Index

1 Input File 2 Solution History 3 Main

Index

Input File
$ Generated by PRO/II Keyword Generation System <version 9.0> $ Generated on: Sat May 05 08:25:48 2012 TITLE DIMENSION METRIC, STDTEMP=0, STDPRES=1.03323 SEQUENCE SIMSCI CALCULATION TVPBASIS=37.778, RVPBASIS=APIN COMPONENT DATA LIBID 1,CL2/2,C3H6/3,C3H5CL/4,HCL/5,C3H6CL2/ & 6,C3H4CL2, BANK=SIMSCI,PROCESS ASSAY FIT=ALTERNATE, CONVERSION=API94, CURVEFIT=CURRENT, & KVRECONCILE=TAILS THERMODYNAMIC DATA METHOD SYSTEM=SRK, DENSITY(L)=COST, SET=SRK01, DEFAULT STREAM DATA PROPERTY STREAM=S1, TEMPERATURE=15, PRESSURE=14, PHASE=M, & RATE(M)=100, COMPOSITION(M)=2,1 PROPERTY STREAM=S2, TEMPERATURE=26, PRESSURE=7, PHASE=M, & RATE(M)=115, COMPOSITION(M)=1,1 RXDATA RXSET ID=1 REACTION ID=1 STOICHIOMETRY 1,-1/2,-1/3,1/4,1 KINETICS PEXP(C,KG,M3,KG/CM2,HR)=2.1E11, ACTIVATION=15.005, & TEXPONENT=0 KPHASE DEFAULT=V REACTION ID=2 STOICHIOMETRY 1,-1/2,-1/5,1 KINETICS PEXP(C,KG,M3,KG/CM2,HR)=1.19E7, ACTIVATION=3.7844, & TEXPONENT=0 KPHASE DEFAULT=V REACTION ID=3 STOICHIOMETRY 1,-1/3,-1/4,1/6,1 KINETICS PEXP(C,KG,M3,KG/CM2,HR)=4.69E14, ACTIVATION=23.5, & TEXPONENT=0 KPHASE DEFAULT=V UNIT OPERATIONS CSTR UID=R1 FEED S1,S2 PRODUCT M=S3 OPERATION VOLUME=0.3, PRESSURE=5, TEMPERATURE=425 FESTIMATE 1,1.15 RXCALCULATION KINETICS(POWERLAW) RXSTOIC RXSET=1 REACTION 1 REACTION 2 REACTION 3 END

Index

Input File
$ Generated by PRO/II Keyword Generation System <version 9.0> $ Generated on: Sat May 05 08:25:48 2012 TITLE DIMENSION METRIC, STDTEMP=0, STDPRES=1.03323 SEQUENCE SIMSCI CALCULATION TVPBASIS=37.778, RVPBASIS=APIN COMPONENT DATA LIBID 1,CL2/2,C3H6/3,C3H5CL/4,HCL/5,C3H6CL2/ & 6,C3H4CL2, BANK=SIMSCI,PROCESS ASSAY FIT=ALTERNATE, CONVERSION=API94, CURVEFIT=CURRENT, & KVRECONCILE=TAILS THERMODYNAMIC DATA METHOD SYSTEM=SRK, DENSITY(L)=COST, SET=SRK01, DEFAULT STREAM DATA PROPERTY STREAM=S1, TEMPERATURE=15, PRESSURE=14, PHASE=M, & RATE(M)=100, COMPOSITION(M)=2,1 PROPERTY STREAM=S2, TEMPERATURE=26, PRESSURE=7, PHASE=M, & RATE(M)=115, COMPOSITION(M)=1,1 RXDATA RXSET ID=1 REACTION ID=1 STOICHIOMETRY 1,-1/2,-1/3,1/4,1 KINETICS PEXP(C,KG,M3,KG/CM2,HR)=2.1E11, ACTIVATION=15.005, & TEXPONENT=0 KPHASE DEFAULT=V REACTION ID=2 STOICHIOMETRY 1,-1/2,-1/5,1 KINETICS PEXP(C,KG,M3,KG/CM2,HR)=1.19E7, ACTIVATION=3.7844, & TEXPONENT=0 KPHASE DEFAULT=V REACTION ID=3 STOICHIOMETRY 1,-1/3,-1/4,1/6,1 KINETICS PEXP(C,KG,M3,KG/CM2,HR)=4.69E14, ACTIVATION=23.5, & TEXPONENT=0 KPHASE DEFAULT=V UNIT OPERATIONS CSTR UID=R1 FEED S1,S2 PRODUCT M=S3 OPERATION VOLUME=0.3, PRESSURE=5, TEMPERATURE=425 FESTIMATE 1,1.15 RXCALCULATION KINETICS(POWERLAW) RXSTOIC RXSET=1 REACTION 1 REACTION 2 REACTION 3 END

