Приложение в. Результаты расчета реактора Гиббса

$ Generated by PRO/II Keyword Generation System <version 8.3>

$ Generated on: Thu Dec 04 15:20:32 2014

TITLE

PRINT STREAM=ALL, RATE=M,WT, FRACTION=M,WT, PERCENT=M,WT

DIMENSION SI, TEMP=C, STDTEMP=0, STDPRES=101.325

SEQUENCE SIMSCI

CALCULATION RVPBASIS=APIN, TVP=37.778

COMPONENT DATA

LIBID 1,22PR/2,IPENTANE/3,PENTANE/4,22MB/5,23MB/6,2MP/7,3MP/ &

8,HEXANE, BANK=SIMSCI,PROCESS

ASSAY CONVERSION=API94, CURVEFIT=CURRENT, KVRECONCILE=TAILS

THERMODYNAMIC DATA

METHOD SYSTEM=SRKM, SET=SRKM01, DEFAULT

STREAM DATA

PROPERTY STREAM=S1, TEMPERATURE=170, PRESSURE=3100, PHASE=M, &

COMPOSITION(WT,KG/H)=1,6/2,450/3,6320/4,650/5,510/6,2200/ &

7,1300/8,7200

RXDATA

RXSET ID=ISOMER_C5-C6

REACTION ID=1

STOICHIOMETRY 6,1/8,-1

REACTION ID=2

STOICHIOMETRY 7,1/8,-1

REACTION ID=3

STOICHIOMETRY 4,1/8,-1

REACTION ID=4

STOICHIOMETRY 5,1/8,-1

REACTION ID=5

STOICHIOMETRY 2,1/3,-1

REACTION ID=6

STOICHIOMETRY 1,1/3,-1

UNIT OPERATIONS

GIBBS UID=R1

FEED S1

PRODUCT M=S2

OPERATION PHASE=M, DP=50, ADIABATIC

ELEMENTS REACTANTS= 1/2/3/4/5/6/7/8

RXSTOIC RXSET=ISOMER_C5-C6

REACTION 1

REACTION 2

REACTION 3

REACTION 4

REACTION 5

REACTION 6

END

SIMULATION SCIENCES INC. R PAGE R-1

PROJECT PRO/II VERSION 8.3 ELEC V7.0

PROBLEM INPUT

THERMODYNAMIC DATA

==============================================================================

SRK SIMSCI PURE COMPONENT DATA

COMP CRITICAL CRITICAL ALPHA C1 C2 C3

TEMPERATURE PRESSURE TYPE

DEG C KPA

---- ---------- ---------- ----- ---------- ---------- ----------

1 160.63 3199.00 6 0.0737 0.9045 5.2823

2 187.28 3381.00 6 0.1883 0.8677 2.9845

3 196.55 3370.00 6 0.5316 0.8700 1.4810

4 215.63 3081.00 6 0.3067 0.8562 2.1437

5 226.83 3127.00 6 0.2695 0.8545 2.3891

6 224.35 3010.00 6 0.2838 0.8475 2.3909

7 231.28 3124.00 6 0.3080 0.8508 2.2697

8 234.45 3025.00 6 0.1581 0.8728 3.8442

SRK SIMSCI INTERACTION PARAMETERS

KIJ = A(I,J) + B(I,J)/T + C(I,J)/T**2

ALL PAIRS HAVE BEEN DEFAULTED TO IDEAL

SIMULATION SCIENCES INC. R PAGE R-1

PROJECT PRO/II VERSION 8.3 ELEC V7.0

PROBLEM INPUT

THERMODYNAMIC DATA

==============================================================================

THERMODYNAMIC SETS USED FOR EACH UNIT OPERATION

DEFAULT METHOD IS SRKM01

THERMODYNAMIC SET UNIT OPERATIONS

----------------- ---------------

SRKM01 R1

UNIT IDENTIFIER UNIT OPERATION THERMODYNAMIC SET

--------------- -------------- -----------------

R1 GIBBS REACTOR SRKM01

SIMULATION SCIENCES INC. R PAGE R-2

PROJECT PRO/II VERSION 8.3 ELEC V7.0

PROBLEM INPUT

THERMODYNAMIC DATA

==============================================================================

THERMODYNAMIC METHODS USED FOR EACH SET

THERMODYNAMIC SET SRKM01 (DEFAULT)

