsochoosewhethertodisplay
streamIDsandengineeringunits.
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OutputandReports
ThePreviewboxdisplaysadynamicsampleofhowtheitemsyouveselected
willappearintheTPboxes.
WhenyoufinishmakingyourselectionsintheTPBoxSettingsdialogbox,click
OK.IfyouvechosentomakeTPboxesforallstreams,theTPboxeswillappearon
theflowsheetrightaway.Ifyouveoptedtoselectthestreamsfromtheflowsheet,
youllseeaSelectStreamsdialogbox;typethestreamnumbers(oneperline)orclick
onthestreamlinesintheflowsheettoselectstreams,andthenclickOKtocreatethe
TPboxes.
Figure 8-08: TP boxes added to a simple flowsheet
Excel Range Boxes

AnExcelrangeboxdisplaysdynamicdatafromaspecifiedcellrangeinaspecified
Excelworksheet.TocreateanExcelrangebox,followthesesteps:
1. StartbyselectingFormat>AddExcelRange.ThisbringsuptheExcel
DataboxSettingsdialogbox.
2. ClickBrowsetonavigatetothefolderwheretheExcelworkbookresides,
thenhighlightthenameoftheworkbookyouwantandclickOpen.
3. IntheWorksheetnamefield,typethenameoftherelevantworksheetwithin
theworkbookthatyouveindicated.
4. Inthecenterportionofthedialogbox,specifythestartingandending
columnandrowcoordinatesthatyouwanttoreferencewithintheselected
worksheet.
5. Inthelowerportionofthedialogbox,changeanyformattingsettingsas
desiredandthenclickOKtocreatethedatabox.
AnExcelrangeboxisadynamiclinkbetweenCHEMCADandtheExcel
worksheet.Asdataisupdatedandsavedintheselectedcellrange,therangeboxcan
automaticallyupdatetoreflectthosechanges.Toviewthemostuptodatedatain
yourExcelrangeboxesatanytime,selectView>RefreshDataBoxes.
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OutputandReports
Using the Layers Feature for Selective Viewing and Printing

WhenyoucreateasimulationinCHEMCAD,youcanbuildyourflowsheetacrossa
hugeworkspace,zoominginandoutasneededtoworkwithspecificareasofthe
flowsheet.Youcanalso,asdescribedabove,addanynumberofdataboxesto
provideaquickvisualreferenceforthedatabehindyourflowsheetobjects.Youcan
addtextlabels,drawcirclesarounditemsthatyouneedtoworkonfurtherin
short,therespracticallynoendtothevisualclutterthatcouldenduponyour
processflowdiagram.Butalloftheseelementsareusefultosomeone,andyou
certainlydontwanttospendyourtimerepeatedlyaddingorremovingvisual
elementsbeforeprintingorsharingaPFD.
CHEMCADssolutiontovisualelementoverloadisafeaturecalledLayers.A
layerisagroupofobjectsinasimulationfileanycombinationofdataboxes,drawn
shapes,textlabels,streams,andUnitOpsthatyoucanvieworhidewithasingle
click.Youdefineexactlywhichobjectsbelongtoalayer,andthentoggleeachlayer
eitheron(visible)oroff(hidden)usingtheCHEMCADExplorerpane.
Note:Turningoffalayerdoesnothingbeyondhidingtheassociatedobjectsfrom
view.HavingalayerhiddenevenifthatlayerincludesstreamsandUnitOps
doesnotinanywayaffectthewaythesimulationrunsoranystreamorUnitOp
properties.
Scenarios for Using Layers

Thefollowingareexamplesofsituationsinwhichyoucanuselayerstoenhance
yourprocessflowdiagrams:
Severaldifferentdepartmentsneedtoreviewyourprocessflowdiagram,but
eachdepartmentwantstoseedifferentdatahighlightedindataboxes.You
cancreateonesetofTPboxeslistingonlyflowrates,forexample,andthen
assignthemalltoalayer;thenhidethatlayerandcreateanewsetofTP
boxeslistingtemperatureandpressureonly.Assignthesedataboxestotheir
ownlayer,hideit,andcontinuewithstreamboxes,UnitOpboxes,or
whateverotheritemsyouneed.Createasmanydifferentlayersasyoulike,
andeachtimeyougotoprintthediagram,viewonlythelayersthatyou
wanttoprint.
Youneedtoemailasimulationtodifferentrecipientswhowanttoview
differentdataboxes.Createsetsofdataboxesassignedtomultiplelayers,and
thenviewjustthelayersthatyouwantyourfirstrecipienttoseeupon
openingthefile.Saveandclosethesimulationbeforeattachingittoanemail
message.Openthesimulationagainforthenextrecipient,selectthelayers
youwantthatpersontosee,savethefile,andattachittoanotheremail
message.
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OutputandReports
Youhaveaverylargeflowsheetthatencompassesanumberofdiscrete
processes.Youcancreateseparatelayersforvariousportionsoftheoverall
flowsheet,andviewonlytheportionsyoureworkingwithatagiventime.
Youcanalsohideunneededportionsoftheflowsheetforprinting.
Ifyouaretroubleshootingaprocess,orforwhateverreasonneedtomark
upaprocessflowdiagram,youcandrawshapessuchasellipsesor
rectanglesaroundcertainUnitOpsorgroupsofUnitOps,usingtextorbright
colorstodrawextraattention.Thenassignallofthesemarkupitemstoa
singlelayersothatyoucanchoosetovieweitherthemarkedupversionor
thecleanversionoftheflowsheetatanytime.
Creating a New layer

Bydefault,allobjectsareassignedtoamasterlayer,whichisalwaysvisible.Before
youcanassignobjectstoanotherlayer,youmustfirstcreateanewlayertouse.The
mostconvenientwaytocreatealayeriswithintheCHEMCADExplorerpane.
IntheCHEMCADExplorer,findthetoplevelitemcalledLayers,rightclickit,
andselectNew.
Figure 8-09: Creating a new layer
IntheNewLayerdialogbox,replacethedefaultlayernamewithadescriptive
nameofyourownandthenclickOK.
Figure 8-10: Naming the new layer
ThenewlayernowappearsundertheLayersiteminCHEMCADExplorer.If
necessary,clicktheplussignnexttoLayerstoviewthelayername.Youcanaddas
manylayersasyoulikeandviewthecompletelisthere.
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OutputandReports
Whenalayerisfirstcreated,itisvisiblebydefault.Alayersstatusasvisibleor
hiddenisindicatedinCHEMCADExplorerbytheiconthatdisplaysnexttoits
name.Avisiblelayershowsagreencheckmark,whileahiddenlayerisgrayin
color.
Figure 8-11: Visible and hidden layers as they appear in CHEMCAD Explorer
Assigning Objects to a Layer

Nowthatyouhavelayers,youcanassignitemstothem.Startbyclickinganobject
tohighlightit;thismightbeanythingfromastreamIDlabeltoaUnitOptoaTP
box.Whatevertypeofobjectitis,whenyouhighlightityoullseethefourblack
boxesthatdefineitsouteredges.Withtheobjectselected,rightclickthenameofthe
desiredlayerintheCHEMCADExplorerandchooseAddSelected.
Tosavetime,youcanaddmultipleobjectstoalayeratonce.Justholddownthe
[SHIFT]keyasyouclickeachobjectinturn,thenrightclickthelayernameand
chooseAddSelected.
Note:Ifyoulike,youcanassignoneormoreobjectstoalayeratthesametimeyou
createthelayer.Todothis,simplyclickthedesiredobject(usethe[SHIFT]click
methodformultipleobjects),thenrightclickLayers,selectNew,andassignthe
layeraname.Theselectedobjectsareautomaticallyassignedtothenewlayer.
Hiding and Viewing Layers

Assoonasyouveaddedatleastoneobjecttoalayer,youcantestthelayerby
hidingitandwatchingwhathappens.Tohidealayer,simplyclickthelayersname,
orthegreencheckmarkediconnexttoitsname;theiconshouldchangetograyand
allitemsassignedtothelayershoulddisappearfromview.
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OutputandReports
Atanytime,youcanhideorvieweachlayerinyoursimulationindependently.
TheiconsnexttothelayernamesintheCHEMCADExplorerprovideaconstant
reminderofwhichlayers,ifany,arecurrentlyhiddenfromview.
Eachtimeyouopenasimulationfile,CHEMCADdisplaysorhidesitslayers
accordingtothewaytheyweresetthelasttimeyousavedthesimulation.
Note:Itispossibleforanobjecttobeassignedtomorethanonelayer.Ifanobjectis
assignedtotwoormorelayers,however,itwillbedisplayedunlessallofits
associatedlayersarehidden.
Removing an Object from a Layer

Ifyounolongerwantaspecificobjectorgroupofobjectstobeassignedtoagiven
layer,youcanremovetheassignmentaseasilyasyoucreatedit.
Firstensurethatthelayerinquestionisvisible.Thenselectalltheobjectsthat
youwanttoremovefromthelayer,rightclickthelayernameinCHEMCAD
Explorer,andchooseRemoveSelected.Nowwhenyouhidethelayer,theobjector
objectsyouremovedshouldremaininview.
Deleting an Entire Layer

Ifforanyreasonyouwanttoremovealayerfromyourlist,simplyrightclickthe
layersnameinCHEMCADExplorerandselectDelete.Thelayerdisappearsfrom
thelist,andifthelayerwashiddenwhenyoudeletedit,theitemsassignedtoitnow
reappear.
Printing a Process Flow Diagram

WhenyouusethePrintcommandonthemainCHEMCADscreen,theresultisa
verbatimreproductionofyourvisibleworkspace.
Ifyourezoomedcloseintooneportionofyourflowsheetwhenyouprint,youll
getacloseupprintoutthatdoesnotincludetherestoftheflowsheet.Ifyouve
hiddenallofyourdataboxestokeepthemoutofyourwaywhileyoufixaproblem,
thosedataboxeswillnotappearontheprintout.IfthePalettepaneiscoveringupthe
productstreamscomingfromoneofyourUnitOps,thoseproductstreamswontbe
ontheprintouteither.
Forthisreason,thefirstthingyoushoulddowhenyourereadytoprinta
processflowdiagramistodecidewhatneedstobeincludedontheprintout.Ifyou
needtheentireflowsheettoappearontheprinteddiagram,selectView>Zoom
Options>ZoomtoFit,orzoommanuallyifyouprefer.Youmaywanttohideor
unpinoneormorepanesaswell,togiveyourselfmoreworkspacewhileyou
preparetoprint.
Next,considerwhetheryourprocessflowdiagramshoulddisplayajobbox,
UnitOporstreamdataboxes,textnotes,orotheritemsinadditiontotheflowsheet
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OutputandReports
itself.Ifyouhavealreadycreatedtheneededitems,makesurethattheyare
currentlyvisibleandplacedwhereyouwantthem.
Whenalloftheitemsyouwanttoprintarevisible,checkoncemoretoensure
thateverythingfallswithintheCHEMCADworkspace.ThenselectFile>Print,or
clickthePrintbuttononthetoolbar.ThisbringsupthePrintSetupdialogbox,
whereyoucanselectprintingoptionsorsimplyclickOKtoprinttheprocessflow
diagram.
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OutputandReports
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Chapter 9
Customizing CHEMCAD
AsyoubecomemorefamiliarwiththewaythatCHEMCADworksandthevarious
optionsandtoolsthatareavailable,youmayfindyourselfwishingthatyoucould
makeyourownadditionseitherforspecializeditemsorforthoseyouuse
frequently.YoucaninfactcustomizeCHEMCADinseveralwaysthatsaveyoutime
bystreamliningandsimplifyingyourworkflow.Theseinclude:
CreatingstreamandUnitOptemplates
AddingcustomcomponentstoCHEMCADscomponentdatabase
MakingyourownsymbolsandaddingthemtotheUnitOpspalette
BuildingcustomUnitOps
CreatingcustomdialogboxesforUnitOpsettings
Definingcustomthermophysicalrules
Thischapterdiscussesallofthesetypesofcustomization,startingwiththe
simplestproceduresandthenmovingontomorecomplexcustomizationsthat
requiresomeprogrammingexperience.
Flowsheet Templates
OneofthemosteffectivewaystosavetimewhencreatingCHEMCADsimulations
istomakeuseofstreamandUnitOptemplates.Atemplateissimplyasetof
characteristics,whichyouassignanameandsaveforlateruse.Whenyousetup
streamorUnitOpspecificationsthatyouknowyoullneedtorecreateinthefuture,
youcancreateatemplateofthatstreamorUnitOp.Youcanthenduplicatethatitem
withinthesamesimulationorinanyothersimulationwithjustafewmouse
clicks.
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CustomizingCHEMCAD
Creating a Template
Tocreateastreamtemplate,firstcreatethestreamyouwanttocloneandgiveitall
ofthecharacteristicsyouwanttoincludeinthetemplate.
ThenfindthisstreamontheCHEMCADExplorersSimulationtab.Expandthe
Flowsheetitem,thenexpandtheStreamitem,andfinallydoubleclickthe
applicablestreamID.ThisbringsupanitemcalledSave.Doubleclicktheword
SavetobringuptheEnterTemplateNamedialogbox,thentypeanameforyour
newstreamtemplateandclickOK.Thenewstreamnameisnowlistedbeneaththe
Saveitem.
TocreateaUnitOptemplate,selecttheappropriateUnitOpIDinCHEMCAD
Explorer,andthenfollowthesameprocedureusedtocreateastreamtemplate.
Viewing a Templates Properties

Toseewhatspecificationsanexistingtemplateincludes,lookitupinthe
CHEMCADExplorer.ExpandtheTemplatesitem,thenexpandtheUnitOpsitem,
andfinallyexpandthenameoftherelevantUnitOptype.Forexample,ifyoure
lookingupatemplatethatyoucreatedforatypeofpumpthatyoufrequentlyuse,
expandthePumpitemintheCHEMCADExplorer.
Whenyoufindyourtemplate,simplyclickthetemplatenametoopenits
specificationsdialogbox.
Applying a Template
Toapplyastreamtemplate,firstexpandtheCHEMCADExploreritemforthe
streaminquestion,eitherbyclickingtheplussigntoitsleftorbydoubleclickingthe
streamname.
Whenthestreamitemisexpanded,youllseetheSaveitembelowit,followedby
thenamesofallthestreamtemplatesthatyouhavecreated.Doubleclickthename
ofthetemplateyouwanttouse,thenclickOKtoconfirmthatyouwanttoapply
thisstreamtemplate.
Renaming or Deleting a Template

Torenameatemplate,simplyfinditunderTemplatesinCHEMCADExplorer,
rightclickthetemplatename,andselectRename.TypethenewnameandclickOK.
ThischangesthetemplatenamethroughoutCHEMCADExplorer.
Theprocedurefordeletingatemplateissimilartorenamingatemplate.Again,
findthetemplateyouwantunderTemplates,rightclickitsname,andselectDelete.
ClickOKtoconfirmthatyouwanttodeletethistemplate.Thetemplatename
disappearsfromCHEMCADExplorer,butstreamsorUnitOpsthatwerespecified
usingthetemplatearenotaffectedinanyway.
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CustomizingCHEMCAD
Note:AnystreamorUnitOptemplatethatyoucreateisavailableforusewithall
othersimulationsonthesameinstallationofCHEMCAD,untilandunlessyou
deletethetemplate.
Creating Custom Components

TheCHEMCADcomponentdatabaseplacesdetailedinformationaboutthousands
ofchemicalsatyourfingertips.Ifforanyreasonyoufindthatyouneedtousea
chemicalcomponentthatdoesnotmatchanyitemcurrentlyintheCHEMCAD
database,youcancreateyourowncomponentforusewithyoursimulations.
Youcancreateasinglecomponent,definearangeofpseudocomponents,or
importacomponentsphysicalpropertiesfromanexternalsource.Theseprocedures
havesimilaraims,butdiffersignificantlyfromoneanother.
Adding a Single Component

CreatingapurecomponentintheCHEMCADcomponentdatabaseisatwopart
task.Youmustfirstcreatethecomponentandthenregressdataintothecomponent.
Creating the Component

Tocreateanewcustomcomponent,youcanuseanyoffivedifferentestimation
methods:
Createahydrocarbonpseudocomponent.Thisistreatedlikeapure
componentinthatcertainaspectsofhowitbehavesorreactsareknown.
UsetheJoback/Lydersenmethod.Withthismethodyouindicatebasic
characteristics,andselectmoleculargroups(knownasJobackgroups,called
GroupAssignmentsinCHEMCAD)fromalist,toindicatehowmanyofeach
moleculargrouparepresentinthecomponent.
UsetheUNIFACmethod.ThismethodissimilartoJoback/Lydersen,except
thatthegrouplistismorespecializedtowardorganiccomponents.
Createacombustionsolid.Thismethodisusedtosimulatesolid
componentsforwhichanelementalanalysisandheatingvalueareknown,
e.g.,coal.
Createanelectrolytecomponent.Thismethodcreatesacomponentthatyou
cansubsequentlyuseinanelectrolytesimulation.
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CustomizingCHEMCAD
Theprocedureforcreatingapurecomponentisasfollows:
1. SelectThermophysical>ComponentDatabase>CreateNewComponent.
ThisbringsuptheNewComponentdialogbox.
Figure 9-01: The New Component dialog box
2. Givethenewcomponentadescriptivename;itisstronglyrecommendedthat
youmakethisnameunique.Allothercharacteristicshereareoptional,except
fornormalboilingpoint,whichisrequiredforthepseudocomponent
method.
3. SelectaCorrelationoptiontoindicatewhichoftheabovemethodsyouwill
use,andclickOKtocontinue.
4. ThedialogboxthatappearsnextdependsontheCorrelationthatyou
selected:
PseudocomponentbringsuptheHydrocarbonCorrelationdialogbox.
GroupcontributionJobackbringsuptheGroupAssignmentsdialogbox.
GroupcontributionUNIFACbringsuptheNewComponentUNIFAC
Groupsdialogbox.
CombustionsolidbringsuptheCombustionSoliddialogbox.
ElectrolytebringsuptheElectrolyteDatadialogbox.
Selecttheappropriateoptionsforyournewcomponentandspecifyasmany
characteristicsasyoulike,asaccuratelyaspossible.ClickOKtocontinue.
5. IntheSelectDestinationDatabasedialogbox,youwillseenodatabaseslisted
ifthisisyourfirsttimetoaddacomponent.Ifthisisthecase,clickNewto
bringuptheManageComponentDatabasesdialogbox.
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CustomizingCHEMCAD
Figure 9-02: The Manage Component Databases dialog box
6. Normally,youllneedtoclickCreate,whichbringsuptheSaveAsdialog
box.Navigatetothelocationyouwantforyourcustomcomponentdatabase,
givethedatabaseaname,andclickSave.Ifyouwanttoaddadatabasethat
someoneelsehascreated(generallyinanetworklocation),youcanclick
Connect,whichbringsupanOpendialogbox;navigatetothatdatabases
location,highlightthedatabase,andclickOpen.
7. TheManageComponentDatabasesdialogboxnowliststhedatabasethat
youcreatedorselected.ClickOKtocontinue.
8. IntheSelectDestinationDatabasedialogbox,thenewdatabaseyouhavejust
namedisnowlisted;highlightitandclickOK.
9. TheView/EditComponentDatamenunowappears.Clickanyitemonthe
menutoaccessadialogboxwithoptionsfordefiningyournewcomponent.
Afterdefiningasmanycharacteristicsaspossible,clickExittoclosethe
menu.
Thenewcomponentisnowavailabletoaddtoyourcurrentsimulationandall
futuresimulations.Toreturnatanytimetomakechangestoauserdefined
component,dooneofthefollowing:
SelectThermophysical>ComponentDatabase>View/EditDatabase
ComponenttobringuptheSelectSingleComponentdialogbox,whichlists
allavailablecomponents.Highlightthecomponentyouwantinthelistand
clickOKtobringuptheView/EditComponentDatamenu.
ClickComponentListonthetoolbar(orselectThermophysical>
ComponentDatabase>View/EditSimulationComponent)tobringupthe
listofcomponentsinthecurrentsimulation.Doubleclickthecomponentyou
wantinthelisttobringuptheView/EditComponentDatamenu.
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CustomizingCHEMCAD
Regressing Data into the Component