Index

Solution History
SIMULATION SCIENCES INC. R PAGE H-1 PROJECT PRO/II VERSION 9.0 ELEC V7.0 PROBLEM CALCULATION HISTORY 05/05/12

*** PROBLEM SOLUTION BEGINS FEED FLASH COMPLETE UNIT 1 SOLVED - 'R1 ' *** PROBLEM SOLUTION REACHED *** THIS RUN USED 6.22 PRO/II SIMULATION UNITS *** RUN STATISTICS STARTED 08:25:41 05/05/12 NO ERRORS FINISHED 08:25:42 05/05/12 NO WARNINGS RUN TIMES NO MESSAGES INTERACTIVE 0 MIN, 0.00 SEC CALCULATIONS 0 MIN, 0.14 SEC TOTAL 0 MIN, 0.14 SEC

Index

Solution History
SIMULATION SCIENCES INC. R PAGE H-1 PROJECT PRO/II VERSION 9.0 ELEC V7.0 PROBLEM CALCULATION HISTORY 05/05/12

*** PROBLEM SOLUTION BEGINS FEED FLASH COMPLETE UNIT 1 SOLVED - 'R1 ' *** PROBLEM SOLUTION REACHED *** THIS RUN USED 6.22 PRO/II SIMULATION UNITS *** RUN STATISTICS STARTED 08:25:41 05/05/12 NO ERRORS FINISHED 08:25:42 05/05/12 NO WARNINGS RUN TIMES NO MESSAGES INTERACTIVE 0 MIN, 0.00 SEC CALCULATIONS 0 MIN, 0.14 SEC TOTAL 0 MIN, 0.14 SEC

Index

CSTR (Summary)

UOM

R1

Name Description Thermodynamic System Feed Streams Product Streams

Product Stream Phases

R1 R1 SRK01 S1 , S2 S3 Vapor -1312301.518 25 -3068187.917 0.3 N/A N/A 7 11.0726231 5 425 12362.18525 578167.0598 12362.18639 2496518.886
S1

S3 Reactor Duty Calculated Reference Temperature for heat of reaction Total Heat of Reaction Reactor Volume Space Time at Outlet Condition Space Velocity at Outlet Condition Inlet Pressure Inlet Temperature Outlet Pressure Outlet Temperature Feed Total Mass Rate Feed Total Enthalpy Product Total Mass Rate Product Total Enthalpy
Stream (Summary)

kcal / hr C kcal / hr m3 hr 1 / hr kg/cm2 C kg/cm2 C kg / hr kcal / hr kg / hr kcal / hr

UOM

Name Description Phase Thermodynamic System Total Molar Rate Total Mass Rate Temperature Pressure Total Molecular Weight Total Specific Enthalpy Total Cp
Total Molar Component Rates

kg-mol / hr kg / hr C kg/cm2 kcal / kg kcal/kg-C kg-mol / hr

S1 S1 Liquid SRK01 100 4208.06389 15 14 42.08063889 8.267527009 0.637758867 0 100 0 0 0 0

CL2 C3H6 C3H5CL HCL C3H6CL2 C3H4CL2

Total Molar Component Fractions

fraction 0 1 0 0

CL2 C3H6 C3H5CL HCL

C3H6CL2 C3H4CL2 Vapor Molar Rate Vapor Mass Rate Vapor Molecular Weight Vapor Mole Fraction Vapor Specific Enthalpy Vapor CP
Vapor Composition

kg-mol / hr kg / hr fraction kcal / kg kcal/kg-C fraction

0 0 N/A N/A N/A N/A N/A N/A N/A N/A N/A N/A N/A N/A

CL2 C3H6 C3H5CL HCL C3H6CL2 C3H4CL2

Vapor Component Rate

kg-mol / hr N/A N/A N/A N/A N/A N/A 100 4208.06389 42.08063889 1 8.267527009 0.637758867 0 1 0 0 0 0 kg-mol / hr 0 100 0 0 0 0 N/A N/A N/A N/A N/A N/A N/A N/A N/A