PROPERTY METHOD

-------- ------

KVALUE(VLE) SRK-MODIFIED-PANAGIOTOPOULOS-REID

KVALUE(LLE) UNSPECIFIED

KVALUE(SLE) UNSPECIFIED

LIQUID ENTHALPY SRK-MODIFIED-PANAGIOTOPOULOS-REID

VAPOR ENTHALPY SRK-MODIFIED-PANAGIOTOPOULOS-REID

LIQUID DENSITY API

VAPOR DENSITY SRK-MODIFIED-PANAGIOTOPOULOS-REID

LIQUID ENTROPY SRK-MODIFIED-PANAGIOTOPOULOS-REID

VAPOR ENTROPY SRK-MODIFIED-PANAGIOTOPOULOS-REID

LIQUID VISCOSITY IDEAL

VAPOR VISCOSITY IDEAL

LIQUID CONDUCTIVITY IDEAL

VAPOR CONDUCTIVITY IDEAL

SURFACE TENSION IDEAL

LIQUID DIFFUSIVITY UNSPECIFIED

SIMULATION SCIENCES INC. R PAGE H-1

PROJECT PRO/II VERSION 8.3 ELEC V7.0

PROBLEM CALCULATION

HISTORY 12/04/14

==============================================================================

*** PROBLEM SOLUTION BEGINS

FEED FLASH COMPLETE

UNIT 1 SOLVED - 'R1 '

*** PROBLEM SOLUTION REACHED

*** THIS RUN USED 11.41 PRO/II SIMULATION UNITS

*** RUN STATISTICS

STARTED 15:20:27 12/04/14 NO ERRORS

FINISHED 15:20:27 12/04/14 NO WARNINGS

RUN TIMES NO MESSAGES

INTERACTIVE 0 MIN, 0.00 SEC

CALCULATIONS 0 MIN, 0.06 SEC

TOTAL 0 MIN, 0.06 SEC

SIMULATION SCIENCES INC. R PAGE I-1

PROJECT PRO/II VERSION 8.3 ELEC V7.0

PROBLEM OUTPUT

INDEX 12/04/14

==============================================================================

PAGE CONTENTS

------ ----------------------------------------------------------------

1 COMPONENT DATA

2 CALCULATION SEQUENCE AND RECYCLES

2 SEQUENCE MAP

3 PLANT MATERIAL BALANCE

GIBBS REACTOR SUMMARY

4 UNIT 1, 'R1'

5 STREAM MOLAR COMPONENT RATES

6 STREAM MOLAR COMPONENT FRACTIONS

7 STREAM MOLAR COMPONENT PERCENTS

8 STREAM WEIGHT COMPONENT RATES

9 STREAM WEIGHT COMPONENT FRACTIONS

10 STREAM WEIGHT COMPONENT PERCENTS

11 STREAM SUMMARY

SIMULATION SCIENCES INC. R PAGE P-1

PROJECT PRO/II VERSION 8.3 ELEC V7.0

PROBLEM OUTPUT

COMPONENT DATA 12/04/14

==============================================================================

COMPONENT COMP. TYPE PHASE MOL. WEIGHT DENSITY

KG/M3

--------------------- ----------- ----------- ----------- -----------

1 22PR LIBRARY VAP/LIQ/SOL 72.150 596.729

2 IPENTANE LIBRARY VAP/LIQ/SOL 72.150 625.850

3 PENTANE LIBRARY VAP/LIQ/SOL 72.150 631.126

4 22MB LIBRARY VAP/LIQ/SOL 86.177 653.234

5 23MB LIBRARY VAP/LIQ/SOL 86.177 665.521

6 2MP LIBRARY VAP/LIQ/SOL 86.177 657.054

7 3MP LIBRARY VAP/LIQ/SOL 86.177 668.608

8 HEXANE LIBRARY VAP/LIQ/SOL 86.177 664.452

COMPONENT NBP CRIT. TEMP. CRIT. PRES. CRIT. VOLM.

C C KPA M3/KG-MOL

--------------------- ----------- ----------- ----------- -----------

1 22PR 9.500 160.630 3199.000 0.3036

2 IPENTANE 27.844 187.280 3381.000 0.3058

3 PENTANE 36.070 196.550 3370.000 0.3130

4 22MB 49.730 215.630 3081.000 0.3590

5 23MB 57.980 226.830 3127.000 0.3578

6 2MP 60.260 224.350 3010.000 0.3664

7 3MP 63.270 231.280 3124.000 0.3664

8 HEXANE 68.730 234.450 3025.000 0.3710

COMPONENT ACEN. FACT. HEAT FORM. G FORM. GLASS TEMP.