Dataregressionistheprocessoffittingexperimentaldatapointstoapolynomial
equationform,sothattheindividualerrorofeachdatapointisminimized.
Dataregressionisonlyrelevanttotemperaturedependentpropertiessuchas
heatcapacity,density,andvaporpressure.CHEMCADusesthesepolynomial
equationfitstocalculatethepropertiesofacomponentatanygiventemperature.
Toregressdataintoacomponentthatyouhavecreated,followthesesteps:
1. SelectThermophysical>ComponentDatabase>ComponentProperty
Regression.ThisbringsuptheSelectRegressionDataSetdialogbox.
Figure 9-03: The Select Regression Data Set dialog box
2. SelecttheuseraddedcomponentthatyouwanttoregressandclickNew.
ThisbringsuptheEditRegressionSetdialogbox.
Figure 9-04: The Edit Regression Set dialog box
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CustomizingCHEMCAD
3. Selectaregressiontypeandprovideadescriptivenameforthedata
regression,thenclickOK.Thisbringsupadialogboxthatdisplays
parametersfortheselectedregressiontype.
4. Verifythedataonthisdialogbox,makingadditionsorchangesasnecessary,
andthenclickOK.Thisbringsupadialogboxfordataentry.
5. Enteryourexperientialdatapointsinthecellsprovided.Youcanentera
valueintheWeight_factorcolumntoweighttheregressiontowardoneor
moredatapoints.Whenyouhaveenteredallofyourdatapoints,clickOK.
Note:YoucanpasteacontiguousrangeofcellsfromanExcelworksheetintothe
cellsinthisdialogbox.
6. TheregressiondataisdisplayedinatabinthemainCHEMCADwindow.
Anothertabdisplaystheregressionresultsingraphicalformat.Reviewthe
dataandplot,anddecidewhethertheregressionadequatelyrepresentsyour
experimentaldata.
7. Adialogboxappears,askinghowyouwouldlikethechangestobeapplied
toexistingsimulations.ChooseanoptionandthenclickOK.
8. Repeatthisprocedureasneededtoregressotherpropertiesforyour
component.
Pseudocomponent Range
Usingapseudocomponentcurveanothertermforthedistillationcurveportionofan
assayyoucancutahydrocarbonstreamintopseudocomponents,orfractions.A
pseudocomponentrepresentsagroupofcomponentsthatboilwithinanarrow
temperaturerange.PseudocomponentrangesareusedinCHEMCADtomodel
hydrocarbons.
Whenyoudefineapseudocomponentrangeforastream,CHEMCADcreates
entriesinthecomponentdatabaseforeachhydrocarboncut,andassignsthese
componentscompositionstothestream.
Note:Beforeyoudefineapseudocomponentrange,makesurethatyouhave
specifiedinyourcomponentlist,asappropriate,waterandanylightendsthatexist
intheassay.
1. SelectThermophysical>PseudocomponentCurves.
2. IntheDistCurveCharacterizationdialogbox,enterstreamnumber(s)and
clickOK.
3. IntheHydrocarbonCorrelationdialogbox,selecttheappropriate
correlationsforyourcurve,orusethedefaultselectionsandclickOK.
4. ThisbringsuptheCurveTemperatureCutRangesdialogbox.Foreachcut
rangethatyouwanttodefine,provideabeginningandendingtemperature,
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CustomizingCHEMCAD
andenterthenumberofpointsthatyouwanttodefineasdiscrete
pseudocomponentswithinthatrange.ClickOKtocontinue.
5. IntheBulkPropertiesdialogbox,specifyadistillationcurvetypeandentera
totalflowrateandbulkgravityforthestream.Youcanmakeotherentries
hereasneeded,butonlythesethreeitemsarerequired.Notethatifyouhave
viscositydatathatyouwanttouse,youmustchecktheViscosityboxhere.
ClickOKtocontinue.
6. Intheresultingdialogbox,enterthedistillationcurvefromyourassay,
specifyingthevolumepercentageandboilingtemperatureforatleastfive
datapoints.ClickOKtocontinue.
7. Thenextdialogboxisoptional.Enteragravitycurvefromyourassay,listing
thevolumepercentageandspecificgravityforatleastfivedatapoints.Click
OKtocontinue.
8. Thenextdialogboxisalsooptional.Ifyouhavelightendsandwaterdefined
inyourassay,entervolumepercentagedatahereforallrelevantcomponents.
ClickOKtocontinue.
9. IfyoucheckedtheViscosityboxontheBulkPropertiesdialog,youwillnow
seetheViscosityDatadialogbox.EnteryourviscositydataandclickOK.
10. ThisbringsuptheEditDistillationCurvesmenu,showninFigure905.
Figure 9-05: The Edit Distillation Curves menu
11. ClickSaveandExit.Thepseudocomponentpropertiesnowdisplayinatab
inthemainCHEMCADwindow.Youcanreviewandprinttheseresults,and
leavethetabopenaslongasyoulike.Toreturntothemainworkspaceand
yourflowsheet,simplyclickthefarlefttab,whichdisplaysthenameofyour
simulation.
12. Toseethelistofpseudocomponentsthatyouhavecreated,editthe
propertiesforthestreamyouselected.Thepseudocomponentswillbelisted
afterpurecomponents,withnamesthatbeginwithNBP.
Importing a Neutral File

Youcanalsoaddacomponenttothedatabasebyimportingitsphysicalproperties
fromanexternaldatasource.Thisprocedureisknownasneutralfileimport.
Fordetailedinformationaboutimportingandusinganeutralfile,seethe
CHEMCADHelpsystem.
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CustomizingCHEMCAD
Creating a Custom Symbol

YoucancreateacustomsymbolinCHEMCAD,forusewitheitherabuiltinUnitOp
orauserdefinedUnitOp.ThetoolusedtocreatesymbolsiscalledtheCHEMCAD
SymbolEditor.
YoucanlaunchtheSymbolEditorineitheroftwoways:
WithinCHEMCAD,selectEdit>EditUnitOpSymbols.
FromWindows,selectStart>AllPrograms>Chemstations>Utilities>
SymbolEditor.
Oncetheeditorisopen,youllseeagriddedworkspaceandasmall,freefloating
toolpalette.
Figure 9-06: The Symbol Editors workspace and palette
Youcanbuildasymbolfromthegroundup,butthebestwaytolearntousethis
toolistoeditanexistingCHEMCADUnitOpsymbol.Todothat,followthesesteps:
1. SelectFile>OpenfromtheSymbolEditormenu.IntheOpendialogbox,
selectafilefromSymbolsdirectoryandclickOpen.Theselectedsymbol
opensintheSymbolEditorworkspace,asshowninFigure907.
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CustomizingCHEMCAD
Figure 9-07: The pump_1.sym file open in the Symbol Editor workspace
2. SelectFile>SaveAsandsavethefileinadifferentdirectory,usinga
distinctivenametoavoidconfusionwiththeoriginalsymbol.
3. UsethetoolsavailableinSymbolEditortochangethesymbolasneeded:
Toremoveoralteranyexistingpartofthesymbol,selectStructure>
Ungrouptobreakthesymbolintoitsindividualcomponents.
Toaddgraphicalcomponentstothesymbol,usethedrawingtoolsonthe
toolpalette,suchasRectangleandEllipse.
Toaddatextlabeltothesymbol,usetheTexttool.
Toaddaninletoroutlet,clicktheappropriateitemonthetoolpalette
andthenclicktoplacetheinletoroutletonthesymbol.
Tobackoutofachangethatyouvemade,selectEdit>Undoorpress
[CTRLZ].
4. Whenyourereadytosavethesymbol,makesurethatyouhavedeletedany
unwanteditemsontheworkspace.SelectEdit>SelectAllorpress[CTRLA],
andthenselectStructure>Group.
5. SelectFile>Savetosavethechangestoyournewsymbol.
Tocreateatotallynewsymbol,simplystartfromablankworkspace,namethe
file,andusethevariousdrawingtoolstocreatethedesiredcombinationofshapes
andtext.Addinletsandoutletsasneeded,thengroupthesymbolscomponentsand
savethefile.
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CustomizingCHEMCAD
Onceyouvecreatedyournewsymbol,youneedtoassociateitwithaUnitOp
typeandthenadditintotheappropriateUnitOpsubpalette.
1. WithintheSymbolEditorprogram,selectFile>EditUnitOpType.The
SelectUnitOperationTypedialogboxappears.
Figure 9-08: The Select Unit Operation Type dialog box
2. SelecttheappropriateUnitOptypeandclickOK.
3. ToassignthenewsymboltoaUnitOppalette,selectFile>Addto
CHEMCADPalette.
4. CloseandrestartCHEMCADtoseeyournewsymbolappearonthe
specifiedsubpalette.
Customized Costing Calculations

CHEMCADincludessomeverybasiccostingroutinestohelpdeterminethecapital
costofequipment.UsingasimplifiedformofCknownastheParserlanguage,you
maymodifytheseroutinestobettersuityourneeds.Detailsofthisprocedureare
foundintheCHEMCADCalculator/ParserModuleguide,availableonthe
Chemstationswebsite.
Creating Custom UnitOps

IfyouneedaUnitOpthatfallsoutsidetherangeofoptionsofferedontheAll
UnitOpspalette,youcancreateacustomUnitOp.Thegoalofcreatingacustom
UnitOpistohaveaunitwhereyoucanenteryourownequationstocalculateheat
andmassbalances.Overtheyears,CHEMCADusershavecreatedcustomUnitOps
forpurposesasdiverseasmembraneseparationunits,fuelcells,specializedsolids
handlingunits,andcrystallizersfortheseparationofxylenes.
FouritemsontheAllUnitOpspalettearededicatedtouserdefinedUnitOps.
YoucancreateacustomUnitOpusinganyofthefollowingfourways:
ExcelUnitOp:CreatedthroughacombinationoftheCOMinterfaceandtheData
Mapinterface
Calculator:CreatedusinganinlineCprogram
Useraddedmodule:CreatedusingVisualStudiooranotherC++compiler
VBAUnitOp:CreatedthroughtheVBAEditor,whichispartofCHEMCAD
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CustomizingCHEMCAD
ThebasicproceduresforcreatingcustomExcelUnitOpsarecoveredinChapter
10,DataInterfaces.CalculatorUnitOpsaredefinedbyaprogramminglanguage
calledParser,thesyntaxforwhichisdocumentedintheCHEMCADCalculator/Parser
Moduleguide,availableontheChemstationswebsite.
C++useraddedmodulesaredevelopedusingMicrosoftsVisualC++
developmenttool,thesametoolsthatwereusedinthecreationofCHEMCADsown
UnitOps.TheproceduresforcreatingC++useraddedmodulesforusewith
CHEMCADaredetailedintheUseraddedModulesGuide,whichisalsoavailableon
theChemstationswebsite.
VBAUnitOpsaredefinedbyVBAsubroutines,andaredescribedlaterinthis
chapter.
ThemethodyouchooseisanimportantfirststeptowardcreatingaUnitOp,but
thechoiceisalmostentirelyuptoyou.CalculatorUnitOpscanbequickandeasyto
setup,buttheycantdoeverythingtheothermethodscan.TheExcel/VisualBasic
approachisverypowerfulandusesthefamiliarVisualBasiclanguagefor
development.Adrawbacktothismethodisthatcalculationcansometimesbeslow
duetotheuseofMicrosoftExceltodothecalculations.Themostpowerfuland
fastestcalculatingmethodistheC++useraddedmodulemethod,butifyouarenew
toC++,itmaybechallengingtouse.VBAUnitOpsareaspowerfulasthosecreated
usingC++,andaremucheasiertobuild.
WhichevermethodyouusetoprogramthecalculationsofyourUnitOp,youwill
likelyneedtocreateadialogboxtoprovideauserinterface.Adialogboxenables
userstosendinformationintoyourUnitOp,forexamplethenumberofstagesfora
distillationUnitOp.NomatterwhatmethodyouusetoprogramyourUnitOp,you
willusetheDialogEditorprogramtocreatetheuserinterface.
Creating a Custom UnitOp Dialog Box

CHEMCADusesdialogboxestosetvariablesforalltypesofUnitOps.Usingthe
DialogEditorprogram,youcancreateacustomdialogboxforusewithanytypeof
useraddedunits.
YoucanalsoeditanexistingUnitOpsspecificationdialogboxforexampleto
addtextnotes,totranslatefromEnglishtoanotherlanguage,ortolimittheUnitOps
functionalityalthoughthisisnotcommonlydone.
TheDialogEditorprogramenablesyoutocreateandmodifydialogboxes,
whicharecontrolledbyfileswiththe.MYextension.Thesefiles,alongwith.MAP
filesand.LABfiles,definedialogboxesforuseinCHEMCAD.
TousetheDialogEditorprogram,youllneedagoodunderstandingof
Windows,alongwithabasicknowledgeofVisualProgrammingconceptssuchas
objectsandproperties.Youshouldalsohaveafirmunderstandingofsimulationin
CHEMCADbeforeventuringintoDialogEditor.
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CustomizingCHEMCAD
TheDialogEditorprogramisseparatefromCHEMCAD.Tolaunchit,select
Start>AllPrograms>Chemstations>Utilities>DialogEditor.
Figure 9-09: The Dialog Editor window showing an open dialog
AdetaileddescriptionofhowtousetheDialogEditorisavailableonthe
Chemstationswebsite,aswellasontheCHEMCADinstallationCDROM.
Customizing Thermodynamics
Occasionally,youmayfindthatnoneofthethermodynamicmodelsbuiltinto
CHEMCADserveyourneedsforaparticularsimulation.Ifthisshouldhappen,you
cantakeoneoftwoapproachestohandlingthermodynamicsforthesimulation:
eithercreateyourownKvalueorenthalpymodelorcreateyourownmixingrule.
Creating a Custom K-value or Enthalpy Model

TheKvalueforanycomponentisaratiothatreflectstheamountofthatcomponent
presentinvaporandliquidphasesundergivenconditions.CHEMCADusesK
valuestocalculatevaporliquidequilibriuminstreamsandinUnitOps.
Anenthalpymodelcalculatestheheatcontentofasystemundergiven
conditions.EnthalpymodelsareusedtocalculatetheheatbalanceinCHEMCAD
simulations.
IfyouhaveaKvalueorenthalpymethodthatyoudliketouse,youcanwrite
C++codetointroduceyourmodelintotheCHEMCADsystem.Adetailed
descriptionofhowtocreatecustomKvaluesandenthalpymodelsisavailableinthe
UseraddedModulesGuide,whichisavailableontheChemstationswebsiteandon
theCHEMCADinstallationCDROM.
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CustomizingCHEMCAD
WhenyouvesuccessfullyaddedacustomKvaluemethod,youcanselectiton
theKvalueModelstaboftheThermodynamicSettingsdialogbox,byusingthe
GlobalKvalueOptionsettingcalledADDK.
Figure 9-10: Selecting the ADDK K-value option
Afteraddingacustomenthalpymodel,youcanselectitontheEnthalpyModels
taboftheThermodynamicSettingsdialogbox,byusingtheGlobalEnthalpyOption
settingcalledADDH.
Figure 9-11: Selecting the ADDH enthalpy model
Creating a Custom Mixing Rule

AmixingruledetermineshowCHEMCADcalculatesthepropertiesofamixer,
basedonthepropertiesofitspurecomponents.Youcancreatecustommixingrules
foranyoftheselectionslistedontheTransportPropertiestab,eitherusingVBAas
describedinthefollowingsectionorusingC++.
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CustomizingCHEMCAD
Visual Basic Applications (VBA)

YoucancustomizeCHEMCADusingVisualBasicApplications,orVBA.The
CHEMCADExplorersVisualBasictabprovidesaccesstothefollowingtypesof
customizableitems:
Reactions
Properties
UnitOps
IfyouhavewrittencodeinVBAthatyouwouldliketomakeavailablein
CHEMCAD,youcaninsertthatcodeintooneofthetemplatesthatCHEMCAD
provides,oruseanyofthesetemplatesasastartingpointandlaunchaVBAeditor
fromwithinCHEMCAD.
Defining a Reaction, Mixing Rule, or UnitOp

Todefineacustomreaction,mixingrule,orUnitOpusingVBA,followthesesteps:
1. ClicktheVisualBasictabinCHEMCADExplorerandexpandtherelevant
item:Reactions,Properties,orUnitOps.
2. DoubleclicktherelevanttemplateitemtoopentheVBAeditor.
3. Copytheexistingsubroutineandpastethecodebelowtheexampleinthe
codewindow.Renamethenewsubroutinecopy.
4. Editthenewsubroutineasneededtoachievetheresultthatyouwant.
5. ReturntoCHEMCADbyeitheroftwomethods:
Use[ALTTAB]ortheWindowstaskbar,leavingtheVBAeditorwindow
open.
ClicktheViewCHEMCADbuttonatthefarleftendoftheVBAeditors
toolbartoclosetheeditorwindow.
Note:Youcanalsousethe[ALTF11]keycombinationtotogglebetweenCHEMCAD
andtheVBAeditor.
6. SavethecurrentCHEMCADsimulation,thenexpandtherelevant
CHEMCADExploreritemagaintoseeyournewlydefinediteminthelist.
Using a VBA-defined Reaction

Onceyouhavedefinedanewreaction,youcanuseitforakineticorbatchreactor:
1. SelecttheBatchReactororKineticReactortoolandplaceareactoriconon
theflowsheet.AddandspecifystreamsforthisUnitOpasappropriate.
2. Doubleclicktheicontodefinereactorspecifications.Makethefollowing
selectiontouseyourVBAdefinedreaction.
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CustomizingCHEMCAD
Batchreactor:Afterspecifyingthereactorsinitialcharge,youllseethe
BatchReactorGeneralInformationdialogbox.OntheGeneraltab,select
thekineticrateexpressionoptioncalledDefineeachreaction.
Kineticreactor:OntheGeneralSpecificationstaboftheKineticReactor
dialogbox,selectthekineticrateexpressionoptioncalledDefineeach
reaction.
3. Foreachreactionthatyoudefine,youllenterdataintoaKineticDatadialog
box.ChoosetheKineticRateExpressionoptioncalledUserVBA.This
bringsupadropdownlisttotherightoftheKineticRateExpressionfield,
whereyoucanchooseauserdefinedreaction.Selecttheappropriateoption
foreachreactionthatyoudefineforthisUnitOp,andthenclickOKto
continuetothenextreaction.
Figure 9-12: Selecting a VBA-defined reaction in the Kinetic Data dialog box
4. Whenyouhavedefinedthelastreaction,clickOKtoreturntothemain
CHEMCADwindow.
Using a VBA-defined Mixing Rule

Onceyouhavedefinedanewmixingrule,youcanincludeitinyourCHEMCAD
simulations:
1. SelectThermophysical>ThermodynamicSettings.
2. IntheThermodynamicSettingsdialogbox,dropdownthelistofoptionsfor
themixingrulethatyouusedasatemplateforyournewrule.Selectyour
rulefromthelist.
3. ClickOKtoreturntothemainCHEMCADwindow.
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CustomizingCHEMCAD
Using a VBA-defined UnitOp

OnceyouhavedefinedanewVBAUnitOp,youcanincludeitinyourCHEMCAD
simulations:
1. SelecttheVisualBasicUnitOptoolandplaceaniconontheflowsheet.Add
streamsintoandoutoftheUnitOpasyounormallywould.
2. DoubleclicktheicontodefinetheUnitOpsspecifications.
3. IntheVisualBasicUnitOpdialogbox,dropdowntheFunctionlisttoseethe
availableVBAUnitOps.SelecttheoneyouwanttouseandclickOK.
Figure 9-13: Selecting a VBA UnitOp
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CustomizingCHEMCAD
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Chapter 10
Data Interfaces
CHEMCADenablesyoutoexchangedatawithotherprogramsthroughavarietyof
methods.Thissavestime,effort,andthepotentialforkeystrokeerroranddata
omissions.Insomecases,thesedatainterfacescanenableCHEMCADtolink
directlyintoyourplantinformationsystemstorunsimulationswithouthuman
intervention.
ThedatainterfacesthatCHEMCADusesareasfollows:
TheExcelDataMapinterface,whichcanlinkanyvalueinaCHEMCAD
simulationtoanycellinanExcelworksheet,orviceversa(notethatrunning
CHEMCADsimulationsfromExcelrequiresaCOMinterface,described
below)
TheVisualBasicApplicationinterface,whichenablesyoutobuildcustom
reactions,mixingrules,andUnitOps
TheOPCinterface,whichpermitsanyOPCClientapplicationtoaccess
valuesinaCHEMCADsimulation
COMinterfaces,whichallowanyCOMenabledprogram(suchasMATLAB)
toaccessandcontrolaCHEMCADsimulation
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DataInterfaces
Excel Data Mapping

TheExcelDataMappingfeatureallowsyoutolink,retrieve,andinsertdatafroman
ExcelspreadsheetintoaCHEMCADsimulation.Italsoletsyouinsertdatafroma
CHEMCADsimulationintoanExcelspreadsheetwithjustafewclicks.The
integrationofCHEMCADandExcelisapowerfulandeasytousetoolthatsaves
youtimeandwork.
WithExcelDataMapping,youcanquicklyandeasilygetthemostof
CHEMCAD/Excelintegration,evenifyouhavenoexperiencewithVisualBasicor
Excelprogramming.Infact,youcanuseandbenefitfromthisfeatureevenwithvery
littleknowledgeoftheExcelprogram.
TouseExcelDataMapping,youmustfirstcreateoneormoreDataMaps,and
thensetuprulesfortheexecutionofeachDataMapinuse.
Creating an Excel Data Map