CL2 C3H6 C3H5CL HCL C3H6CL2 C3H4CL2 Total Liquid Molar Rate Total Liquid Mass Rate Total Liquid Molecular Weight Total Liquid Mole Fraction Total Liquid Specific Enthalpy Total Liquid CP
Total Liquid Composition

kg-mol / hr kg / hr fraction kcal / kg kcal/kg-C fraction

CL2 C3H6 C3H5CL HCL C3H6CL2 C3H4CL2

Total Liquid Component Rate

CL2 C3H6 C3H5CL HCL C3H6CL2 C3H4CL2 Liqud Molar Rate Liquid Cp Liquid Molecular Weight Liquid Mole Fraction Liquid Molar Enthalpy
Liquid Composition

kg-mol / hr kcal/kg-C fraction kcal / kg-mol fraction

CL2 C3H6 C3H5CL HCL

C3H6CL2 C3H4CL2
Liquid Component Rate

N/A N/A kg-mol / hr N/A N/A N/A N/A N/A N/A N/A N/A N/A N/A N/A N/A N/A N/A N/A N/A N/A N/A N/A N/A N/A N/A kg-mol / hr N/A N/A N/A N/A N/A N/A N/A N/A N/A N/A N/A N/A N/A N/A N/A N/A N/A kg-mol / hr N/A N/A N/A N/A N/A N/A

CL2 C3H6 C3H5CL HCL C3H6CL2 C3H4CL2 Decant Water Mole Rate Decant Water Moleculat Weight Water Mole Fraction Decant Water Molar Enthalpy Decant Water Cp Liquid1 Mole Rate Liquid1 Mole Frac Liquid1 Molecular Weight Liquid1 Molar Enthalpy Liquid1 Cp
Liquid1 Composition

kg-mol / hr fraction kcal / kg-mol kcal/kg-C kg-mol / hr fraction kcal / kg-mol kcal/kg-C fraction

CL2 C3H6 C3H5CL HCL C3H6CL2 C3H4CL2

Liquid1 Component Rate

CL2 C3H6 C3H5CL HCL C3H6CL2 C3H4CL2 Liquid2 Mole Rate Liquid2 Mole Frac Liquid2 Molecular Weight Liquid2 Molar Enthalpy Liquid1 Cp
Liquid2 Composition

kg-mol / hr fraction kcal / kg-mol kcal/kg-C fraction

CL2 C3H6 C3H5CL HCL C3H6CL2 C3H4CL2

Liquid2 Component Rate

CL2 C3H6 C3H5CL HCL C3H6CL2 C3H4CL2

S2

S3

S2 S2 Vapor SRK01 115 8154.12136 26 7 70.90540314 66.63824658 0.124767845 115 0 0 0 0 0 1 0 0 0

S3 S3 Vapor SRK01 205.2291124 12362.18639 425 5 60.23602717 201.9480055 0.322820986 6.544912878 37.52827913 6.717467045 98.68419954 9.770887577 45.98336624 0.031890762 0.182860408 0.03273155 0.480848932

0 0 115 8154.12136 70.90540314 1 66.63824658 0.124767845 1 0 0 0 0 0 115 0 0 0 0 0 0 0 N/A 0 N/A N/A N/A N/A N/A N/A N/A N/A N/A N/A N/A N/A N/A N/A N/A N/A N/A N/A N/A N/A N/A N/A N/A

0.047609657 0.224058691 205.2291124 12362.18639 60.23602717 1 201.9480055 0.322820986 0.031890762 0.182860408 0.03273155 0.480848932 0.047609657 0.224058691 6.544912878 37.52827913 6.717467045 98.68419954 9.770887577 45.98336624 0 0 N/A 0 N/A N/A N/A N/A N/A N/A N/A N/A N/A N/A N/A N/A N/A N/A N/A N/A N/A N/A N/A N/A N/A N/A N/A

N/A N/A N/A N/A N/A N/A N/A N/A N/A N/A N/A N/A N/A N/A N/A N/A N/A N/A N/A N/A N/A N/A N/A N/A N/A N/A N/A N/A N/A N/A N/A N/A N/A N/A N/A N/A N/A N/A N/A N/A N/A N/A N/A N/A N/A N/A N/A

N/A N/A N/A N/A N/A N/A N/A N/A N/A N/A N/A N/A N/A N/A N/A N/A N/A N/A N/A N/A N/A N/A N/A N/A N/A N/A N/A N/A N/A N/A N/A N/A N/A N/A N/A N/A N/A N/A N/A N/A N/A N/A N/A N/A N/A N/A N/A