KJ/KG-MOL KJ/KG-MOL C

--------------------- ----------- ----------- ----------- -----------

1 22PR 0.19636 -168070.00 -17140.00 MISSING

2 IPENTANE 0.22746 -153700.00 -14050.00 MISSING

3 PENTANE 0.25151 -146760.00 -8813.00 MISSING

4 22MB 0.23497 -184680.00 -8745.00 MISSING

5 23MB 0.24610 -176800.00 -3125.00 MISSING

6 2MP 0.27744 -174550.00 -5338.00 MISSING

7 3MP 0.27373 -172000.00 -3420.00 MISSING

8 HEXANE 0.30126 -166940.00 -66.34 MISSING

COMPONENT DATABANK(S) USED

--------------------- ---------------------

1 22PR SIMSCI

2 IPENTANE SIMSCI

3 PENTANE SIMSCI

4 22MB

5 23MB

6 2MP SIMSCI

7 3MP

8 HEXANE SIMSCI

SIMULATION SCIENCES INC. R PAGE P-2

PROJECT PRO/II VERSION 8.3 ELEC V7.0

PROBLEM OUTPUT

CALCULATION SEQUENCE AND RECYCLES 12/04/14

==============================================================================

CALCULATION SEQUENCE

SEQ UNIT ID UNIT TYPE

--- ------------ ----------

1 R1 GIBBS

SEQUENCE MAP

SEQ DESCRIPTION

---- -----------------------------------------

1 GIBBS 'R1'

SIMULATION SCIENCES INC. R PAGE P-3

PROJECT PRO/II VERSION 8.3 ELEC V7.0

PROBLEM OUTPUT

PLANT MATERIAL BALANCE 12/04/14

==============================================================================

FEED STREAMS: S1

PRODUCT STREAMS: S2

OVERALL PLANT MOLAR BALANCE

---------------- KG-MOL/HR ---------------- PERCENT

COMPONENT FEED +REACTION -PRODUCT =DEVIATION DEV

--------------------- ---------- ---------- ---------- ---------- -------

1 22PR 0.083 20.294 20.377 0.000 0.00

2 IPENTANE 6.237 48.073 54.310 0.000 0.00

3 PENTANE 87.595 -68.367 19.228 0.000 0.00

4 22MB 7.543 28.388 35.930 0.000 0.00

5 23MB 5.918 6.537 12.455 0.000 0.00

6 2MP 25.529 17.764 43.293 0.000 0.00

7 3MP 15.085 14.083 29.168 0.000 0.00

8 HEXANE 83.549 -66.772 16.777 0.000 0.00

TOTAL 231.539 0.000 231.539 0.000 0.00

OVERALL PLANT MASS BALANCE

------------------ KG/HR ------------------ PERCENT

COMPONENT FEED +REACTION -PRODUCT =DEVIATION DEV

--------------------- ---------- ---------- ---------- ---------- -------

1 22PR 6.00 1464.24 1470.24 0.00 0.00

2 IPENTANE 450.00 3468.45 3918.45 0.00 0.00

3 PENTANE 6320.00 -4932.69 1387.31 0.00 0.00

4 22MB 650.00 2446.36 3096.36 0.00 0.00

5 23MB 510.00 563.34 1073.34 0.00 0.00

6 2MP 2200.00 1530.88 3730.88 0.00 0.00

7 3MP 1300.00 1213.62 2513.62 0.00 0.00

8 HEXANE 7200.00 -5754.21 1445.79 0.00 0.00

TOTAL 18636.00 0.00 18636.00 0.00 0.00

SIMULATION SCIENCES INC. R PAGE P-4

PROJECT PRO/II VERSION 8.3 ELEC V7.0

PROBLEM OUTPUT

GIBBS REACTOR SUMMARY 12/04/14

==============================================================================

UNIT 1, 'R1'