ThetoolusedtocreateandeditDataMapsinCHEMCADistheExcelDataMap
Editor.ThistooldisplayswithintheCHEMCADworkspace,andresemblesanExcel
spreadsheet.IthasallyouneedtolinkstreamandUnitOpparameterstooneor
moreExcelspreadsheets.OneachExcelDataMap,youcanlinkupto500
parametersinasinglespreadsheet,andyoucanhaveuptotenDataMapsper
simulation.
TolinkyoursimulationtoanExcelspreadsheet,firstcreatethetargetExcel
workbook,makinganoteofthefilesname,itslocation,andthenameofthespecific
worksheettowhichyouwanttolink.Thenfollowthesestepstocreateanewdata
map:
1. OntheCHEMCADExplorer,expandtheDataMapsitemandthenclick
NewDataMap.AspreadsheetwillopenwithintheCHEMCADworkspace.
Figure 10-01: The Excel Data Map Editor
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DataInterfaces
2. ClicktheBrowsebuttonandlocatethetargetworkbook.Selecttheworkbook
fileandclickOpen.
3. InthecellnexttoExcelWorksheetName,typethenameoftheworksheetto
whichyouwanttolinkyoursimulation.
Note:Ifyouneedtoverifythenameoftheworksheet,youcanclicktheOpenbutton
tolaunchExcelandviewtheworkbook.
4. DoubleclickthecellbelowMapRuletoseeadropdownlistofmapping
options:
ToWorksheetOnlyenablesyoutosenddatafromstreamsorUnitOpsin
CHEMCADtotheselectedworksheet.
ToCCOnlyenablesyoutosenddatafromanycellontheworksheetto
theselectedstreamorUnitOpparameterinyoursimulation.
Fordatareconciliationenablesyoutomanipulatethedatausing
CHEMCADsDataReconciliationfeature.
Figure 10-02: Selecting a Map Rule option in the Excel Data Map Editor
5. DoubleclickthecellbelowCCObjTypetoseeadropdownlistofmapping
options:
StreamenablesyoutolinkanExcelcellorcellrangetoastreamonthe
flowsheet.
UnitOpenablesyoutolinkanExcelcellorcellrangetoaUnitOponthe
flowsheet.
Miscenablesyoutochangedynamicflowsheetsettings.
6. ClickthecellbelowCCObjID.TypetheIDnumberofthestreamorUnitOp
towhichyouwanttolink.
7. DoubleclickthecellbelowParIDtoseeadropdownlistofparametersfor
theselectedUnitOporstream.Scrolldownandselectanoptionfromthelist.
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DataInterfaces
Note:WhenyouareimportingcelldataintoCHEMCAD,thelistofparameter
optionsislimited,asmanyvaluesinaCHEMCADsimulationarecalculatedbased
onothervalues.
8. Ifyouchoseaparameterthatisrelatedtoaspecificcomponent(e.g.,Comp
Molefraction,oranyitemmarkedwithanarrow),youwillneedtospecifythe
component.DoubleclickthecellbelowComponenttoseeadropdownlist
ofavailablecomponents.Selectacomponentfromthelist.
Figure 10-03: Component-specific parameters marked with arrows on the Par ID list
9. ClickthecellbelowWrkShtCell/Range.Typethecelladdressorcellrange
towhichyouwanttolink.Celladdressesshouldbeformattedwiththe
columnletterandrownumber,e.g.,A1orD17.Cellrangesshouldbe
formattedastwosuchaddresses(representingtherangesfirstandlast
values)separatedbyacolon,e.g.,A1:A12orB5:E20.
10. Ifyouareperformingadatareconciliation,youcanusetheWeightcolumn
togivecertainitemsinthereconciliationmoreimportancethanothers.
11. Repeattheprocedureuntilyouhavespecifiedallofthecellsorcellranges
thatwilllinktoyoursimulation.
12. SavetheDataMapbyselectingFile>SaveAs.TypeanameforyourData
MapandthenclickOK.ThenewlycreatedDataMapnowappearsonthe
CHEMCADExplorerundertheDataMapsitem.
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DataInterfaces
Figure 10-04: List of available Data Maps in CHEMCAD Explorer
13. ToleavetheDataMapopenandreturntoyoursimulation,usethetabsatthe
bottomofthemainCHEMCADworkspace.ToclosetheDataMap,select
File>Close,orclicktheredXbuttonontheDataMapstab.
Data Map Execution Rules

AfterconfiguringoneormoreExcelDataMapsforasimulation,youmustsetup
executionrulestousethem.YoucanconfigureuptotenDataMapfilesper
simulation.
TosetupDataMapexecutionrules,followthesesteps:
1. OntheCHEMCADExplorer,expandtheDataMapsitemandthenclick
ExecutionRules.TheDataMapExecutionRulesdialogboxappears.
Figure 10-05: The dialog box for configuring execution rules
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DataInterfaces
2. ClickthesquarebuttonnexttothefirstfieldintheSelectDataMapscolumn
tobringuptheSelectDataMapdialogbox.
Figure 10-06: Selecting a Data Map from the list
3. SelectthenameoftheDataMapforwhichyouwanttosetrules,andclick
OKtoreturntotheDataMapExecutionRulesdialogbox.Repeatthisstep
forallotherDataMapswhoserulesyouwanttosetupatthistime.
4. IntheBeforeSimulationRunsfieldnexttoeachselectedDataMap,clickthe
dropdownlisttochooseanactionforthatDataMaptoperformbefore
calculationsbegin:
DoNothingperformsnoactionbeforethesimulationisrun.Youmight
usethisoptiontodisableaDataMaptemporarily.
ToWorkbooksendstherequesteddatatoExcelbeforerunningthe
simulation.Youmightusethisoptionwhenyouwanttopulldatafrom
inletstreamsorUnitOpspecifications.
ToCHEMCADsendstherequesteddatainExceltoCHEMCADbefore
runningthesimulation.Youmightusethisoptionwhenyouwanttofeed
datatoinletstreamsorUnitOpswithdatafromtheExcelworksheet.
5. IntheAfterSimulationRunsfieldnexttoeachselectedDataMap,clickthe
dropdownlisttochooseanactionforthatDataMaptoperformafter
calculationsarecomplete:
122
DoNothingperformsnoactionafteryoursimulationhasrun.Youmight
usethisoptiontodisableaDataMaptemporarily.
ToWorkbooksendstherequesteddatatoExcelafterrunningthe
simulation.Youmightusethisoptionwhenyouwanttosenddatafrom
streamsorcalculatedparametersofUnitOpstotheworkbookinExcel.
DataInterfaces
Figure 10-07: Three different Data Maps with rules set up
6. WhenyouhaveconfiguredalloftheDataMapsthatyouwanttouse,click
OKtosaveyourrulesandclosetheDataMapExecutionRulesdialogbox.
Youcannowrunthesimulation.IfyouopentheExcelfilesthatarelinkedtothe
simulation,youwillbeabletoseetheparametersofstreamsandUnitOpsrelatedto
theExcelDataMap.Youcanalsoperformyourowncalculationsintheworkbook
basedonthedatalinkedtoCHEMCAD.
Creating Excel UnitOps

YoucanbuildanExcelspreadsheetthatfunctionsasaUnitOpwithinCHEMCAD.
ThisisusefulforextremelysimpleUnitOpssuchasmixersanddividers,orfor
simpleseparations.
1. StartbycreatingacustomdialogboxforyournewUnitOp,asdescribedin
Chapter9,CustomizingCHEMCAD.
2. Next,createanExcelspreadsheetcontainingyourdesiredcalculationsforthe
newUnitOp.
3. Openasimulation,selecttheExcelUnitOptoolontheAllUnitOpspalette,
andplaceaUnitOpiconontheworkspace.
4. DrawtheappropriatestreamsintoandoutoftheExcelUnitOp.
5. DoubleclicktheUnitOpicontoopentheExcelWorkBookUnitdialogbox.
6. OntheFilePathstab,usethetopBrowsebuttontospecifythelocationand
filenameofthecustomdialogboxthatyoucreated.UsethesecondBrowse
buttontospecifythelocationandfilenameoftheExcelworkbook.
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DataInterfaces
7. NowyouneedtospecifyhowthisspreadsheetwilllinktoCHEMCAD.Click
theDataMapstabtolinkthespreadsheetusingoneormoreDataMaps,or
clicktheExcelMacrostabtolinkthespreadsheetusingtheCOMinterface.
OntheDataMapstab,specifytheexecutionrulesasdescribedearlierin
thischapter.
OntheExcelMacrostab,specifythenamesoftheExcelmacrosthatyou
haveprogrammedtousetheCOMinterface,intheorderthatyouwant
themtobecalculated.
8. ClickOKtoreturntothemainCHEMCADwindow.
Specification Sheets
UsingtheinterfacewithMicrosoftExcel,CHEMCADallowsyoutooutput
simulationdatatoanExcelspreadsheetresemblingavendorspecificationsheet,as
discussedinChapter8,OutputandReports.Customizingthesespecsheetssavesyou
timebyoutputtingdataintheformatrequiredbyyourcompanyorvendor.
TocustomizethespecsheetforaspecificUnitOptype,editthecorresponding
Excelspreadsheetinthefollowingdirectory:
C:\ProgramFiles\Chemstations\CHEMCAD\Program\templates
IftheUnitOptypeyouwantisnotrepresentedbytheExcelfilesinthisdirectory,
youcancopythegenericspecsheet.xlsfileanduseitasatemplateforanewUnitOp
spreadsheet.
Placethecopyinthesamedirectory,andmakeitsfilenamethestandardfour
characterabbreviationfortheUnitOptypeinquestion.Forexample,tocreateaspec
sheettemplatefortheFlashUnitOp,youwouldneedtonamethefilecopyflas.xls.
SeetheCHEMCADHelpinformationaboutyourspecificUnitOpifyouneedtolook
upthisabbreviation.
Beforeyoucontinue,youwillneedtoturnofftheReadonlyattributeforthe
newspreadsheetfile.Thequickestwaytodothisistorightclickthefilewithinthe
WindowsExplorer,selectProperties,andthencleartheReadonlycheckboxinthe
Propertiesdialogbox.
OncethecopyisrenamedandtheReadonlyattributeisturnedoff,youcan
openthespreadsheetandedititasneeded.
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DataInterfaces
Using CHEMCAD as an OPC Server

CHEMCADiscapableofsettingupanOPCserverwhichallowsdirectdatatransfer
betweenanyCHEMCADsimulationandanyOPCclientapplication.
OPCstandsforOLEforProcessControl.OPCprovidesastandardmethodfor
differentdevicesandapplicationstosharedata.UsingOPC,youcansharedata
betweenCHEMCADsimulationsandSCADAsystems,datahistorians,distributed
controlsystems(DCS),andhumanmachineinterfaces(HMIs).
Infact,theacronymOPCisnowconsideredbymanytomeanOpenness,
Productivity,Connectivity,becausethistechnologyformsthebasisforsharingand
manipulatingplantdata.
OPCenabledsystemsareclassifiedaseitherOPCserversorOPCclients.OPC
serversareeitherapplicationsordevicesthatprovidedata.OPCclientsare
interfacesthatuseandmanipulatethisdata.OPCclientscanconnecttomultiple
OPCserversatanytimeandreadandwritedatatoallofthem.
OPC Applications
OPCcanbeappliedasfollows:
Inferentialsensors:Sometimescalledsoftsensors,inferentialsensorsuseone
ormoremeasuredvariablestoestimateanothervariable.UsingCHEMCAD
simulationsanddatafromyourplantsDCS,youcanembedsimulationsto
providedatasuchasconcentrations,heatduty,andfoulingfactor,which
wouldnotnormallybeavailable.
Operatortraining:YoucancoupleanoperatorHMItoadynamicsimulation
tocreateatrainingsimulatorthatcanhelptrainoperatorsinasafeand
effectiveway.
OPC Compliance
ChemstationsisaMemberoftheOPCFoundation,anorganizationdevotedto
maintainingtheOPCstandards.CHEMCADhasbeencertifiedfor,andinterop
testedfor,OPCDAstandard2.05a.
Enabling CHEMCAD as an OPC Server

ToenableOPCwithinCHEMCAD,selectTools>Options>Misc.Settings,then
checktheEnableOPCServerboxandclickOK.Whenyoudothis,CHEMCAD
registersanOPCservernamedCHEMCAD.SimulationServer.1onyourmachine.
Onceyouloadasimulation,allofthatsimulationsstreampropertiesand
UnitOpsettingsandvariablesareautomaticallypublishedastagstotheOPC
serversnamespace.
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DataInterfaces
Everyvaluetaghasaunitstagassociatedwithit,whichshowstheengineering
unitsusedtoreportthevalue.Tochangetheengineeringunits,selectFormat>
EngineeringUnitswithinaCHEMCADsimulation.
WhentheOPCserverfeatureisenabled,CHEMCADautomaticallyregisters
itselfasanOPCserver.IfyouwanttounregisterCHEMCADandremoveitfromthe
listofOPCservers,youcanselectStart>Runandtypethefollowingcommand:
{program directory}\CC6.Exe unregister
Forexample,ifyourprogramdirectorywereC:\Program
Files\Chemstations\CHEMCAD\Program(thedefaultdirectory),youwouldtype
thefollowing:
C:\Program Files\Chemstations\CHEMCAD\Program\CC6.exe unregister
Reading and Writing Values to CHEMCAD Using OPC

YoucanuseOPCtohavevaluesreadfromorwrittentoasimulation,andtorunthe
simulation.Bothsteadystateanddynamicsimulationscanberuninthisway.
ValuesareupdatedtotheOPCserverwheneverCHEMCADcompletesasteady
staterunoradynamictimestep.Valuescanalsoberead;inthecaseofadynamic
simulation,readingvaluesbetweentimestepswillcausetheprogramtoextrapolate
fromthelastconvergedresults.
Valuescanbewrittenatanytime.IfCHEMCADisintheprocessofexecutinga
timesteporasteadystatesimulation,thevaluesareheldinabufferuntilthe
simulationisconverged,atwhichtimethevaluesarewrittentoCHEMCAD.
WhenvaluesarewrittentoaCHEMCADstream,thestreamisimmediately
reflashed,andallOPCtagsforthatstreamareupdated.
OPC Server Operations

InadditiontoreadingandwritingprocessdatatoCHEMCAD,itisusefultobeable
tosendcommandstoCHEMCAD,forexampletotellCHEMCADtostartorstop
runningasimulation.
ThisisdonewithaseriesofflagsintheCHEMCADgroupoftheOPCserver.To
useanyoftheseflags,writea1toflag.CHEMCADwillexecutethedesired
commandandreturnavalueindicatingsuccessorfailure.Areturnof0indicates
thatthecommandhascompletedsuccessfully,whileanegativereturnindicatesa
problemofsomekind.
Theavailablecommandsareasfollows:
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RefreshServertellsCHEMCADtorefreshalldatasenttotheOPCserver.
RunSteadyStaterunsasteadystatesimulation.Whenthesimulation
finishes,theflagwillbereseteitherto0(runconverged)ortoanegative
numberindicatingthenumberoferrorsthatoccurredduringtherun.To
DataInterfaces
viewtheerrormessagetext,youmustopentheCHEMCADinterface
directly.
Restoretoinitialstatereturnsadynamicsimulationtotimezero.Areturnof
0indicatessuccess;avalueof1indicatesfailure.
RunDynamicstartsadynamicsimulation.Areturnof0indicatessuccess;a
valueof1indicatesfailure.
RunDynamicOneSteprunsasingletimestepofadynamicsimulation.A
returnof0indicatessuccess;avalueof1indicatesfailure.
SetInitialStatesetsthecurrentprocessconditionsasthetimezero
conditions,overwritingtheprevioustimezeroconditions.Areturnof0
indicatessuccess;avalueof1indicatesfailure.
StopSimulationstopsadynamicsimulation.Areturnof0indicatessuccess;
avalueof1indicatesfailure.
CHEMCAD OPC Namespace

AnOPCnamespacedefinesandorganizesalltheavailablecommandsanddata.
OPCnamespacesaredividedintogroups,eachofwhichcontainsitems.Itemsare
sometimesreferredtoastags.
Note:Mostofthedataitemsinasimulationhaveengineeringunitsassociatedwith
them.Inthesecases,weusuallydefinetwoseparatetags,onecontainingthedata
valueandtheothercontainingtheunitsstring.Allunitsstringsarereadonlyfrom
OPC.Theunitsstringsaregovernedbythesettingsinsidethesimulation.
ThegroupsinCHEMCADsOPCnamespaceareorganizedasfollows:
CHEMCAD.SimulationServer:ThisistheOPCservername.Byconvention,
thisnameisfollowedbyaversionnumber,e.g.,
CHEMCAD.SimulationServer.1,toindicatetheOPCServerversion.Thisis
theservernametowhichOPCclientswillconnect.
CHEMCADGroup:Thisgroupcontainsanyinformationthatisnot
dependentonastreamorUnitOp,andallcommandsusedtorun
CHEMCAD.
StreamsGroup:Thisgroupcontainsaseriesofsubgroups,oneforeach
streamontheflowsheetnumberedbystreamIDnumber.
UnitOperationsGroup:Thisgroupcontainsaseriesofsubgroups,onefor
eachunitoperationontheflowsheet,numberedbyUnitOpIDnumber.
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DataInterfaces
COM Interfaces
ComponentObjectModel(COM)isaMicrosoftstandardplatformthatenables
programstosharecontentsuchasdataandcalculationroutines.Thisinterface
makesitpossibleforotherprogramstocontrolaCHEMCADsimulation.
CHEMCADactsasaCOMserver,soanyprogramthatcanactasaCOMclient
canbemadetointerfacewithCHEMCADinthisway.Ifyouarentcertainwhether
yourapplicationcanactasaCOMclient,checkwiththesoftwarevendor.
Note:UsingtheCOMinterfacetoCHEMCADisacomplicatedprocedurethat
requiressomeexperienceinprogramming.Ifyourorganizationlacksinhouse
expertiseinprogramming,considerbringinginathirdpartyresourcetoassistyou
withtheprocedure.
ThefollowingsectionisabriefwalkthroughofasimpleCOMinterfacebetween
ExcelandCHEMCAD.
Connecting Excel and CHEMCAD: A Simple COM Interface

WhileyoucanexportorimportdatavaluesusingExcelDataMap,more
complicatedinteractionssuchasrunningasimulationfromanotherprogram
requiretheextracontrolaffordedbytheCOMinterface.
Thefollowingisasimplifieddescriptionoftheprocedureforconnectingthese
twoprogramsandenablingExceltoloadasimulation,changeavalue,runthe
simulationagain,readthesamevalue,andthenclosethesimulation.
Inthisprocedure,youlluseExceltodothefollowing:
OpenCHEMCAD
ReadinvaluesfromCHEMCADintoanExcelworkbook
Changeavalueinthesimulation
Runthesimulation
ReadtherevisedvaluesbackintoExcel
Normally,usingCOMinterfacesinvolvessomeprogramming.Wehavecreated
anexamplecalledVBCLient.xlstohelpyouovercomethathurdle;youdontneedto
writeanycodeatalltousethistool.Evenifyouneedtowriteyourownprogram,
thecodeinthemacrosofVBClientwillcomeinhandyasaguide.
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Using the VBClient Example

FollowthesestepstousetheVBClientexample:
1. OpenExcelandloadtheworkbookcalledVBClient.xls.Thisworkbookhas
threeworksheets:
CommandcontainsbuttonsforcontrollingaCHEMCADsimulation.
Streamsdisplaysallstreamdatainthesimulation.Thissheetcanbeused
forbothinputandoutputofstreamvariablestotheCHEMCAD
simulation.
UnitOpsdisplaysallUnitOprelateddataforthesimulation.Thissheet
canbeusedforbothinputandoutputofUnitOpvariablestothe
CHEMCADsimulation.
2. OntheCommandsheet,youwillseeaseriesofbuttonstoloadCHEMCAD,
loadasimulation,readdatafromthesimulation,writedatabacktothe
simulation,andrunthesimulation.ClickLoadCHEMCADtostartan
instanceofCHEMCAD.
ClickLoadSimulationtoloadasimulationintoCHEMCAD.
MakeachangetothedatashownontheStreamsandUnitOpssheets.
Note:Somevaluesarereadonly.Forexample,VBClientdoesnotallowyouto
changeastreamstotalflowratedirectly;youmustinsteadchangethecomponent
flowratestomakeachangetothetotalflowrate.
3. ClickSaveDatatopushyourchangestotheCHEMCADsimulation.
4. ClickRunAlltorunthesimulation.
5. NotethechangestothedataontheStreamsandUnitOpssheets.
A Peek under the Hood

RightclickLoadCHEMCAD,selectAssignMacro,andthenclickEdit.TheVisual
BasiceditorinExcelopenstodisplaythecodebehindthebutton:
Sub LoadCC5()
' initialize global variables
selJobName = ""
selCaseName = ""
selUpdateStrUopData = False
selOK = False
Set CC5 = Nothing
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DataInterfaces
' load CHEMCAD

Set CC6 = CreateObject("CHEMCAD.VBServer")
If CC6 Is Nothing Then
Dim msg As String
msg = "Can not load CHEMCAD."
MsgBox msg
End If
End Sub
Themostimportantlineinthatwholesubroutineis:
Set CC6 = CreateObject("CHEMCAD.VBServer")
Inthatsingleline,ExcelloadsCHEMCADintomemory.
Loadingasimulationisaccomplishedwiththissimpleline:
retFlag = CC6.LoadJob(casePath)
Runningasimulationcanbeassimpleasthis:
retFlag = CC6.SSRunAllUnits
TheCOMInterfaceReferencesectionoftheCHEMCADHelpfile(listedunder
theheadingCustomization)providesafullreferenceofthecommandsavailable
throughCOM.
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Chapter 11
CHEMCAD Tutorials
AlthoughthesimulationsstoredinyourExamplesdirectoryareusefulformany
scenarios,thebestwaytolearntouseCHEMCADistocreateandrunsimulations
yourself.Thetutorialsinthischapterwalkyouthroughbasicsimulationbuilding
stepbystep,usingarealisticexampleproblemthatwillhelpprepareyouforyour
ownsimulations.
Thefirsttutorialisforasimplesteadystatesimulation,whichisthenusedasthe
basisforthesecondtutorial,inwhichyoulllearntousetheCCTHERMmoduleto
rateaheatexchanger.Thethirdtutorialwalksyouthroughabatchdistillation
problemusingCCBATCH,andthefinaltutorialcoversvariousscenariosforpiping
systems.
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CHEMCADTutorials
CC-STEADY STATE Tutorial

Thistutorialcreatesabasicsteadystatesimulationforacondensatestabilizerplant.
Inthisplant,gasentersthesystemwiththefeedconditionsshowninthefollowing
diagram:
Figure 11-01: Condenser stabilizer problem diagram
Yourjobistodeterminenewoperatingconditionsforthisexistingplant,along
withanynecessarymodifications.Thedesignrequirementsareasfollows:
Thecricondenthermdewpointoftheproductgasmustbe20Forless.A
cricondenthermdewpointisthehighesttemperaturefortwophase
coexistenceofamixture.Aslongasthestreamtemperaturestaysabovethe
cricondenthermdewpoint,thestreamcontentswillnotcondense.
Thestabilizedcondensatemusthavemaximumpropanecontentof1%.
Overview
RunningaflowsheetsimulationinCHEMCADisessentiallyaninestepprocedure:
1. Startanewsimulation.
3. Createaflowsheet.
4. Selectcomponents.
5. Selectthermodynamicsoptions.
6. Definethefeedstreams.
7. EnterUnitOpparameters.
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CHEMCADTutorials
9. Reviewtheresultsandprintasneeded.
Thestepsdonothavetobeperformedinthisorder,nordoallofthemhavetobe
doneforeachflowsheet,butyoushouldconsiderallstepsforeachproblem.
Starting a New Simulation

Startbycreatinganewsimulationandgivingitaname.
Todothis,launchCHEMCADandthenSelectFile>SavetoopentheSaveAs
dialogbox.Navigatetothedirectorywhereyouwanttostorethesimulation(tryMy
Simulations,locatedunderMyDocuments)andgiveyoursimulationaname,
leavingthetypeasCHEMCAD6(*.cc6).ThenclickSavetocreatethefileandreturn
tothemainCHEMCADwindow.
Note:Insteadofsavingallchangesinstantly,CHEMCADnowsavesyoursimulation
onlywhenyouusetheSavecommand.Thisprovidesyouwithgreaterflexibility
andgivesyoumorecontroloveryoursimulations,butitalsomeansthatyoushould
saveyourworkfrequently.Thisisasoundpracticeforworkinginanysoftware
application,asitcanhelpyouavoidlosingworkintheeventofapowerproblemor
computerglitch.

SelectFormat>EngineeringUnitstoopentheEngineeringUnitSelectiondialog
box.
TheEnglishunitsoptionisthedefaultandiscurrentlyhighlighted.Tochangethe
engineeringunitssystem,youwouldclicktheAltSI,SI,orMetricbutton;youcould
thenchangeanyoftheindividualunitsaswell.Forthistutorial,youwilluseEnglish
units,soclickCanceltoexitthisdialogboxwithoutmakingchanges.

AsdescribedinChapter5,creatingaflowsheetisamatterofplacingUnitOpicons
onthescreen,connectingthemwithstreams,andthenaddingvariousgraphical
objectstoenhancethedrawing.
Placing UnitOps
1. Startyourflowsheetbyaddinganicontorepresenttheinitialfeedstream.In
theAllUnitOpspalette,findtheFeedicon,whichisanarrowpointingtothe
right.ClicktheFeedicon,thenclickintheworkspacewhereyouwantto
placethefeedstream.Whenthefeedstreamarrowappears,goaheadand
turnofftheFeeddrawingtoolbyrightclickinganyblankareaofthe
workspace.
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CHEMCADTutorials
Note:AtanytimeafterdrawingafeedstreamoranyUnitOpicon,youcanclickthe
icontodisplaytheblacksizinghandlesateachcorner.Withtheiconselectedthis
way,youcanclicktheiconanddragittoanewlocation,orclickanysizinghandle
anddragitoutwardorinwardtoresizetheicon.
2. Nowplacethetwoheatexchangersontheflowsheet.OntheAllUnitOps
palette,pointtotheHeatExchangericonuntilitspopuplabelappears(see
Figure1102).
Figure 11-02: The pop-up label that identifies the UnitOp icon
3. ClickthelowerrightcorneroftheHeatExchangericon,ontheblacktriangle,
toopenthesubpalette.Selectthetwosidedheatexchangericonasshownin
Figure1103.Theiconthatyouclickedinthesubpalettenowappearsonthe
mainAllUnitOpspalettetorepresenttheHeatExchangerUnitOp.
Figure 11-03: Selecting the two-sided heat exchanger icon
4. Pointthemousecursoraboutaninchtotherightofthefeediconandclick.A
twosidedheatexchangericonappearsontheflowsheetwhereyouclicked.
Note:TheUnitOpIDlabelof1shouldappearinacirclenexttotheheatexchanger
icon.ForeachsubsequentUnitOpthatyoudraw,CHEMCADwillassignanordinal
numberinthisway,touniquelyidentifyeachpieceofequipmentontheflowsheet.
5. ReturntotheAllUnitOpspalette,andagainclicktheHeatExchangericons
blacktriangle.Toswitchfromthetwosidedmodeltoasinglesidedmodel,
youllneedtoselecttheappropriateicon(seeFigure1104)fromtheHeat
Exchangersubpalette.
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CHEMCADTutorials
Figure 11-04: Switching to the single-sided heat exchanger icon
6. Againmovethecursortotheworkspace,thistimeaboutaninchtotheright
ofthefirstheatexchanger,andclickthemouse.Asinglesidedheat
exchangericonappearsontheflowsheetwhereyouclicked.Yourflowsheet
sofarshouldlooksomethinglikeFigure1105.
Figure 11-05: The flowsheet so far
7. AddtheFlashandValveUnitOpiconstoyourflowsheet,usingthestandard
icons.
8. Forthecondensatestabilizer,useadistillationcolumn.Multipledistillation
UnitOpsareavailable,butfornow,assumethatthemoduleyouwanttouse
istherigorousdistillationmodelcalledTower.YoullneedaTowericonwith
traysandareboilerbutnocondenser;thisisdifferentfromthedefaultTower
UnitOpicon.ClickthelowerrightcorneroftheTowericonsboxtoviewthe
subpalette,thenselecttheiconshowninFigure1106.
Figure 11-06: Selecting the appropriate Tower UnitOp icon
9. NowthatyouhaveselectedtheappropriateTowericon,addthisUnitOpto
theflowsheet.
10. PlacethreeProducticonsontheflowsheet,oneforeachproductstream.You
canquicklyplacethreeidenticalicons,simplybyclickingrepeatedlyina
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CHEMCADTutorials
slightlydifferentlocation.WhenyouveclickedtocreatethethirdProduct
icon,rightclicktoturnofftheProductdrawingtool.
Drawing Streams
NowthatalloftheUnitOpsareinplace,selecttheStreamtoolandconnectthe
variousUnitOpsasappropriate.Rememberthateachstreammuststartatared
outletpointontheupstreamUnitOp,andendatablueinletpointonthe
downstreamUnitOp.
ToavoidhavingtoreselecttheStreamtooleachtime,makesurethatassoonas
youclicktocompleteonestream,youmovethecursortothenextlocationandclick
tostartthenextstream.
Drawstreamstoconnectthefollowing:
Feedstreamtofirstheatexchangersleftsideinlet
Firstheatexchangersrightsideoutlettosecondheatexchangersleftside
inlet
Secondheatexchangersrightsideoutlettoflashinletofyourchoice
Flashtopoutlettofirstheatexchangerstopinlet
Firstheatexchangersbottomoutlettonearestproducticon
Flashbottomoutlettovalveinlet
Valveoutlettotowerinletofyourchoice
Towertopoutlettonearestproducticon
Towerbottomreboileroutlettonearestproducticon
Asyoudrawstreams,CHEMCADassignsstreamIDs,justasitassignedUnitOp
IDswhenyoucreatedthoseitems.ThelabelsforstreamIDsaredisplayedin
squares,todistinguishthemfromtheUnitOpIDsdisplayedincircles.
Selecting Components
Nowyouneedtoidentifythecomponentstobeusedinthissimulation.Startby
selectingThermophysical>SelectComponents.ThisbringsuptheSelect
Componentsdialogbox,showninFigure1107.
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CHEMCADTutorials
Figure 11-07: The Select Components dialog box
Forthisexample,youllchoosecomponentsfromthestandardCHEMCAD
database.IntheSelectComponentsdialogbox,findandaddeachneeded
component,beginningwithnitrogen:
1. IntheSearchbox,starttypingthewordnitrogen.
2. Assoonasyouvetypedni,youshouldsee46NitrogenN2highlightedin
theAvailableComponentsarea.Clicktherightarrowbuttontoaddnitrogento
yoursimulation.
3. UsethescrollbarintheAvailableComponentsareatoreturntothetopofthe
componentlist.
4. Holddownthe[CTRL]keyonyourkeyboardasyouclickeachofthe
followingcomponentsinturn:
Methane
Ethane
Propane
IButane
NButane
5. Clicktherightarrowbutton,locatedtotherightoftheAvailableComponents
area,toaddalloftheselectedcomponentstoyoursimulation.
6. Nowaddthefollowingcomponentsbydoubleclickingeachoneinturn:
IPentane
NPentane
10
NHexane
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CHEMCADTutorials
Figure 11-08: The completed Select Components dialog box
7. SaveyourcomponentselectionsbyclickingOK.
Selecting Thermodynamic Options

Assoonasyouhavefinishedcomponentselection,theThermodynamicsWizard
appears.Thistoolcansuggestthermodynamicsoptionstousewiththissimulation.
CHEMCADsThermodynamicsWizardworkslikethis:
1. First,itlooksatthecomponentlistanddecideswhatgeneraltypeofmodelis
required,i.e.,equationofstate,activitymodel,etc.
2. Second,itlooksattemperatureandpressurerangesthatyouprovideand
decideswhichequationwithinagivencategoryisbestatthelimitsofthose
ranges.
3. Ifthemethodisanactivitymodel,theprogramthenlooksattheBIP
databasetoseewhichmodelhasthemostdatasetsforthecurrentproblem.
ItthencalculatesthefractionalcompletenessoftheBIPmatrix.Ifthatfraction
isgreaterthantheBIPthresholdparameter,itusesthechosenactivity
method;ifnot,itusesUNIFAC.
TheThermodynamicsWizardisnoreplacementforengineeringjudgment.Thistool
usesanalgorithmbasedongeneralrules,andisthereforefallible.Thesuggested
modelmightnotalwaysbethebestmodelforthesystem.
Selectingthermodynamicoptionsbasicallymeansselectingamodelormethod
forcalculatingvaporliquid(orvaporliquidliquid)phaseequilibrium(calledtheK
valuemodel)andselectingamethodormodelforcalculatingtheheatbalance(called
theenthalpymodel).Thecommandsfortheseselectionsarelocatedonthe
Thermophysicalmenu.
CHEMCADhasalibraryofdozensofKvaluemodelswithavarietyofoptions
andabout12enthalpymodels.Makingtheproperselectionfromtheselibrariescan
sometimesbedifficult.Forthepurposesofthistutorial,assumethatyouwanttouse
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CHEMCADTutorials
thePengRobinsonmethodforboththeKvalueandenthalpycalculations.Follow
thesestepstoselectyourthermophysicaloptions:
1. AcceptthedefaulttemperatureandpressurerangesintheThermodynamics
WizardandclickOK.
2. ClickOKagaintoacceptthewizardssuggestedmethodofSRK.
3. WhentheThermodynamicSettingsdialogboxopens,findtheGlobalK
ValueModelselection,intheupperleftcorneroftheKValueModelstab.
ThecurrentsettingisSRK,butforthepurposesofthetutorial,youllneedto
selectthePengRobinsonmodel.Clickthedownarrowattherightendofthe
selectionboxtoviewalonglistofKvaluechoices,thenclickPeng
Robinson.
Figure 11-09: The new K-value selection in the Thermodynamic Settings dialog box
4. NowclicktheEnthalpyModelstab.ThePengRobinsonmethodhasalready
beenenteredastheGlobalEnthalpyModelselection;thiswasdone
automaticallybecauseyouchosePengRobinsonasyourKvaluemethod.
Whileyoudohavetheoptiontooverridethischoice,inthiscaseyoullneed
tokeepthePengRobinsonmodel;leaveallsettingsastheyareandclickOK
toreturntothemainCHEMCADworkspace.
Forthepurposeofthistutorial,thethermodynamicselectionsarenowcomplete.
Note:WhileyouarenotrequiredtousetheThermodynamicsWizard,youshould
knowhowtouseit,ifonlyasastartingpointforyoursimulations.Youcanrevisit
thewizardatanytimebyselectingThermophysical>ThermodynamicsWizard.
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CHEMCADTutorials
Defining the Feed Streams

Nowitstimetodefineyoursimulationsfeedstream.Thereareseveralwaysthat
youcandothis,butthequickestandmostefficientwaytodefineasinglestreamis
todoubleclickthestreamline.
Note:Beforeyouproceed,verifythatyourengineeringunitsaresettoEnglishinthe
EngineeringUnitSelectiondialogbox,asdescribedearlierinthistutorial.
Doubleclickthelineforstream1,yourfeedstream,tobringuptheEditStreams
dialogbox.
Figure 11-10: The Edit Streams dialog box
Youwillspecifythefeedstreamaccordingtothefollowingrules:
TheStreamNamefieldcandisplayastreamlabelofupto16alphanumeric
characters.Thisfieldisoptional,andyoucanuseanylabelyoulike.
ThenextfourfieldsTempF,Prespsia,VaporFraction,andEnthalpy
MMBtu/harethethermodynamicpropertiesofthestream.Accordingtothe
GibbsPhaseRule,onceamixturescompositionisgiven,specifyinganytwo
ofthesefourthermodynamicpropertieswilldefinetheothertwo.Assuch,
definingthecomposition,temperature,andpressureforamixtureuniquely
definesitsvaporfractionandenthalpy.Alternatively,definingthe
composition,pressure,andenthalpywilluniquelydefinethemixtures
temperatureandvaporfraction.
Sinceenthalpiesarecalculatedrelativetoadatum,thecalculationofany
givenstreamenthalpyisaninvolvedprocesswhichispronetoerrors.For
thisreason,CHEMCADdoesnotpermityoutoenterstreamenthalpyasa
constraint.
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CHEMCADTutorials
Inadditiontodefiningthestreamscomposition,youmustdefineexactly
twoofthefollowingproperties:temperature,pressure,andvaporfraction.
Thetwovariablesthatyouspecifywilldisplayasredtext,whilethethird
variableandthevalueenthalpywillbedisplayedinblackwhenyouflashthe
stream.
Anexceptiontothisconventionallowsyoutoaddheatdutywithanempty
stream.Ifyouspecifyatotalcomponentflowrateofzero,youmayspecifya
temperature,pressure,andenthalpyrate.Astreamdefinedthiswayis
treatedasaheatduty,andisaddedtotheheatbalanceoftheunit.The
temperatureandpressurearearbitraryforthissituation.
TheTotalflowunitandCompunitfieldsworktogethertoprovideavariety
ofwaystodefinestreamcompositions.Iftheselectedcompunitismole,
mass,orvolumefraction(eithergloballyorlocally),thentheTotalflowunit
selectionisavailable.Iftheselectedcompunitisafloworamountoption,
thenthetotalflowratebecomesthesumofthecomponentflowrates,and
theTotalflowunitselectionisnotavailable.
IftheCompunitfieldselectionisanamountflowunit(asopposedtoa
fractionalunit),thenthecomponentflowratevaluesareautomaticallyadded
asyouenterthem.ThecurrentsumisdisplayedintheTotalflowfield.
YoucanclicktheFlashbuttonatanytimetoperformaflashcalculation
usingthecurrentlyspecifiedcompositionandthermodynamicproperties.
Thisenablesyoutoobtainflashcalculationsquicklyandwithoutleavingthe
dialogbox.
Fractionsthatdonotaddupto1.0areautomaticallynormalizedwhenyou
eitherclickFlashorexitthedialogbox.
Withtheserulesandbehaviorsinmind,enterthedataforyourfeedstream.
1. Beginwiththestreamtemperature.ClicktheTempFlabel,thenclickthe
emptyfieldtoitsright.Type75andthenpressthedownarrowkeyonyour
keyboardtocontinue.
2. Type200inthePrespsiafield,thenpressthedownarrowkeyseveraltimes
untilyouarriveattheNitrogenfield.
Note:Beforeyoucontinue,verifythattheCompunitfieldissettolbmol/h.
3. Type100.19intheNitrogenfield,andtheninsimilarfashion,typethe
followingnumbersinthecorrespondingfields:
Methane:4505.48
Ethane:514
Propane:214
IButane:19.2
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CHEMCADTutorials
NButane:18.18
IPentane:26.4
NPentane:14
NHexane:14
4. ClickOKtosavethisstreaminformationandreturntothemainCHEMCAD
workspace.
Enter UnitOp Parameters

Nowthatyouvespecifiedyourfeedstreamproperties,itstimetospecifythe
characteristicsofyourUnitOps.ThefollowingsectionsaddresseachUnitOpinturn.
Note:Aswithstreams,youcanenterUnitOpparametersinvariousways,butforthe
purposesofthistutorial,wellusethequickestandsimplestmethod,doubleclicking
eachUnitOptoaccessitsspecificationdialogbox.
First Heat Exchanger

1. Doubleclicktheflowsheeticonforthefirstheatexchanger.TheHeat
Exchangerdialogboxwillappear,asshowninFigure1111.
Figure 11-11: The Heat Exchanger dialog box
2. AswithmanytypesofUnitOps,thedialogboxforspecifyingaheat
exchangerconsistsofmultipletabbedpages.Youcanbrowsethroughthe
Specifications,Misc.Settings,andCostEstimationstabsbyclickingeach
tabinturn.
3. Thepressuredroponbothsidesofthisexchangeris5psi.Onthe
Specificationstab,findthePressureDropsarea,andenter5inboththeStream
1andStream4fields.
4. Thefirststreamoutletmustbeatitsdewpoint,soyoullneedtospecifyan
outletvaporpressureof1.InthefieldnexttoVaporfractionstream2,enter1.
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CHEMCADTutorials
5. ClickOKtosavethespecificationsforthisUnitOpandclosethedialogbox.
Second Heat Exchanger

1. Doubleclicktheflowsheeticonforthesecondheatexchanger.TheSimple
HeatExchangerdialogboxwillappear.
2. Theoutlettemperaturefromthisheatexchangerwilldeterminehowmuchof
theliquidisremovedintheflashdrum.This,inturn,willdeterminethe
cricondenthermdewpointoftheproductgas.Therefore,thisspecificationis
oneofthekeyparametersofthisprocess.Asafirstattempt,useanoutlet
temperatureof5F.Enter5inthePressuredropfieldand5inthe
Temperatureofstream3field.
Figure 11-12: Setting up the second heat exchanger
Flash Drum
Inthissimulation,theflashdrumisavaporliquidseparatorandrequiresno
specification.
Valve
1. DoubleclickthevalveflowsheeticontobringuptheValvedialogbox.
2. Theoutletpressureforthisunitis125psia,soenter125intheOutletpressure
field.
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CHEMCADTutorials
Stabilizer Tower
1. DoubleclickthetowericontoopentheTOWRDistillationColumndialog
box.NotethatthesettingsforthisUnitOparedividedintofivetabs.
2.
OntheGeneraltab,enterthefollowing:
Colmpressdrop:5
No.ofstages:12
Feedtrayforstream:1
3. ClicktheSpecificationstabtomakespecificationsforthecolumn.This
columnhasnocondenserorsidestreams,soyouwillonlybemaking
specificationsforthereboiler.DropdownthelistofoptionsforSelectreboiler
mode,andselectthemodecalled4Bottommoleflowrate.
4. Nowyouneedtospecifythenumericvalueofthereboilerflowrate.Inthe
Specificationfieldimmediatelytotherightofyourreboilermodeselection,
enteravalueof30.
5.
ClickOKtosavethespecificationsforthisUnitOpandreturntothemain
CHEMCADworkspace.
Allofthedataentryfortheflowsheetisnowcomplete.Beforeyoucontinue,you
shouldsaveyoursimulation.Asnotedearlier,itsagoodideatodothisperiodically
asyoubuildthesimulation,butcompletionofyourUnitOpspecificationsisa
particularlygoodtimetostopandsave.
Run the Simulation

Torunthesimulation,clicktheRunAllbuttononthetoolbar.
Theprogramfirstrechecksthedataandlistsanyerrorsandwarningsinthe
Messagespane.Inthiscase,youshouldhavenoerrors,althoughyouwillhave
warningsaboutestimatesyouhavenotgiven.Youcanignorethesewarningsand
proceedbyclickingYes.Thecalculationwillthenproceed.
Whentherunfinishes,amessageboxappears:Recyclecalculationhasconverged.
Toclosethisdialogboxandclearthescreen,clickOK.
Review the Results and Print as Needed

Beforerunningandprintingreportsandplots,youshouldreviewthesimulationto
verifywhetheritmeetsthedesigncriteriasetoutforthisproblem.
Checking the Cricondentherm Dewpoint

Ifyouhavechosentheproperoutlettemperatureforthesecondheatexchanger,the
cricondenthermdewpointfortheproductgasstream(stream5)willbe20Forless.
Thecricondenthermdewpoint,youwillrecall,isthehighestdewpointtemperaturea
mixturewilleverseeatanypressure.Thesimplestwaytoidentifythehighest
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dewpointtemperatureoftheproductgasistoplotallofthedewpointtemperatures
oftheproductgas,i.e.,toplotaphaseenvelope.
1. StartwiththePlotmenu,whichprovidesaccesstoalltypesofgraphical
reports.SelectPlot>PhaseEnvelopes.IntheSelectStreamsdialogbox,
specifystream5,thenclickOKtobringupthePhaseEnvelopedialogbox.
2. Noentriesarerequiredonthisscreensinceyouonlyneedtolookatthe
dewpointline,buttomaketheplotmoreinteresting,displaythe0.25andthe
0.5vaporfractionlinesinadditiontothenormalphaseenvelopeboundaries.
CompletethedialogboxasshowninFigure1113.
Figure 11-13: Plotting vapor fraction lines along with the cricondentherm dewpoint
3. ClickOKtocontinue.CHEMCADperformtherequiredflashcalculationsto
generatethespecifiedphaseenvelope.Phaseenveloperesultsareproduced
intwoformats:
Anumericaltabulation(table)ofthetemperature,pressure,vapor
fraction,vaporcompressibilityfactor,andtheliquidcompressibility
factor
Agraphicalplotoftemperatureandpressureforeachvaporfractionline
requested
Thetabularresultswillappearfirst;sinceyoureinterestedinthegraphical
results,closethewindowdisplayingthetable.Thescreenwillnowlook
similartoFigure1114.NotethatthemainCHEMCADbuttontoolbaris
largelyunavailablenow,andthemenuitemshavechanged.
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Figure 11-14: Phase envelope plot results
4. Todeterminewhetherthecricondenthermdewpointofstream5is20For
less,zoominonthefarrightportionofthedewpointcurve.Todothis,click
anddragwithyourmousetohighlightthatportionofthegraph
approximately400to1000psiand0to30F.Whenyoureleasethemouse
button,theselectedareawillfilltheentireplotwindow,givingyouaclose
upviewofspecificdatapoints.
Figure 11-15: Zoomed-in plot results
5. Asthisviewshows,thehighestdewpointofthismixtureisalittlelessthan
20F,sothecricondenthermdewpointisindeedwithinthetargetproduct
gasspecification.Rightclickthemouseanywhereintheplotwindowto
returntothefullplotview.
6. Toprintthephaseenvelopeplot,clickthePrintbuttonandthenfollowany
promptsfromyourprinter.
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7. YoucanalsotrythefollowingtopracticeworkingwithplotsinCHEMCAD:
Editthetextoftheplottitle(inthiscase,PhaseEnvelopeforStream5)orthe
graphaxislabelsbyselectingChart>EditTitles.IntheChartTitles
dialogbox,makeanydesiredchangesandthenclickOKtoviewthe
updatedchart.
SelectChart>EdittoopentheChartExplorer,whichprovidesaccessto
settingsforcolor,size,layout,andvariousotheraspectsoftheplot
presentation.
8. Returntothemainsimulationwindowbyclickingthecharttabsredx
button,orleavethechartwindowopenandclickthemainsimulationtabat
thebottomleftoftheCHEMCADworkspace.
Checking the Bottoms Stream Purity

Thisproblemalsorequiresthatthepercentofpropaneinstream9be1%.Youcan
checktoseeifyouveachievedthisspecificationbycheckingthestreamcomposition
reportavailableontheReportmenu.First,though,youllneedtosettheflowunits
forthestreamcomposition.
1. SelectReport>SetFlowUnitstobringuptheViewFlowRateUnitdialog
box.ClicktheMole%buttonandthenclickOKtoapplythisselectionand
closethedialogbox.
2. NowselectReport>StreamCompositions>SelectStreams.IntheSelect
Streamsdialogbox,type9andthenclickOKtocontinue.
3. Theresultingtabulardatawindowshowsthatpropaneisgreaterthanthe1%
specification(seeFigure1116).Thismeansthattheinitialdesignistoo
conservative.Tocorrectthis,youcangobackandrespecifythecolumnto
produceprecisely1%propaneinthebottom.
Figure 11-16: Stream Composition report for stream 9
4. Returntothemainsimulationwindowbyclickingthereporttabsredx
button.
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Re-running the Simulation

Youcannowrerunthestabilizer,specifyingthatyouwant1%propaneinthe
bottom.
1. DoubleclicktheTowerUnitOptobringuptheTOWRDistillationColumn
dialogboxforthestabilizer.
2. ClicktheSpecificationstab.Youneedtochangethereboilermodefrom4
Bottommoleflowratetoapurityspecification.ClicktheSelectreboilersmode
dropdownlistandselect6Bottomcomponentmolefraction.
3. Withthischangeofmode,youneedtospecifythedesiredpurityandthe
componentforwhichitisbeingspecified.IntheSpecificationfield,enter.01.
IntheComponentdropdownlist,select4Propane.
4. ClickOKtosaveyourchangesandreturntothemainCHEMCAD
workspace.
5. Youcannowrerunthecalculationsforthecondensatestabilizer.Whileyou
couldaccomplishthisusingtheRunAllcommand,itsmoreefficienttore
runonlytheUnitOpthatyouhavechanged.Thequickestwaytodothisisto
rightclicktheUnitOpiconontheflowsheetandselectRunthisUnitOp.Run
theTowerUnitOpusingthismethod.
AssoonasyouseetheRunfinishedmessageinthebottomleftcornerofthe
CHEMCADwindow,youcancheckonthepropanecontentofthebottomstream.
YouvealreadyseenhowtogetadetailedStreamCompositionreport;youcanalso
usetheFlowsheetQuickviewfeaturetogetinstantstreaminformationwithouteven
clickingthemouse.
FindtheFlowsheetQuickviewbuttonatthefarrightendoftheCHEMCAD
toolbar.Ifthisbuttonisnotcurrentlyactivated(withathinoutlineandawhite
buttonbackground),clickthebuttontoturnonthisfeature.
Figure 11-17: Turning on the Flowsheet Quickview feature
WithFlowsheetQuickviewturnedon,pointyourmousecursoratstream9on
theflowsheet.Afteramoment,apopupinformationwindowappears,listing
streampropertiesincludingcomposition.Thevalueforpropaneshouldbe1orvery
closeto1,asshowninFigure1118.
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Figure 11-18: Checking the propane content of stream 9
Nowthatyouhaveachievedtheresultsthatyousetouttoproduce,savethe
simulation,usingeitherFile>SaveortheSavebuttononthetoolbar.
Producing a Text Report

TheReportmenuoffersabroadarrayoftextreports,asdescribedinChapter8,
OutputandReports.Forthepurposeofthistutorial,assumethatyouwanttoview
andprintoutareportwiththefollowinginformation:
ForStreams1,5,8,and9,thestreamcompositioninmassflowratesand
molefractions,aswellasthedefaultstreamproperties
Theequipmentsummariesforeverypieceofequipmentintheflowsheet
Towertrayprofilesforthecondensatestabilizer
Becauseyouwantareportwithabroadrangeofinformationaboutyour
simulation,usetheConsolidatedReportoption.
1. SelectReport>ConsolidatedReporttobringuptheReportWriterdialog
box.Fromhere,youcanspecifyexactlywhatyouwanttoincludeinyour
report.
2. Startbyspecifyingwhichstreamsyouwanttoinclude.ClicktheSelect
Streams&UnitOpstabandchecktheSelectStreams(OverrideDefaults)
box.Thisprovidesaccesstotheotherstreamselectionsettings.
3. ClicktheSelectFromFlowsheetbutton,whichbringsuptheSelectStreams
dialogbox.Eithertypeinthenumbers1,5,8,and9orclickthe
correspondingstreamsontheflowsheettoaddthenumbers.ClickOKto
returntotheSelectStreams&UnitOpstab.
4. TheAllUnitOpsoptionisselectedbydefault.Inthiscase,youdowantto
includeallUnitOpsinthereport,soleavethesettingsontherightsideofthe
tabastheyare.
5. ClickStreamPropertiesintheleftcolumntoviewthestreamproperties
options.ThenclickthePropertiestab,whichlistsacollapsedlistofall
availablestreamproperties.YoucanchecktheStreamProperties(Override
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Defaults)boxtoexplorethevariouspropertiesandseewhichonesare
selected,butforthepurposeofthistutorial,usethedefaultsettingsonthis
tab.
6. ClickStreamCompositionintheleftcolumntoviewthestreamcomposition
options.ThenclicktheStreamCompositionstab,whichlistsavailableand
selectedflowoptions.ClicktheStreamComposition(OverrideDefaults)
boxtogainaccesstotheseoptions.KeeptheMassFlowRateoption,and
doubleclickMoleFractionsintheleftcolumntoaddthisoptiontothelistof
selectedflowoptionsatright.
7. Finally,verifythattheTrayprofilereportsectionisincludedinthe
ConsolidatedReport.Youcanalsodeleteanyreportsectionsthatyoudont
need,andreorderthedesiredsectionstosuityourneeds.
8. ClickGeneratetorunanddisplaythereport.Youcannowreviewthe
results,rerunifdesired,savethereportforlateruse,andprintthereportas
needed.
9. Whenyoufinishreviewingandworkingwiththereport,clickCancelto
closetheReportWriterdialogboxandreturntothemainCHEMCAD
workspace.
Generating a Process Flow Diagram

Asyouknow,thestreamsandUnitOpsonaflowsheetonlytellpartofthestoryof
yourprocess.Fortunately,CHEMCADprovidesmanyfeaturestohelpyouaddthe
extracontentneededtoturnaplainflowsheetintoafullfledgedprocessflow
diagram(PFD)forotherstoreviewanduse.
ToprepareyourfinishedsimulationtobeprintedasaPFD,youlladdastream
databoxcontainingtheheatandmaterialbalancefortheentireflowsheet.Youll
placethatdataboxunderneaththeflowsheetdiagramandthenaddatitletothearea
abovetheflowsheet.Finally,youwillcreateanewlayerinthissimulationand
assignthePFDspecificitemstothatlayer,sothatyoucanhidethemfromview
whenworkinganddisplaythemagainquicklyforprinting.
FollowthesestepstoprepareandprintthePFD:
1. Startbyzoomingouttogiveyourselfmoreworkspace.Ifyouuseamouse
thatisequippedwithascrollwheelbetweenthemousebuttons,youcan
pointatthecenterofyourflowsheetandrollthescrollwheeldownafew
clickstozoomout.Ifyoudonthaveascrollwheel,youcanselectView>
ZoomOptions>Out.
2. Nowplacethedataboxcontainingtheheatandmaterialbalanceforthis
flowsheet.SelectFormat>AddStreamBoxtobringuptheSelectStreams
dialogbox.Becauseyouwanttoincludeallstreams,leavethesettingsthe
waytheyareandclickOKtocontinue.
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3. IntheDataboxPropertyOptionsdialogbox,reviewthedefaultselections,
indicatedbycheckedboxes.Forthepurposesofthistutorial,leavethe
selectionsastheyareandclickOKtocontinue.
4. IntheDataboxSettingsdialogbox,youcanindicatewhethertousedividing
lineswithinthebox.AcceptthedefaultsettingshereandclickOK.
5. ThestreamdataboxappearsintheupperleftcorneroftheCHEMCAD
workspace,butyouwanttoplaceitbelowtheflowsheet.Thedataboxis
alreadyselected,sopointyourmousecursoranywhereinsidetheboxand
thenclickanddragtorepositionit.Movethedataboxuntilitiscentered
belowtheflowsheetdiagram.
Note:Youcanalsoresizeadataboxbyselectingtheboxandthenclickingand
dragginganyofthesizinghandlesatthecorners.Dragintomakethedatabox
smaller,orouttomakeitlarger;noticethatthetextadjustsinsizetofitthebox.
6. NowplaceatitleonthePFDtodescribetheprocess.IntheAllUnitOpsor
DrawingSymbolspalette,findandselecttheTexttool.
7. Movethecursortoapointsomewhereabovetheflowsheetandclickthe
primarymousebutton.Averticalinsertionpointlinebeginstoblinkwhere
youhaveclicked.TypethewordsCondensateStabilizerPFDandthenclick
anyblankspotontheCHEMCADworkspace.
8. Tomakethistextlarger,selectFormat>Font.IntheFontdialogbox,change
theSizesettingto18andthenclickOK.
9. Clickanddragthenewheadingtocenteritabovetheflowsheetdiagram.
10. Finally,setupalayerforyourstreamdataboxandtitlesothatyoucan
displayorhidetheseitemsasasingleunit.AtthebottomoftheCHEMCAD
Explorerpane,clicktheSimulationtab,thenrightclicktheLayersitemand
selectNew.
Figure 11-19: Creating a new layer using the CHEMCAD Explorer
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CHEMCADTutorials
11. IntheNewLayerdialogbox,typeanameforthenewlayer.Forthis
example,namethelayerPFDElements,thenclickOKtocreatethelayer.
12. NowaddthetwoPFDelementstothelayer.Clickthetitlethatyouplaced
abovetheflowsheet,thenholddownthe[SHIFT]keyandclickinsidethe
streamdataboxthatyouplacedbelowtheflowsheet.Bothitemsshouldnow
beselected,withsmallblackboxesvisibleineachcorner.
13. IntheCHEMCADExplorerpane,doubleclicktheLayersitemtoexpandit,
thenrightclickonyournewlycreatedPFDElementslayerandclickAdd
Selected.
Figure 11-20: Adding selected items to your new layer
14. ThetitleandstreamdataboxarenowpartofthePFDElementslayer.This
layerisvisible,asindicatedbythegreencheckmarkonitsicon.Clickthis
iconorthenamePFDElementstotogglethelayeroff,causingthetitleand
streamdataboxtodisappear;thenclickagaintomakethemvisible.
15. WiththePFDelementsvisible,selectView>ZoomOptions>ZoomtoFit.
ThiscustomfitstheentirePFDtotheavailableworkspaceforoptimal
printing.Toprint,youcaneitherselectFile>PrintorclickthePrintbutton
onthemainCHEMCADtoolbar.Followthepromptsforyourprinterto
completetheprintingprocess.
16. TocloseCHEMCAD,selectFile>Close,orclicktheClosebuttoninthe
upperrightcorneroftheCHEMCADwindow.ClickYesatthemessage
askingwhetheryouwanttoexitCHEMCAD,thenclickYesagaintosave
changestothesimulation.
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CC-THERM Tutorial
Thistutorialwalksyouthroughtheratingofaheatexchanger.Theexampleyoull
workwithisthecondensatestabilizerexampledescribedintheCCSTEADYSTATE
tutorial,whichlookslikethis:
WhileitsrecommendedthatanewCHEMCADuserbuildthissimulationfrom
thegrounduptogainproficiencywiththesoftware,areadymadeexamplecalled
CHEMCADTutorial.CC6isalsoavailable.Thisfileislocatedbydefaultinthe
directorycalledMyDocuments\MySimulations\Examples\Tutorials.
Yourobjectiveistoratethefirstheatexchangerinthisflowsheet.Theequipment
youreworkingwithisacountercurrentgas/gasheatexchangerwiththefollowing
geometryanddimensions:
TEMAclass=R
TEMAtype=BEM
Foulingfactors=0.001bothsides
Shellinsidediameter=27
Numberoftubes=646
Tubeoutsidediameter=0.75
Tubewallthickness=0.065
Tubelength=20
Tubepattern=rotatedtriangular(60)
Tubepitch=0.9375
Baffles:10,equallyspaced
Baffletype=singlesegmental
Bafflecut=35%(diameter)
Impingementplatepresent
Shellsidenozzles=one,12
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Tubesidenozzles=one,12
BaffletoshellI.D.clearance=0.3125(diameter)
ShellI.D.toOTLclearance=0.35433(diameter)
Tubetobaffleholeclearance=0.035(diameter)
Spaceattopofbundle=2.8
Carbonsteeltubes;allothermaterialsA285C
5rowspersealingstrip
Overview of the Heat Exchanger Sizing Process

TheCCTHERMmoduleenablesyoutogenerateheatcurvesandspecifyheat
exchangers.Thisprocessinvolvesthefollowingsteps:
1. Identifythetubesidestream.
2. Generateandfinalizetheheatcurveandpropertiesonbothsidesofthe
exchanger.
3. Definegeneralinformationabouttheexchanger.
4. Specifyanydesiredtubedata.
5. Specifyanydesiredshelldata.
6. Specifyanydesiredbaffledata.
7. Specifyanydesirednozzledata.
8. Specifyanydesiredspecificclearances.
9. Specifythematerialsusedintheconstructionoftheheatexchanger.
10. Specifyanydesiredmiscellaneousdata.
11. Runthesizingcalculations.
12. Reviewresultsandcreateplotsasneeded.
Identify the Tube-side Stream

OncethesimulationiscompleteinCCSTEADYSTATE,youcanstartsizingthefirst
heatexchangerbyidentifyingthetubesidestream:
1. ClickonthefirstheatexchangericonandthenselectSizing>Heat
Exchangers>Shell&Tube.
2. Amessageboxpromptsyoutoselectastreamenteringtheexchangerstube
side.ClickOKtocontinue.
3. AttheSelectStreamsdialogbox,eithertype1orclickstream1onthe
flowsheet,thenclickOK.
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4. CCTHERMdisplaysdataforallfourstreamsaroundtheexchangerina
separatereportwindow.Revieworprintthedataasneededandthenclose
thereportwindow.
Generate the Heat Curve

Oncethetubesidestreamisidentified,CCTHERMpromptsyouthroughthesetup
oftheheatcurve.TheHeatCurveParametersdialogboxdisplaysassoonasyou
closethereportfromthepreviousstep.
Figure 11-21: The Heat Curve Parameters dialog box
Toaccountforthechangeinphysicalpropertiesacrosstheheatexchanger,CC
THERMdividestheanalysisintozones.Thesezonesarethermodynamicsegments
basedonequaltemperaturechangesorequalenthalpyincrements.Therearetwo
optionstochoosefrom:
Equalenthalpy:Incrementsofequalenthalpychange
Bubbledewpoint:Incrementsofequalenthalpychangebetweenthedew
andbubblepoints,withseparatezonesforsuperheatingandsubcoolingif
present
Thedefaultsettingisthebubbledewpointoption.Foreithersegmentation
method,youcanalsodecidehowmanyzonestocalculatefortheexchanger.The
morezonesyouspecify,themoreaccuratethecalculationswillbe,butcalculations
willalsobeslower.Theindustrystandardis10zones(11points),whichisthe
defaultentryhere,butyoucanselectanynumberbymakinganentryinthe
Numberofcuttingpointsfield.Bearinmindthatthenumberofpointsequalsthe
numberofzonesplusone.
Forthistutorial,leaveallthedefaultsettingsandclickOKtocontinue.CC
THERMcalculatesthe11pointsneededfortheheatcurveanddisplaysaplotlike
theoneshowninFigure1122.
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Figure 11-22: Heat curve plot for first heat exchanger
Thisplotenablesyoutoinspectthecalculatedheatcurveforanyobvious
problemsinthesetupoftheanalysis.ClickOKtoclosethiswindowandcontinue.
Define General Specifications

ThenextdialogboxtoappeariscalledGeneralSpecifications.Here,youcanprovide
basicinformationgoverningheatexchangercalculations,suchasprocesstype,
allowablepressuredrop,foulingfactor,TEMAclassandtype,andsoforth.
Thisdialogboxhastwotabs,andmostofthefieldsonbothtabshavedefault
settings.ThetabthatinitiallydisplaysiscalledGeneralInformation,anditincludes
thefollowingsettings:
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Calculationmode:Thisentrydetermineswhetheryouaredesigningor
ratingaheatexchanger.UsethedefaultsettingofRating.
TEMAclass/standard:ThisentryspecifiestheexchangersTEMAclass,
whichisprimarilyafunctionofitsmechanicaldetails.Usethedefaultsetting
ofTEMAR.
Orientation:Thisentryspecifieswhethertheexchangerismounted
horizontallyorvertically.UsethedefaultsettingofHorizontal.
TEMAfrontendhead,TEMAshelltype,andTEMArearendhead:To
establishthebasicconfigurationoftheexchanger,youmustdefinethese
characteristicsoftheexchangeraccordingtoTEMAdesignations.The
simplestandmostcommonkindofexchangerisafixedtubesheet,orBEM,
TEMAtype.SelectBBonnetforthefronthead,EOnePassfortheshell
type,andMFixedTubesheet(Bhead)fortherearhead.
Processtype:Insomecases,youmustidentifytheprocesstype,forexample
inthecaseofpoolboilingorfallingfilmcondensation.Inthiscase,usethe
CHEMCADTutorials
defaultselectionofSensibleFlowforbothtubesideandshellside,asthere
isnophasechangeoneithersideoftheexchanger.
FoulingfactorToallowforfoulingontheinsideandoutsideofthetube,
youcanenterfoulingfactors.Usethedefaultsettingof0.001(Englishunits)
onbothsides.
OntheModelingMethodstab,youcanselecttheformulastobeusedincertain
aspectsoftheheatexchangercalculations.Forthepurposesofthistutorial,usethe
programsdefaultselections.ClickOKtocontinue.
Set Tube Specifications

TheTubeSpecificationsdialogboxnowappears,populatedwithdefaultentriesin
allfields.
Figure 11-23: The Tube Specifications dialog box
Enter646intheNumberoftubesfieldandclickOKtocontinue.
Set Shell Specifications

ThenextdialogboxtoappeariscalledShellSpecifications.
Figure 11-24: The Shell Specifications dialog box
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Theonlyvaluethatyouneedtospecifyhereistheshelldiameter.CCTHERM
assumesthatthevalueenteredhereistheactualshellinsidediameter.Type2.25(the
equivalentinfeetto27)intheShelldiameterfieldandthenclickOKtocontinue.
Note: TheCHEMCADsuitehasahandybuiltinconversionfeaturethatcanhelp
wheninputfieldsrequireadifferentunitofmeasurethanthedatayouhave.Place
yourcursorinanynumericdataentryfield,andthenpress[F6]tobringupadialog
boxthatoffersconversionunitsrelevanttotheselectedfield.Typethevalueyou
haveintheappropriatefieldandpress[ENTER]toconverttootherunits.Verifythe
resultsoftheconversionandthenclickOK.CHEMCADautomaticallyselectsthe
appropriateunitsforthefieldandentersthatconvertedvalue.
Set Baffle Specifications

TheBaffleSpecificationsdialogboxdisplaysnext.
Figure 11-25: The Baffle Specifications dialog box
Mostofthedefaultentrieshereareappropriateforthisexample;youdo,
however,needtospecifythebafflespacingandbafflecut.
Baffle Spacing
Allthatyouknowforthepurposesofbafflespacingisthatthereare10baffles
equallyspaced.Eraseanydefaultvaluesforspacingandenter10intheNumberof
bafflesfield.CCTHERMwillcalculateequalspacingforthebaffles.
Baffle Cut Percent

Thebafflecutpercentcanbebasedeitherondiameteroronarea.TheBasisofcut
fieldidentifiesthebasisforthespecifiedcut;usethedefaultsettingofDiameter,and
enter35intheBafflecutpercentfield.ClickOKtocontinue.
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Set Nozzle Specifications

TheNozzleSpecificationsdialogboxnowappears.
Figure 11-26: The Nozzle Specifications dialog box
Thedefaultentriesareacceptableforthisexample,soyouonlyneedtoenterthe
insidediameterfortheinletandoutletnozzlesonboththetubeandshellsides.All
ofthesenozzleshave1internaldiameters.
Enter1ineachofthefourfieldsatthetopofthedialogbox,thenclickOKto
continue.
Set Clearance Specifications

YouwillnowseetheClearanceSpecificationsdialogbox.
Figure 11-27: The Clearance Specifications dialog box
CCTHERMalwaysdefaultstoTEMAclearances,sonormallynoentryis
requiredinthisdialogbox.Inthiscase,theclearancesareknown,soyoushould
enterthemintheeventtheydonotconformexactlytoTEMA.Youcanusethe[F6]
featurenotedearlierinthistutorialtoconvertthegivenclearancesfrominchesto
feet.
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Also,becausethereisanimpingementplate,youneedtoenterthespaceatthe
topofthebundle.Type0.233333intheSpaceatTopofBundlefieldandthenclick
OKtocontinue.
Set Material Specifications

ThenextdialogboxtoappeariscalledMaterialSpecifications.
Figure 11-28: The Material Specifications dialog box
Here,youcanspecifythematerialsofconstructionfortheheatexchanger.For
thisexample,usethedefaultentries:carbonsteelforthetubesandA285Cforall
othermaterials.ClickOKtocontinue
Set Miscellaneous Specifications

ThelastdialogboxtoappeariscalledMiscellaneousSpecifications.
Figure 11-29: The Miscellaneous Specifications dialog box
TheonlyfieldthatisimportanttothisexampleisRowsperSealingStrip.The
defaultentryof5iswhattheexamplecallsfor,soleavethedialogboxasitisand
clickOKtocontinue.
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Run Sizing Calculations

Nowthatyouhavespecifiedheatexchangerdatainalloftherequireddialogboxes,
theShellandTubeExchangermenuappears.Notethatthismenuiswhatyouwill
seeifyoureturntoshellandtubesizingforthisexchangeratanytimeafterthis
initialspecification.
Figure 11-30: The Shell and Tube Exchanger menu
ClicktheCalculatebuttononthemenu.Thecalculationwillrunveryfast,
showingruntimemessagesonthestatusbarandthenreturningyoutotheShelland
TubeExchangermenu.
Review Results and Create Plots

Nowthatcalculationsarecomplete,youcanclicktheViewResultsbuttontoseethe
resultoftheheatexchangercalculations.TheViewResultsmenuwillappear.
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Figure 11-31: The View Results menu
Clickanyofthesebuttonstoviewvariousreportsoneverythingfrombaffle
parameterstovibrationanalysis.Whenyouselectareport,thedatadisplaysina
separatewindow,whichyoucanrevieworprintandthenclose.Toreturntothe
ShellandTubeExchangermenuatanytime,clicktheExitbutton.
YoucanalsodisplayresultsgraphicallybyclickingPlot.ThisopensthePlot
menu,fromwhichyoucanselectavarietyofzonebyzonegraphs.
Figure 11-32: The Plot menu
Theseplotsopeninaplotwindow,justliketheheatcurveplotthatyouwesaw
atthebeginningofthistutorial.WhenyouclickOKtocloseanyplot,youwillreturn
totheShellandTubeExchangermenu.
Youcanalsoprinttabulated,hardcopyreportsusingtheSelectReportsand
GenerateReportsoptionsontheShellandTubeExchangermenu.First,clickSelect
ReportstobringuptheReportSelectiondialogbox.
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Figure 11-33: The Report Selection dialog box
Selectareportviewer,andchecktheboxesforthereportsthatyouwantto
generate.ClickOKtoreturntotheShellandTubeExchangermenu,thenclick
GenerateReports.Allofthereportsthatyouselectedwillbegeneratedand
displayedusingtheviewerthatyouchose.
ClickExittoclosetheShellandTubeExchangermenu,thenclickYeswhen
askedwhetheryouwanttosaveyourchanges.Youcannowrevieworprintthe
report.
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CC-BATCH Tutorial
ThistutorialwalksyouthroughtheprocessofusingCCBATCHtosimulateabatch
distillationcolumn.
Description of the Problem

Thesimulationyouwillcreateisafivestepbatchdistillationcampaign,as
illustratedinFigure1134.Theobjectiveistoseparate100lbmolofmixedpropane,
butane,pentane,andhexaneintothreeseparatetanks,producing99%purebutane.
Figure 11-34: The batch distillation flowsheet
Thefollowingaredetailedspecificationsforthisproblem:
ThermodynamicSelections
ColumnSpecifications
K-value:PengRobinson
No.ofinternalstages:8
Enthalpy:PengRobinson
No.ofoperations:5
Internalstageholdup:0.01ft3
Condenserholdup:0.1ft3
Condenserpressure:14.7psia
Columnpressuredrop:2psia
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InitialChargeConditions
InitialChargeComposition(molefrac)
Temperature:Calculated
Pressure:16.7psia
VaporFraction:0atbubblepoint
Totalamountofcharge:
100lbmol
Propane: 0.1
N-Butane: 0.3
N-Pentane: 0.1
N-Hexane: 0.5
CHEMCADTutorials
OperatingStep1
OperatingStep2
Purpose:Propaneremoval
Purpose:Propaneremoval
Refluxratio:5
Refluxratio:20
Distillatemolarflowrate:2
Stopwhen:Distillatemole
fractionofNButaneis0.2
Stopwhen:Distillatemolefractionof
NButaneis0.985
Materialstobeaddedatstart:
None
Materialstobeaddedatstart:None
OperatingStep3
OperatingStep4
Purpose:Butaneproduction
Purpose:Pentaneremoval
Refluxratio:25
Refluxratio:15
Stopwhen:Accumulatormole
fractionofNButaneis0.99
Stopwhen:Distillatemolefractionof
NHexaneis0.2
Materialstobeaddedatstart:20
lbmolofmolefraction40%N
Butane/60%NHexane,atits
bubblepointat16.7psia
Materialstobeaddedatstart:None
OperatingStep5
Purpose:Pentaneremoval
Refluxratio:25
Stopwhen:Bottommolefraction
ofNHexaneis0.9998
Materialstobeaddedatstart:
None
Overview of the Batch Distillation Process

Theprocessofbuildingtheflowsheetandsimulatingthebatchdistillationinvolves
thefollowingsteps:
1. Createanewsimulation.
3. Drawtheflowsheet.
4. Selectthecomponents.
5. Selectthermodynamicoptions.
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CHEMCADTutorials
6. Specifypotcharge.
7. Specifythedistillationcolumn.
8. Defineoperatingsteps.
10. Reviewtheresultsandprintasneeded.
Creating a New Simulation

Startbycreatinganewsimulationandgivingitaname.
Todothis,launchCHEMCADandthenSelectFile>SavetoopentheSaveAs
dialogbox.Navigatetothedirectorywhereyouwanttostorethesimulation(tryMy
Simulations,locatedunderMyDocuments)andgiveyoursimulationaname,
leavingthetypeasCHEMCAD6(*.cc6).ThenclickSavetocreatethefileandreturn
tothemainCHEMCADwindow.

SelectFormat>EngineeringUnitstoopentheEngineeringUnitSelectiondialog
box.
TheEnglishunitsoptionisthedefaultandiscurrentlyhighlighted.Tochange
theengineeringunitssystem,youwouldclicktheAltSI,SI,orMetricbutton;you
couldthenchangeanyoftheindividualunitsaswell.Forthistutorial,youwilluse
Englishunits,soclickCanceltoexitthisdialogboxwithoutmakingchanges.

AsdescribedinChapter5,creatingaflowsheetisamatterofplacingUnitOpicons
onthescreen,connectingthemwithstreams,andthenaddingvariousgraphical
objectstoenhancethedrawing.
Placing UnitOps
BeginbyplacingtheBatchColumnunitonthescreen.
1. OntheAllUnitOpspalette,clicktheBatchcolumntool(seeFigure1135)
andthenclickinthemainCHEMCADworkspace.Thebatchcolumnicon
appearswhereyouclicked.
Figure 11-35: The icon representing a batch column
2. ClicktheTanktool(seeFigure1136).Ontheworkspace,clicktotherightof
thebatchcolumntoplaceatankicon.Thenclickjustbelowthefirsttank,and
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CHEMCADTutorials
clickagainbelowthesecondtank.Whenyouhaveplacedallthreetankson
theflowsheet,rightclicktodeactivatetheTanktool.
Figure 11-36: The tank icon
3. ClicktheProducttool(seeFigure1137)andinsimilarfashion,placethree
productarrowsontheflowsheet,eachonebelowandtotherightofatank
icon.RightclicktodeactivatetheProducttool.
Figure 11-37: The product icon
Drawing Streams
NowthatalloftheUnitOpsareinplace,selecttheStreamtoolandconnecteach
tanksoutlettothenearestproductarrow.Thesearetheonlystreamsthatyouneed
forthistutorial.
Note:Inthissimulation,thebatchdistillationcolumntransfersproductstothetanks
baseduponbatchoperationparametersthatyouprovide.Streamconnections
betweenthecolumnandthetanksarenotnecessary,andareambiguousgiventhe
dynamicnatureofsuchstreams.
Rememberthateachstreammuststartataredoutletpointontheupstream
UnitOp,andendatablueinletpointonthedownstreamUnitOp.Toavoidhavingto
reselecttheStreamtooleachtime,makesurethatassoonasyouclicktocomplete
onestream,youmovethecursortothenextlocationandclicktostartthenext
stream.
Asyoudrawstreams,CHEMCADassignsstreamIDs,justasitassignedUnitOp
IDswhenyoucreatedthoseitems.ThelabelsforstreamIDsaredisplayedin
squares,todistinguishthemfromtheUnitOpIDsdisplayedincircles.
Atthispoint,theflowsheetshouldlooksimilartoFigure1134.
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CHEMCADTutorials
Selecting Components
Nowyouneedtoidentifythecomponentstobeusedinthissimulation.Startby
selectingThermophysical>SelectComponents.
Forthisexample,youllchoosecomponentsfromthestandardCHEMCAD
database.IntheSelectComponentsdialogbox,findandaddeachneeded
component.
1. Holddownthe[CTRL]keyonyourkeyboardasyouclickeachofthe
followingcomponentsinturn:
Propane
NButane
NPentane
10
NHexane
2. Clicktherightarrowbutton,locatedtotherightoftheAvailableComponents
area,toaddalloftheselectedcomponentstoyoursimulation.TheSelect
ComponentsdialogboxshouldnowlooklikeFigure1138.
Figure 11-38: The completed Select Components dialog box
3. SaveyourcomponentselectionsbyclickingOK.
Selecting Thermodynamic Options

Assoonasyouhavefinishedcomponentselection,theThermodynamicsWizard
appears.Thistoolcansuggestthermodynamicsoptionstousewiththissimulation.
CHEMCADsThermodynamicsWizardworkslikethis:
1. First,itlooksatthecomponentlistanddecideswhatgeneraltypeofmodelis
required,i.e.,equationofstate,activitymodel,etc.
2. Second,itlooksattemperatureandpressurerangesthatyouprovideand
decideswhichequationwithinagivencategoryisbestatthelimitsofthose
ranges.
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CHEMCADTutorials
3. Ifthemethodisanactivitymodel,theprogramthenlooksattheBIP
databasetoseewhichmodelhasthemostdatasetsforthecurrentproblem.
ItthencalculatesthefractionalcompletenessoftheBIPmatrix.Ifthatfraction
isgreaterthantheBIPthresholdparameter,itusesthechosenactivity
method;ifnot,itusesUNIFAC.
TheThermodynamicsWizardisnoreplacementforengineeringjudgment.Thistool
usesanalgorithmbasedongeneralrules,andisthereforefallible.Thesuggested
modelmightnotalwaysbethebestmodelforthesystem.
Selectingthermodynamicoptionsbasicallymeansselectingamodelormethod
forcalculatingvaporliquid(orvaporliquidliquid)phaseequilibrium(calledtheK
valuemodel)andselectingamethodormodelforcalculatingtheheatbalance(called
theenthalpymodel).Thecommandsfortheseselectionsarelocatedonthe
Thermophysicalmenu.
CHEMCADhasalibraryofdozensofKvaluemodelswithavarietyofoptions
andabout12enthalpymodels.Makingtheproperselectionfromtheselibrariescan
sometimesbedifficult.Forthepurposesofthistutorial,assumethatyouwanttouse
thePengRobinsonmethodforboththeKvalueandenthalpycalculations.Follow
thesestepstoselectyourthermophysicaloptions:
1. AcceptthedefaulttemperatureandpressurerangesintheThermodynamics
WizardandclickOK.
2. ClickOKagaintoacceptthewizardssuggestedmethodofSRK.
3. WhentheThermodynamicSettingsdialogboxopens,findtheGlobalK
ValueModelselection,intheupperleftcorneroftheKValueModelstab.
ThecurrentsettingisSRK,butforthepurposesofthetutorial,youllneedto
selectthePengRobinsonmodel.Clickthedownarrowattherightendofthe
selectionboxtoviewalonglistofKvaluechoices,thenclickPeng
Robinson.
Figure 11-39: The new K-value selection in the Thermodynamic Settings dialog box
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CHEMCADTutorials
4. NowclicktheEnthalpyModelstab.ThePengRobinsonmethodhasalready
beenenteredastheGlobalEnthalpyModelselection;thiswasdone
automaticallybecauseyouchosePengRobinsonasyourKvaluemethod.
Whileyoudohavetheoptiontooverridethischoice,inthiscaseyoullneed
tokeepthePengRobinsonmodel;leaveallsettingsastheyareandclickOK
toreturntothemainCHEMCADworkspace.
Forthepurposeofthistutorial,thethermodynamicselectionsarenowcomplete.
Note:WhileyouarenotrequiredtousetheThermodynamicsWizard,youshould
knowhowtouseit,ifonlyasastartingpointforyoursimulations.Youcanrevisit
thewizardatanytimebyselectingThermophysical>ThermodynamicsWizard.
Specifying Pot Charge

Nowthatyouhavethermodynamicsandcomponentsdefinedforthissimulation,
andyouhaveabatchcolumnintheflowsheet,youcandefinethepotchargeforthe
column.
Youwillspecifythepotchargeaccordingtothefollowingrules:
TheTempF,Prespsia,VaporFraction,andEnthalpyMMBtu/hfieldsare
thethermodynamicpropertiesofthecharge.AccordingtotheGibbsPhaseRule,
onceamixturescompositionisgiven,specifyinganytwoofthesefour
thermodynamicpropertieswilldefinetheothertwo.Assuch,definingthe
composition,temperature,andpressureforamixtureuniquelydefinesits
vaporfractionandenthalpy.Alternatively,definingthecomposition,
pressure,andenthalpywilluniquelydefinethemixturestemperatureand
vaporfraction.
Sinceenthalpiesarecalculatedrelativetoadatum,thecalculationofany
givenenthalpyisaninvolvedprocesswhichispronetoerrors.Forthis
reason,CHEMCADdoesnotpermityoutoenterenthalpyasaconstraint.
Inadditiontodefiningthepotcomposition,youmustdefineexactlytwoof
thefollowingproperties:temperature,pressure,andvaporfraction.Thetwo
variablesthatyouspecifywilldisplayasredtext,whilethethirdvariable
andthevalueenthalpywillbedisplayedinblackwhenyouflashthecharge.
170
TheTotalflowunitandCompunitfieldsworktogethertoprovideavariety
ofwaystodefinechargecomposition.Iftheselectedcompunitismole,mass,
orvolumefraction(eithergloballyorlocally),thentheTotalflowunit
selectionisavailable.Iftheselectedcompunitisanamountoption,thenthe
totalchargebecomesthesumofthecomponentquantities,andtheTotal
flowunitselectionisnotavailable.
IftheCompunitfieldselectionisanamountunit(asopposedtoafractional
unit),thenthecomponentchargevaluesareautomaticallyaddedasyou
enterthem.ThecurrentsumisdisplayedintheTotalflowfield.
CHEMCADTutorials
YoucanclicktheFlashbuttonatanytimetoperformaflashcalculation
usingthecurrentlyspecifiedcompositionandthermodynamicproperties.
Thisenablesyoutoobtainflashcalculationsquicklyandwithoutleavingthe
dialogbox.
Fractionsthatdonotaddupto1.0areautomaticallynormalizedwhenyou
eitherclickFlashorexitthedialogbox.
Withtheserulesandbehaviorsinmind,enterthedataforyourpotcharge:
1. DoubleclickthebatchcolumntoopentheEditBatchChargedialogbox.
Figure 11-40: The Edit Batch Charge dialog box
2. InthePrespsiafield,type16.7,thenpress[TAB]andtype0intheVapor
Fractionfield.
Note:Itsimportantthatyouactuallytypea0overtheexisting0entryintheVapor
Fractionfield.ThistellsCCBATCHthatyouarechoosingtospecifyavapor
fraction.
3. IntheCompunitfield,selectmolefrac.Youcannowtypeavalueof100in
theTotalflowfield.
4. Type0.1inthePropanefield,andtheninsimilarfashion,typethefollowing
numbersinthecorrespondingfields:
NButane:0.3
NPentane:0.1
NHexane:0.5
5. ClickOKtosavethischargeinformationandcontinue.
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Specifying the Distillation Column

Whenyouhavespecifiedthepotcharge,CCBATCHdisplaystheBatchDistillation
Columndialogbox.
Figure 11-41: The Batch Distillation Column dialog box
MakethefollowingentriesontheGeneraltabofthisdialogbox:
Numberofstages:8
Numberofoperationsteps:5
Stageholdup:.01
Condenserholdup:1
Condpressure:14.7
Colmpresdrop:2
Whenyouhaveenteredtheseparameters,clickOKtosavethedataand
continue.
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Defining the Operating Steps

Whenyouhavecompletedtheinitialcolumnspecification,theBatchOperation
Parametersdialogboxappears.
Figure 11-42: The Batch Operation Parameters dialog box
Inthisdialogbox,youlldefinetheparametersforeachoperatingstepofthe
batchcampaign.Beforeyoubegin,youneedtounderstandhowCCBATCHhandles
tankassignments.
TheProductassignmentfieldsidentifytheaccumulatortowhichaproductor
decantstreamwillbesent.Youcanusethisoptionevenifyoudonotplacetankson
theflowsheet;simplydesignatingaUnitOpIDnumberissufficient.Inthiscase,its
importantthatyoudesignateaUnitOpIDthatisnotalreadyinuse.
SinceCCBATCHpermitsvaporliquidliquiddistillation,theremaybetwo
liquidphasesinthecondenser,possiblygivingrisetodecantingofonephaseorthe
other.TheDistillateTank#fieldentryrepresentsthetankthataccumulatesthe
distillate.TheDecanterTank#fieldentryrepresentsthetankthataccumulatesthe
decantedliquid,ifany.
Operating Step 1
Foroperatingstep1,makethefollowingentriesintheBatchOperationParameters
dialogbox:
ChangetheStartupoptionfieldto1Startwithtotalreflux.
IntheProductassignmentarea,enter2intheDistillatetank#field.
IntheFirstspecvaluefield,enter5asthevalueoftherefluxratio.
IntheSecondspecvaluefield,enter2.
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CHEMCADTutorials
IntheOperationstepstopoptionsarea,settheStopwhenoptiontoDistillate,
settheMeasuredvariableoptiontoMolefraction,andenter0.2intheStop
valuefield.IntheComponentfieldthatnowappears,select2NButane.
IntheMin.runtimefield,enter0.5.
Whenyouhavemadetheseentries,clickOKtomoveontothenextoperating
step.
Operating Step 2
dialogbox:
Enter2intheDistillatetank#field.
Enter20intheFirstspecvaluefieldand2intheSecondspecvaluefield.
StoptheoperationwhenthemolefractionofNButaneinthedistillateis
0.985.
Whenyouhavemadetheseentries,clickOKtomoveontothenextoperating
step.
Operating Step 3
Followthesestepsforoperatingstep3:
1. MakethefollowingentriesintheBatchOperationParametersdialogbox:
StoptheoperationwhenthemolefractionofNButaneinthe
accumulatoris0.99.
2. ClicktheAdditionalSettingstab.Hereyouwillspecifytheadditionof20
molesofmixturetothepot,withacompositionof40%butaneand60%
hexane.ChecktheAddmaterialtopotboxandthenclickOKtobringupthe
EditBatchChargedialogbox.
3. InthePrespsiafield,type16.7,thenpress[TAB]andtype0intheVapor
Fractionfield.
4. Enterthefollowingcompositionsettings:
SettheCompunitfieldtomolefrac.
Enter0.4intheNButanefield.
Enter0.6intheNHexanefield.
Enter20intheTotalflowfield.
5. ClickOKtocontinuetothenextoperatingstep.
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CHEMCADTutorials
Operating Step 4
dialogbox:
StoptheoperationwhenthemolefractionofNHexaneinthedistillateis0.2.
Whenyouhavemadetheseentries,clickOKtomoveontothefinaloperating
step.
Operating Step 5
dialogbox:
StoptheoperationwhenthemolefractionofNHexaneintheresidual
chargeatthebottomofthecolumnis0.9998.
Whenyouhavemadetheseentries,clickOKtocontinue.
The Run Time Information Dialog Box

Atthecompletionofthelastoperatingstep,theRunTimeInformationdialogbox
displays.Here,youcanchoosewhichvariableswillbeplottedwhenyourunthe
simulation.
Figure 11-43: The Run Time Information dialog box
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CHEMCADTutorials
Forthisexample,thedefaultdisplayaplotofdistillatemolefractionsforall
fourcomponentsiswhatyouwant,soclickOKtobringuptheBatchDistillation
menu.
Figure 11-44: The Batch Distillation menu
Thismenuprovidesaccesstotheentryscreensforalldefinedoperationsteps,as
wellasoptionsforinserting,deleting,andcopyingoperationsteps.Youmightwant
toreviewtheoperatingstepsandverifyyourentriesbeforerunningthesimulation.
Whenyouarefinished,clicktheExitbuttontoclosethemenu.

Torunthesimulation,clicktheRunAlltoolbarbutton.CCBATCHfirstchecksthe
inputdataforerrorsoromissions.Youmayseethefollowingtypesofmessages:
Errormessagesmustbefixedbeforethesimulationcanproceed.Under
specificationofthebatchcolumnwouldbeanexampleofthistypeoferror.
Warningmessagesareusuallyinputomissions,whichmayormaynotcause
problemsuponexecution.Thesearenonfatalerrorsthatdonotnecessarily
needtobecorrectedpriortosimulation.
Assumingthatyoucorrectlyspecifiedthepotchargeandsubsequentoperation
steps,youshouldseenomessages;theprogramwillproceeddirectlytothe
calculation.
Youwillseethedistillatemolefractionsplottedonthescreeninaplotwindow.
Eachtimetheprogramproceedstothenextoperatingstep,anewplotwindowwill
open,alongwithanewtabatthebottomofthemainCHEMCADworkspace.
Duringtherun,onlythecurrentstepsplotisvisible.Whenthesimulationis
finished,thedynamicplotwillquitscrollingandaRunfinishedmessagewillappear
atthefarleftendoftheCHEMCADstatusbar.
Aftertherun,youcanviewtheplotforaparticularoperatingstepbyclicking
thecorrespondingtabatthebottomoftheCHEMCADworkspace.Tocloseany
plotstab,clicktheClosebutton(markedwithanx)onthetab.Tocloseallofthe
plottabsatthesametime,selectWindow>CloseAllCharts.
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Reviewing and Printing Results

Oncethesimulationiscomplete,youcanreviewtheresultsinteractivelybefore
printingahardcopy.ThecommandsneededtodothisarelocatedintheReportand
Plotmenus.
Plotting the Results

Forbatchcalculations,themostconvenientwaytoexaminetheoutputistoplotthe
results.Todothis,clickyourbatchcolumnUnitOpandthenselectPlot>Dynamic
Plots>BatchColumnHistory.
ThisbringsuptheBatchColumnPlotsdialogbox.Fromhere,youcangeneratea
plotthatencompassestheentirecampaign.Forexample,youcanfollowthesesteps
toplotdistillatemolefractionsacrossalloperatingsteps:
1. InthePlotvariablefield,selectthe0Molefractionsoption.
2. IntheOfthefield,selectthe3Distillateoption.
3. IntheComponentstoplotarea,usethefirstfourfieldstoselectthefour
componentsfoundinthedistillate.
Figure 11-45: The completed Batch Column Plots dialog box
4. ClickOKtoviewthecompositeplot,whichshouldresembleFigure1146.
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Figure 11-46: Composite plot showing composition of distillate over time
Revieworprinttheresultsasneeded,andthenclosetheplottabtoreturntothe
simulation.
Generating Text Reports

Youcanalsoviewcertainbatchresultsintabularformat.Todothis,selectReport>
BatchResults.Asummaryoftheresultsofthissimulationdisplaysinaseparate
window.Revieworprinttheresultsasneeded,andthenclosethereportwindowto
returntothemainCHEMCADwindow.
Generating a Full Report

TheReportmenuoffersabroadarrayoftextreports,asdescribedinChapter8,
OutputandReports.Forthepurposeofthistutorial,assumethatyouwanttoview
andprintoutareportwiththefollowinginformation:
Operatingstepresults
Batchcolumnhistory
Finalbatchcolumnholdup
Becauseyouwantareportwithabroadrangeofinformationaboutyour
simulation,usetheCHEMCADReportWritertool.
1. SelectReport>NewtobringuptheReportWriterdialogbox.
2. IntheAddNewReportSectionlist,thefirstthreeitemsareBatch
DistillationResults,BatchHistory,andBatch/DynamicColumnHoldup.
DoubleclickeachoftheseitemsinturntoaddthemtotheCurrentReport
Sectionslistatleft.
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Figure 11-47: Batch distillation items added to new report
3. ClickGeneratetocreatethereport.Youcanthenedit,save,andprintthe
reportasneeded.
4. Whenyoufinishreviewingandworkingwiththereport,clickCancelto
closetheReportWriterdialogboxandreturntothemainCHEMCAD
workspace.
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Piping Tutorial
Apipingnetworkrepresentstheflowoffluidsthroughseveralpiecesofequipment.
Ifsufficientvariables(flowrateandpressure)arespecifiedonthepipingnetwork,
CHEMCADcalculatestheunknownvariables.
Forfluidflowthroughequipment,flowratemaybecalculatedasafunctionof
theinletandoutletpressure.Ifyouknowanytwoofthesethreevariables,
CHEMCADcancalculatethethird.
Inthistutorial,youwillworkwithCHEMCADspipingfeatures.Youwill
performcontrolvalveandorificesizingandrating;simulatecomplexpiping
networks;usefeedbackcontrollers;calculateNPSH;andmakeappropriate
equipmentselections.
Control Valve Sizing Example

Thisportionofthepipingtutorialcoverscontrolvalvesizing,controlvalves,andthe
useofnodes.
Problem Statement
Forthispartofthetutorial,referencetheflowsheetshowninFigure1148.This
exampleiscalledExample1,anditslocatedintheMy
Simulations\Examples\Pipingfolder.
D-1
-9F
225 psig
D-2
-1F
15 psig
D-3
-28F
0.2 psig
Figure 11-48: Diagram of control valve sizing example
Youneedtosizecontrolvalvesforhandlingaflowof113,000lb/hrofliquid
ammoniaineachlinecomingfromvesselD1.Youmustselectproperlysizedvalves
andthendeterminethepercentopenforeachvalveattheratedservice.
Toperformtheinitialsizing,allyouneedarestreamswiththecorrectproperties
(seeFigure1149).Itisnotnecessarytomodelthetanks.
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CHEMCADTutorials
1
1
Figure 11-49: Streams for initial sizing
AllthreestreamsinFigure1149areattheinletconditionsof9Fand225psig.
Thedividersplitsthe226,000lb/hrflowintotwoequalflowsof113,000lb/hrof
ammonia.
Toperformtheinitialsizing,followthesesteps:
1. ClicktheRunAllbuttononthemainCHEMCADtoolbartocalculatethe
flowinformationforstreams2and3.Bothstreamsshouldbeat9F,225
psig,and113,000lb/hrofammonia.
2. Clickstream2toselectit.Thestreamisselectedwhenitisshownbracketed
byblacksquares.SelectSizing>ControlValvetobringuptheControlValve
Sizingdialogbox.
Figure 11-50: The Control Valve Sizing dialog box
3. IntheDownstreampressurefield,enter15.ClickOKtodisplayacontrol
valvesizingreportinaseparatewindow.CHEMCADreportstheproperties
ofthestreamandthecalculatedparametersforthevalve.
4. Repeattheprocedureforstream3,usingadownstreampressureof0.2psig.
Rating Case
Thenexttaskistoratethesevalvesinasimulation.Youneedtodeterminethevalve
positionforthesevalvesinthisserviceat113,000lb/hr.Sincethistaskmodelsthe
behaviorofthecontrolvalves,youwillneedaslightlylargerflowsheet,asshownin
Figure1151.
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CHEMCADTutorials
1
1
3
2
4
8
5
9
Figure 11-51: Flowsheet for rating valves in a simulation
TheflashUnitOpsattheendarenotnecessary;theyareincludedtoillustratethe
vaporandliquidflowratesinseparatestreamsifflashingoccurs.
Thedividerisstillsetto113,000lb/hr,andtheflashtanksaresettothemode
calledSpecifyTandP;calculateV/FandHeat.FlashUnitOp#2issetto1Fand15
psig.FlashUnitOp#3issetto28Fand0.2psig.
Followthesestepstoratethecontrolvalves:
1. Doubleclicktheiconforcontrolvalve#4toopentheControlValvedialog
box.
Figure 11-52: The Control Valve dialog box
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CHEMCADTutorials
2. IntheValveflowcoefficient(Cv)field,enter36.IntheDownstream
pressurefield,enter15.SelecttheOperatingmodeoptioncalledFix
flowrate,adjustvalveposition.ClickOK.
3. Nowdoubleclicktheiconforcontrolvalve#5.Forthisvalve,selectthesame
operatingmodethatyouusedforvalve#4.Specifyavalveflowcoefficientof
54andadownstreampressureof0.2psig,andthenclickOK.
4. ClicktheRunAllbuttononthetoolbartorunthesimulation.
5. Toviewtheresults,firstclickablankareaoftheCHEMCADworkspaceto
ensurethatnoUnitOpsarecurrentlyselected.ThenselectReport>UnitOps
>SelectUnitOps.
6. IntheSelectUnitOpsdialogbox,type4,press[RETURN],andthentype5.
ClickOKtobringupareportforthesetwovalves.
Thereportshowsthatvalve#4isat72.5%open,andvalve#5isat53.3%open.
Toseehowmuchvaporizationoccursacrossvalve#5,rightclickthevalveand
selectViewStreamProperties.ThisvolumechangeiswhyCHEMCADchosea
largervalveforthesecondstream.Withthevaporizationoccurringinthevalve,a
smallertwoinchvalvebodywouldbeapproachingsonicvelocitythroughthevalve
body.
Flow Rate as a Function of Pressure

IntypicalCHEMCADsimulations,informationflowsinonedirection:downstream.
Upstreamconditionsdeterminethedownstreamconditions.Inmostsimulations,
yousimplysettheflowratesandpressuresoffeedstreams.Pressuredropsare
eithercalculatedbasedonfloworspecifiedthroughUnitOps,andthedownstream
pressures,flowrates,andsofortharecalculatedwhenyourunthesimulation.
Forpipingsimulations,flowrateandpressurearedependentoneachother.The
backpressureonvalves,pipes,andotherUnitOpsaffectstheflowratethroughthe
valve.Likewise,theflowratethroughavalve(orthroughapipeorapump)
determinesthedownstreampressure.
Inflowmodelslikethecontrolvalvesizingmodel,itissometimesusefultolet
flowratevaryasafunctionofthepressure.Forexample,supposeaprocessupsetin
thesystemshowninFigure1153causedthepressureinvesselD2torisefrom15
psigto30psig.Assumingtheupsetoccursfasterthanthevalvesreact,whatisthe
newflowratefromD1?
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CHEMCADTutorials
D-1
-9 F
225 psig
D-2
-1 F
30 psig (UPSET condition)
Cv =36
72.5 % open
Cv =54
53.3% open
D-3
-28F
0.2 psig
Figure 11-53: Vessel D-2 in an upset condition
Toanswerthisquestion,youneedaspecialUnitOpcalledanode.Anodeisa
pointinthesimulationthathasapressure,aflowcomingin,andaflowgoingout.
Thenodeunitscreateanetwork,solvingforflowrateateachpointbasedonthe
fixedpressures.Nodesareplacedontheflowsheetimmediatelyupstreamand
downstreamfromeachcontrolvalve.Figure1154showsthesystemwithnodesin
place.
11
6
10
11
17
7
13
15
18
12
12
19
10
8
14
16
20
Figure 11-54: Nodes located upstream and downstream from control valves
Thefunctionofthedividertosplittheincomingflowisnowhandledbynode
#6.Thenodewillbalancetheflowratessothatallstreamsenteringandexitingthe
nodeareatthesamepressure.Nodesarealsoplacedbetweentheflashvesselsand
thecontrolvalves.Atthenodesyoucanfixthepressures,andlettheflowratevary
asafunctionofvalvepositionandpressuredifference.
Toseehowthesenodesaresetup,youcandoubleclicknode#6toopenthe
Nodedialogbox.
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CHEMCADTutorials
Figure 11-55: The Node dialog box
Thefixedpressureatthisnodeis225psig.TheinletflowmodeissettoFreeinlet
stream,andthetwooutletstreamsaresettoFlowsetbyUnitOp.Theflowintoeach
controlvalvewillbedeterminedbythecontrolvalveopeningpositionandthe
pressuredifferenceacrossthevalve.
Fornode#9,thefixedpressureissetto30psig,andfornode#10,thepressureis
0.2psig.Flowintoeachofthesenodesiscontrolledbythecontrolvalveusingthe
FlowsetbyUnitOpmode;flowoutissettoFreeOutletstream.
Thecontrolvalvesneedtobechangedtofixthevalvepositionandcalculateflow
rate.Todothis,settheOperatingmodeforeachvalvetoFixvalveposition,adjust
flowrate.
Aftermakingthischange,clicktheRunAlltoolbarbuttontorunthesimulation.
Afterrunning,youcanviewthestreamsaroundnode#6byrightclickingthenode
andselectingViewstreamcomposition.Theresultingreport(Figure1156)shows
thattheflowrateforstream11(upstreamfromD2)hasdroppedfrom113,000lb/hr
to109,138lb/hr.Thisillustratestheeffectofbackpressureontheflowratesthrough
thevalves.
Figure 11-56: Stream composition report for node #6
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CHEMCADTutorials
Simple Flow Example

Thisportionofthepipingtutorialcoverscontrolvalvesizing,feedbackcontrollers,
NPSH,orificesizing/rating,pipesizing/rating,andthePipeUnitOp.
Problem Statement
Thepipingsystemshownmustbedesignedtotransport120gpmofglacialacetic
acidat70140F.Thepressureattheinletisknownat20psia,andtheoutletmustbe
nolessthan20psia.Thepipingsystemanditsindividualelementsmustbesizedfor
designconditionsandthenratedatoperatingconditions.Thegoalistodetermine
theNPSHaandheadrequirementsforfuturepumpselection.
Figure 11-57: Piping isometric for this problem
ThisexampleiscalledExample2,anditslocatedinthelocatedintheMy
Creating the Simulation

Followthesestepstocreateandrunthissimulation:
1. ConvertthepipingisometricinFigure1157toaCHEMCADflowsheet.Pipe
UnitOpsareusedtorepresententiresectionsofpiping,includingfittings.
2. SelectSizing>PipingandselecttheapplicablestreamstobringupthePipe
Sizingdialogbox.
186
CHEMCADTutorials
Figure 11-58: The Pipe Sizing dialog box
3. SelecttheTypicalsizingforsinglephaseoptionandusestandardschedule
40pipe.ClickOKtoviewalinesizingreportfortheselectedstream.
Note:Sincethefluidinthissystemissubcooledliquidandallflowsareconstant,
thiscalculatedlinesizeshouldapplytoallpipinginthesystem.Theexceptionisthe
pumpsuctionpipe,whichasageneralruleshouldbeonesizelarger.
4. SelectSizing>Orificeandselectthestreamonthedischargesideofthe
pump.IntheOrificeSizingdialogbox,selectDandD/2pressuretaps,enter
3asthepipeinsidediameter,andenter100asthewaterdifferentialpressure.
ClickOKtobringupanorificesizingreportfortheselectedstream.
Note:Usingthecalculatedborehole,CHEMCADdeterminestheflowresistance
factoroftheorificeasshown:
C = Cd /( (1 4 )
1 2
Kr 2 4
C
TheorificesizingreportgivestheKrvalue,whichyouwilluselaterinthePipe
SizingandRatingdialogbox.
5. Tosizethecontrolvalve,selectstream#1andthenselectSizing>Control
Valve.IntheDownstreampressurefield,enter15,andselecttheSingleseat
option.Sincestream#1isat20psia,youaresimplysizingacontrolvalveto
produceapressuredropof5psi.ClickOKtoviewacontrolvalvesizing
reportfortheselectedstream.
6. Doubleclickcontrolvalve#4toopentheControlValvedialogbox.Enterthe
valveflowcoefficient(Cv)ofthevalvefromthesizingreport,setthevalve
positionto50%,andsettheoperatingmodetoFixflowandposition,
calculatePout.ClickOKtosavethesesettingsandclosethedialogbox.
187
CHEMCADTutorials
7. DoubleclicktheheatexchangericontoopentheSimpleHeatExchanger
dialogbox.Enterapressuredropof2psiandsettheoutlettemperatureto
140F.ClickOKtocontinue.
8. Tabulateandspecifythevalves,fittings,pipelengths,andelevationchanges
ofeachsectionofpipe.Forallofthesepipes,settheMethodfieldto2Single
Phaseflow,settheSizingoptionto0Rating,anduseflangedfittings
throughout.
Pipe#1
Pipe#3(beforecontrolvalve)
1entrance,wellrounded
1swingcheckvalve,clearway
2ballvalves
2ballvalves
4standardelbows,90degree
2tee,flowthroughrun
1tee,flowthroughbranch
1orificeplate(aspreviouslydetermined)
35feetofpiping
14feetofpiping
8elevationchange
14elevationchange
Pipe#5(aftercontrolvalve)
Pipe#7(afterE1515)
2ballvalves
1ballvalve
2tee,flowthroughrun
1tee,flowthroughrun
1exitfrompipe
1wellroundedentrance
24feetofpiping
1exitfrompipe
2footelevationchange
157feetofpiping
5elevationchange
9. Specifythepumpoutletpressureatsomearbitraryvalue(try25psia)and
makeatrialrun.Checkthecalculatedoutletpressure.Youcantheniterateto
findtherequiredpumphead.
Using Controllers to Simplify the Problem

Whilemanuallychangingthepumpoutletpressurewillgetyouwhereyouneedto
be,itseasiertoletCHEMCADdothework.TheControllerUnitOpcanadjustthis
pressureforyou.
AfeedbackcontrollerinCHEMCADhasnothingtodowithprocesscontrol
valvesorPIDsettings.InaCHEMCADsteadystatemodel,thetermfeedbackcontrol
referstoamathematicalcontroller.Itsamathtoolusedtoadjustavariableona
flowsheetuntilatargetvaluereachesaspecifiedvalue.
Followthesestepstouseafeedbackcontrollertocalculatetherequiredoutlet
pressure:
188
CHEMCADTutorials
1. Rightclickstream#8andselectInsertunit.ClickOKatthepopupmessage
andthenclicktheControllertoolintheAllUnitOpspalette.
2. Clickneartheexistingstreamtoplaceacontrollericonontheflowsheet.The
streamautomaticallyreroutesthroughthisicon,asshowninFigure1159.
7
7
Figure 11-59: Insertion of feedback controller
3. IntheControllerdialogbox,specifythefollowingandthenclickOK:
Controllermode:Feedbackward
Adjustthisvariable:UnitOp,IDnumber2,Variable2Outputpressure
Untilthis:Stream,IDnumber8,Variable2Pressure
Isequaltothistarget:Constant20,Units4Pressure
Whenyourunthesimulation,thecontrollerwillautomaticallychangethepump
outletpressureuntilthepressureleavingthelastpipeunitisequalto20psia.You
nowknowtheheadrequirementsforyourpump.
Calculating NPSHa
Thenetpositivesuctionhead,betterknownasNPSH,isdefinedasthetotalpressure
availableatthepumpsuctionminusthepumpingfluidsvaporpressure.Itisalmost
alwaysreportedinfeetofpumpedfluidorwater.
EverypumphasaspecifiedNPSHrequirement(NPSHr)atagivenoperating
speed.Toensurereliableoperation,theavailableNPSH(NPSHa)mustbegreater
thantheNPSHr.Ifnot,cavitationandshortenedservicelifemayresult.
Toselecttheappropriatepump,youneedtocalculateNPSHa.InCHEMCAD,
thisisaneasytask.SimplychecktheCalculateNPSHaboxinthePumpdialogbox,
andthenrunthesimulation.NowwhenyoupullupthePumpdialogbox,the
calculatedNPSHaisdisplayed.
Note:ItisimportanttotheNPSHacalculationthattheinletpipingtothepumpbe
correctlyspecified.Ifthepipingspecificationsarenotcomplete,thepressureatthe
inletmaynotbeaccurate,leadingtoaninaccurateNPSHacalculation.
189
CHEMCADTutorials
Branched Flow Example

ThisportionofthepipingtutorialcoverstheNodeUnitOp,pipenetworks,pump
selectioncriteria,andPumpUnitOpperformancecurves.
Problem Statement
Thepreviouspipingsystemhasbeenchanged.Duetothebranchedflowtothetwo
heatexchangers,theproblemisnolongerasimpleone.
Figure 11-60: Piping isometric showing branched flow
ThisexampleiscalledExample3,anditslocatedinthelocatedintheMy
Thebranchedflowisadifficultproblemtosolveusingthecontrollerapproach.
Bothexchangershavedifferentpipingandthereforedifferentflowrates.Youneed
anapproachwhereyousplitandrecombineflows,andhavethesimulationcalculate
thepressureandflowratesinaniterativemanner.TheNodeUnitOpgivesyouthis
flexibility.
Rememberthatanodeisapointwherepressureisuniform.Theremaybe
multipleinletsandoutlets.Theflowratesforeachstreamwillbebalancedby
CHEMCADtoreachasinglepressure.Youcanspecifythepressureorallowitto
vary.
Creating the Simulation

ConvertthepipingisometrictoaCHEMCADflowsheet,asshowninFigure1161.
190
CHEMCADTutorials
Figure 11-61: The flowsheet representing this piping system
InCHEMCAD,PipeUnitOpsareusedtorepresententiresectionsofpiping,
includingfittings.NodeUnitOpsareplacedwherepressureorflowrateare
unknown.
Forthisexample,assumeapressuredropof2psiacrosseachheatexchanger.
Tabulatethevalves,fittings,pipelengths,andelevationchangesofeachsectionof
pipe.Useflangedfittingsthroughout.
Pipe#1
Pipe#2(beforecontrolvalve)
1entrance,wellrounded
1swingcheckvalve,clearway
2ballvalves
2ballvalves
2tee,flowthroughrun
1orificeplate(asdeterminedabove)
35feetofpiping
14feetofpiping
Pipe#3(aftercontrolvalve)
Pipe#4(toE1514)
1ballvalve
1tee,flowthroughrun
1ballvalve
1exitfrompipe
10feetofpiping
26feetofpiping
191
CHEMCADTutorials
Pipe#5(fromE1514)
Pipe#6(toE1515)
1ballvalve
1ballvalve
1exitfrompipe
1tee,flowthroughrun
30feetofpiping
14feetofpiping
Pipe#7(fromE1515)
Pipe#8(toV1522)
1standardelbow,90degree
1ballvalve
1exitfrompipe
147feetofpiping
1tee,flowthroughrun
10feetofpiping
Atthistimeyoudontknowthepumpspecifications,sosetthepumptoSpecify
OutletPressureandleavethepressurespecificationblank.TheNodeUnitOpwill
solveforthepressureincrease,andsetthepumpoutletpressureaccordingly.
Setupthenodeswiththefollowinginformation:
192
Node3:Variablepressure,usecurrentstreamrateforinlet,flowsetby
UnitOpforoutlet,elevation=20feet
Node5:Variablepressure,flowsetbyUnitOpforbothinletandoutlet,
elevation=34feet
elevation=34feet
elevation=34feet
elevation=50feet
elevation=38feet
elevation=42feet
Node20(lastnode):Fixedpressure,20psia,flowsetbyUnitOpforinlet,free
outletstreamforoutlet,elevation=43feet
CHEMCADTutorials

Torunthesimulation,clicktheRunAllbuttononthemainCHEMCADtoolbar.
Oncethesimulationhasrun,checkthePumpUnitOpspressureincrease.This
tellsyoutheheadrequirementsofthepump.Usingthisinformationandtheflow
rate(120gpm),youcanconsultapumphandbooktodeterminethecorrectpump
size.
Selecting a Pump
Thefollowingpumpcurvedataisrepresentativeofthetypeofequipmentthat
wouldbeappropriateforthisapplication.
Pump Curve
90
Head (ft)
80
1750 rpm
70
60
50
1450 rpm
40
1150 rpm
30
20
0
40
80
120
160
200
Flow (gpm)
0.6
1450 rpm
0.55
Efficiency
1750 rpm
0.5
0.45
1150 rpm
0.4
0.35
0.3
0
40
80
120
160
200
Flow (gpm)
Figure 11-62: Combined pump curves for a sample pump
Toenterthiscurveintoyourpump,openthePumpdialogboxandselect
SpecifyPerformanceCurveforthepumpmode.Thissettingallowsyoutoenter
multiplespeedlinesandanoperatingspeed.Forthepurposesofthistutorial,enter1
193
CHEMCADTutorials
forthenumberofspeedlinesandsetthepumpspeedto1750RPM.ClickOKto
bringupthePerformanceCurvedialogbox.
Figure 11-63: The Performance Curve dialog box
Hereyoucanenterasmanypointsasyouwanttodefineyourcurve.
CHEMCADwillfitaquadraticequationtothepoints,creatingasmoothcurvefitfor
yourdata.
Nowthatyouhaveenteredthepumpperformancecurve,youmustaddnode
UnitOpstothesuctionsideofthepumptoallowtheflowratetovary.Inthisway,
youcancalculatethemaximumflowrateofyoursystem.
194
Index
.CC6files,29
CHEMCAD
Addingasinglecomponent,101
Mainmenu,23
Addingcomponentstoasimulation,42
Toolbar,23
AllUnitOpspalette,37
Tutorials,131
Applyingatemplate,100
Gettinghelpwith,15
Assigningobjectstoalayer,95
Installing,7
Attachingasimulationfiletoanemail,33
Interface,17
BatchReactor/DVSLHistoryplot,72
Licensing,10
BatchResultsreport,83
Modules,3
BinaryLLEplot,87
Openingolderfiles,34
BinodalPlot,87
Overview,1
Binodal/ResidueCurvesplot,87
Productsandfeatures,3
Buildingabasicsimulation,35
Systemrequirements,7
BulkPropertiesdialogbox,106
Usercomponentsin,30
CallingChemstations,16
CHEMCADCoachpane,27
Cases,saving,32
CHEMCADDialogEditor,110
CCBATCHtutorial,164
CHEMCADExplorer,introduced,18
CCDYNAMICS,63
CHEMCADReportWriter,84
CCSTEADYSTATEtutorial,132
CHEMCADSymbolEditor,107
CCTHERMtutorial,153
195
Index
CHEMCADtutorials
Customizingthermodynamics,111
CCBATCH,164
DatainterfacestoCHEMCAD,117
CCSTEADYSTATE,132
DataMapExecutionRulesdialogbox,121
CCTHERM,153
DataMaps,creating,118
Piping,180
Databoxes,90
Chemicalcomponents,selecting,42
DefaulticonforUnitOp,37
Chemstationswebsite,16
Definingstreams,48
Coach,27
DefiningUnitOps,49
ColumnProfiles,88
Deletingatemplate,100
COMinterfaces,128
Dialogbox,customizing,110
ComponentObjectModel(COM),128
DialogEditorutility,110
Components
DistCurveCharacterizationdialogbox,105
Adding,44
Distillationreport,82
Finding,43
Dongle
Removing,45
ForCHEMCADlicensing,10
Selecting,42
Reprogramming,13
CompositeCurvesplot,88
Drawingaflowsheet,36
ConnectingstreamstoUnitOps,39
Drawingstreamsonaflowsheet,39
Consolidatedreporting,84
Drawingtools,41
ControlValveSizingdialogbox,58
DynamicColumnHistoryplot,72
ControllerConvergenceplot,89
DynamicColumnHistoryreport,73
ConvergenceParametersdialogbox,65
Dynamicoperation,settingup,65
Costingcalculations,customized,109
Dynamicplots,89
CreatingacustomUnitOpdialogbox,110
DynamicRunTimeScheduledialogbox,67
Creatingalayer,94
Dynamicsimulation,running,69
Creatinganewsimulation,31
Dynamicsimulations,strategiesfor,65
Creatingatemplate,100
DynamicStreamHistoryplot,72
CreatinganExcelDataMap,118
DynamicStreamHistoryreport,73
Creatingcustomcomponents,101
DynamicUnitOpHistoryreport,73
CreatingExcelUnitOps,123
DynamicsMenu,66
CreatingcustomUnitOps,109
Dynamicsreports,83
CurveTemperatureCutRangesdialogbox,105
Dynamics
Customcomponents,101
Additionalinputfor,64
Customenthalpymodel,111
Defined,63
CustomKvaluemodel,111
Output,71
Custommixingrule,creatingusingVBA,113
Plottingresults,72
Customreaction,creatingusingVBA,113
RecordingstreamsandUnitOps,68
CustomUnitOpicon
Runningonestepatatime,70
Creating,107
Textbasedresults,72
Addingtoasubpalette,109
Toolbarbuttonsfor,66
CustomUnitOp,creatingusingVBA,113
EditDistillationCurvesmenu,106
CustomUnitOps,creating,109
EditFeedStreamsbutton,48
Customizedcostingcalculations,109
EditStreamGroupdialogbox,77
CustomizingCHEMCAD,99
EditStreamsdialogbox,48
CustomizingtheCHEMCADscreen,24
Ellipsetool,41
196
Index
Emailingasimulation,33
Linetool,41
EngineeringUnitSelectiondialogbox,36
LockedforEditingdialogbox,31
Engineeringunits
Lowfidelitymodeling,defined,53
Changingforreports,76
Mainmenu,23
Selecting,36
ManageComponentDatabasesdialogbox,102
Enthalpyoptions,selecting,46
MassandEnergyBalancesreport,83
Equipmentparameters,specifying,49
Messagespane,22
Equipmentsizing,introduction,54
Movingapane,25
ErrorsandWarningstab,onMessagespane,22
MovingUnitOpicons,38
Examplefiles,30
Multilinetool,41
ExcelDataMapEditor,118
MySimulationsdirectory,32
ExcelDataMappingfeature,defined,118
Neutralfileimport,106
ExcelDataboxSettingsdialogbox,92
NewComponentdialogbox,102
Excelrangeboxes,92
Newsimulation,creating,31
ExcelUnitOps,creating,123
Notestab,onMessagespane,23
Flowsheetdataboxes,90
OlderCHEMCADfiles,34
Flowsheettemplates,99
OLEforProcessControl(OPC),125
Flowsheets,drawing,36
OPC
Flowsheetbasedgraphs,88
Applications,125
GlobalEnthalpyModel,47
Compliance,125
GlobalKValueModel,47
Namespace,127
Graphicalreports,87
Serveroperations,126
Grid,27
OPCserver,usingCHEMCADas,125
Groups
Opencommand,31
Stream,76
Openinganexistingsimulation,31
UnitOp,80
OpeninganolderCHEMCADfile,34
HeatCurvesplot,88
Palettepane,introduced,20
Hidingalayer,95
Palettes,customizing,21
Highfidelitymodeling,defined,53
ParticleSizeDistributionreport,80
HydrocarbonCorrelationdialogbox,105
PFDprinting,96
Icons,creating,107
PFDs,90
InstallingCHEMCAD,7
PhaseEnvelopesplot,88
Jobfiles,29
Pinningandunpinningpanes,25
Kvalueoptions,selecting,46
PipeProfileplot,88
Layers,93
Pipingtutorial,180
Assigningobjectsto,95
PlotsinCHEMCAD,87
Creating,94
Plots,dynamic,89
Deleting,96
Plottingdynamicresults,72
Hidingandviewing,95
PlugFlowReactorProfileplot,88
Removingobjectsfrom,96
LicenseMonitorscreen,11
Polygontool,41
Printingaprocessflowdiagram,96
LicensingCHEMCAD,10
PrintingCHEMCADreports,89
Licensing,fordynamics,63
Processflowdiagrams,90
Licensing,forhighfidelitymodeling,62
Properties,ofstreams,48
Linesizing,55
PseudocomponentCurvesplot,88
197
Index
PseudocomponentCurvesreport,80
Selectingcomponents,42
Pseudocomponentrange,defining,105
Selectingengineeringunits,36
RecordStreamsdialogbox,68
SelectingKvalueandenthalpyoptions,46
RecordingstreamsandUnitOpsfordynamics,68
Selectiveprinting,93
Rectangletool,41
Settingruntimefordynamics,66
Redocommand,26
Simulationfiles
Regressingdataintoauseraddedcomponent,104
Introduced,29
Reliefdevicesizing,61
Creating,31
Removingcomponentsfromasimulation,45
Emailing,33
Renamingatemplate,100
Opening,31
ReportWriter,84
Overviewofbuilding,35
Reportsfordynamicsimulations,71
Saving,32
Reports
Simulation,running,50
CHEMCADReportWriter,84
Singlecomponent,adding,101
Dynamics,83
Sizing,introduction,54
Printing,89
Specsheetreport,82
Streamcompositions,78
Specsheets,outputtoExcel,124
Streamproperties,79
SpecifyingUnitOps,49
UnitOpbased,80
Startinganewsimulation,31
Reprogrammingadongle,13
Streamboxes,90
Reroutingastream,40
Streamcompositionreports,78
ResettoInitialStatebutton,70
Streamcomposition,viewing,79
ResidueCurvesplot,88
Streamgroups,creating,76
Resizingapane,24
StreamPropertiesplot,88
ResizingUnitOpicons,38
Streampropertyreports,79
Results,reviewing,51
Streams
Reviewingrunresults,51
Drawingonaflowsheet,39
Routingstreams,39
Defining,48
RunfromCurrentStatebutton,69
Rerouting,40
RunfromInitialStatebutton,69
Switchingtodynamics,65
Runtime,setting,66
SymbolEditorutility,107
RunTracetab,onMessagespane,22
Symbols,creating,107
Runningadynamicsimulation,69
Technicalsupport,contacting,16
Runningasimulation,50
Templates
SaveAscommand,32
Applying,100
SaveasInitialStatebutton,71
Creating,100
Savingasimulation,32
Defined,99
Savingdifferentcases,32
Deleting,100
SearchforUnitOp(s)field,21
Renaming,100
SearchOptionsdialogbox,44
Textreports,75
SelectComponentsdialogbox,43
Texttool,41
SelectDataMapdialogbox,122
ThermodynamicSettingsdialogbox,47
SelectDestinationDatabasedialogbox,102
Thermodynamicsreport,83
SelectRegressionDataSetdialogbox,104
Thermodynamicssettings,manuallyselecting,47
SelectSingleComponentdialogbox,103
ThermodynamicsWizard,46
198
Index
Thermodynamics,customizing,111
UnitOpbasedplots,88
Thermophysicaldatagraphs,87
UnitOpbasedreports,80
Toolbar,23
UpdateSimulationFormatdialogbox,34
Topologyreport,83
UpdatingaCHEMCADlicense,13
TPboxes,91
Userspecifiedfile,plotting,89
TPXYplot,87
ValveTraydialogbox,59
TraySizingdialogbox,59
VBA
Undocommand,26
UnitOpboxes,91
Customreactions,113
UnitOpdialogbox,customizing,110
CustomUnitOps,113
UnitOpgroups,creating,80
UsingtocustomizeCHEMCAD,113
UnitOpicons
VBAdefinedmixingrule,using,114
Creatingcustomized,107
VBAdefinedreaction,using,113
Manipulating,38
VBAdefinedUnitOp,using,115
UnitOps
Custommixingrules,113
VesselSizingdialogbox,57
Addingtoaflowsheet,36
ViewPropertyOptionsdialogbox,79
Selectingdefaulticonfor,37
View/EditComponentDatamenu,103
Listingofallavailable,5
Viewingalayer,95
Specifying,49
WebsiteforChemstations,16
ZoomOptionsmenu,27
199
Index
200

CHEMCAD 6 User Guide 2012 PDF

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CHEMCAD Version 6

CHEMCAD Version 6 User Guide

PseudocomponentRange .............................................................................................................. 105

CreatingaCustomSymbol ............................................................................................................... 107

Chapter11CHEMCADTutorials ................................................................................................... 131

RuntheSimulation ......................................................................................................................... 144

CCTHERMTutorial .......................................................................................................................... 153

SetNozzleSpecifications ............................................................................................................... 159

RunningtheSimulation ................................................................................................................. 176

PipingTutorial .................................................................................................................................... 180

BranchedFlowExample ................................................................................................................ 190

Overview of CHEMCAD and Its Uses

CHEMCAD Products and Features

CHEMCAD Features by Module

Run steady state

Sizing heat exchangers

Reports (incl. Excel)

Run subflowsheet META unit

SCDS distillation column

Tower distillation column

Tower plus distillation column

* These UnitOps will be phased out eventually.

Getting Started with CHEMCAD

Installing the Software

CHEMCAD Version 6 User Guide

Getting Started with CHEMCAD

Figure 2-01: InstallShield Wizard screen listing software components to be installed

Figure 2-02: The CHEMCAD Suite InstallShield Wizard screen

CHEMCAD Version 6 User Guide

Getting Started with CHEMCAD

Figure 2-03: The Standard License screen

CHEMCAD Version 6 User Guide

Getting Started with CHEMCAD

Figure 2-04: Status bar showing the progress of CHEMCAD installation

Types of CHEMCAD Licenses

CHEMCAD Version 6 User Guide

Getting Started with CHEMCAD

Figure 2-05: The CHEMCAD License Monitor dialog box

CHEMCAD Version 6 User Guide

Getting Started with CHEMCAD

Figure 2-06: Selecting a licensing preference

CHEMCAD Version 6 User Guide

Getting Started with CHEMCAD

Figure 2-07: The CHEMCAD License Monitor dialog box

CHEMCAD Version 6 User Guide

Getting Started with CHEMCAD

Figure 2-09: Browsing for the dongle update file

CHEMCAD Version 6 User Guide

Getting Started with CHEMCAD

Figure 2-11: Successful re-programming of a CHEMCAD dongle

Getting Help with CHEMCAD

CHEMCAD Version 6 User Guide

Getting Started with CHEMCAD

The Chemstations Web Site

Contacting Chemstations Technical Support

Toll-free (U.S. and Canada): 800.243.6223

CHEMCAD Version 6 User Guide

The CHEMCAD Interface