OPERATING CONDITIONS

REACTOR TYPE ADIABATIC

DUTY, M*KJ/HR -5.982E-10

TOTAL HEAT OF REACTION AT 25.00 C, M*KJ/HR -1.5406

MINIMUM GIBBS FREE ENERGY (G/RT), /HR 4602.7945

INLET OUTLET

----------- -----------

FEED S1

LIQUID PRODUCT S2

TEMPERATURE, C 170.00 188.05

PRESSURE, KPA 3100.0000 3050.0000

REACTION DATA

--------- RATES, KG-MOL/HR ---------- FRACTION

COMPONENT FEED CHANGE PRODUCT CONVERTED

------------------ ----------- ----------- ----------- -----------

1 22PR 0.0832 20.2943 20.3775

2 IPENTANE 6.2370 48.0726 54.3096

3 PENTANE 87.5949 -68.3669 19.2280 0.7805

4 22MB 7.5426 28.3876 35.9302

5 23MB 5.9180 6.5371 12.4551

6 2MP 25.5288 17.7643 43.2931

7 3MP 15.0852 14.0829 29.1681

8 HEXANE 83.5488 -66.7718 16.7770 0.7992

TOTAL 231.5386 0.0000 231.5386

REACTOR MASS BALANCE

----------- Rates, KG/HR ------------ Fraction

Component Feed Change Product Converted

-------------------- ----------- ----------- ----------- -----------

1 22PR 6.0000 1464.2397 1470.2397

2 IPENTANE 450.0000 3468.4540 3918.4540

3 PENTANE 6320.0000 -4932.6937 1387.3063 0.7805

4 22MB 650.0000 2446.3625 3096.3625

5 23MB 510.0000 563.3444 1073.3444

6 2MP 2200.0000 1530.8757 3730.8757

7 3MP 1300.0000 1213.6232 2513.6232

8 HEXANE 7200.0000 -5754.2058 1445.7942 0.7992

TOTAL 18636.0000 0.0000 18636.0000

SIMULATION SCIENCES INC. R PAGE P-5

PROJECT PRO/II VERSION 8.3 ELEC V7.0

PROBLEM OUTPUT

STREAM MOLAR COMPONENT RATES 12/04/14

==============================================================================

STREAM ID S1 S2

NAME

PHASE LIQUID LIQUID

THERMO ID SRKM01 SRKM01

FLUID RATES, KG-MOL/HR

1 22PR 0.0832 20.3775

2 IPENTANE 6.2370 54.3096

3 PENTANE 87.5949 19.2280

4 22MB 7.5426 35.9302

5 23MB 5.9180 12.4551

6 2MP 25.5288 43.2931

7 3MP 15.0852 29.1681

8 HEXANE 83.5488 16.7770

TOTAL RATE, KG-MOL/HR 231.5386 231.5386

TEMPERATURE, C 170.0000 188.0511

PRESSURE, KPA 3100.0000 3050.0000

ENTHALPY, M*KJ/HR 8.2662 9.4899

MOLECULAR WEIGHT 80.4877 80.4877

MOLE FRAC VAPOR 0.0000 0.0000

MOLE FRAC LIQUID 1.0000 1.0000

SIMULATION SCIENCES INC. R PAGE P-6

PROJECT PRO/II VERSION 8.3 ELEC V7.0

PROBLEM OUTPUT

STREAM MOLAR COMPONENT FRACTIONS 12/04/14

==============================================================================

STREAM ID S1 S2

NAME

PHASE LIQUID LIQUID

THERMO ID SRKM01 SRKM01

FLUID MOLAR FRACTIONS

1 22PR 3.5916E-04 0.0880

2 IPENTANE 0.0269 0.2346

3 PENTANE 0.3783 0.0830

4 22MB 0.0326 0.1552

5 23MB 0.0256 0.0538

6 2MP 0.1103 0.1870

7 3MP 0.0652 0.1260

8 HEXANE 0.3608 0.0725

TOTAL RATE, KG-MOL/HR 231.5386 231.5386

TEMPERATURE, C 170.0000 188.0511

PRESSURE, KPA 3100.0000 3050.0000

ENTHALPY, M*KJ/HR 8.2662 9.4899

MOLECULAR WEIGHT 80.4877 80.4877

MOLE FRAC VAPOR 0.0000 0.0000

MOLE FRAC LIQUID 1.0000 1.0000

SIMULATION SCIENCES INC. R PAGE P-7

PROJECT PRO/II VERSION 8.3 ELEC V7.0

PROBLEM OUTPUT

STREAM MOLAR COMPONENT PERCENTS 12/04/14

==============================================================================

STREAM ID S1 S2

NAME

PHASE LIQUID LIQUID

THERMO ID SRKM01 SRKM01

FLUID MOLAR PERCENTS

1 22PR 0.0359 8.8009

2 IPENTANE 2.6937 23.4560

3 PENTANE 37.8317 8.3045

4 22MB 3.2576 15.5180

5 23MB 2.5560 5.3793

6 2MP 11.0257 18.6980

7 3MP 6.5152 12.5975

8 HEXANE 36.0842 7.2459

TOTAL RATE, KG-MOL/HR 231.5386 231.5386

TEMPERATURE, C 170.0000 188.0511

PRESSURE, KPA 3100.0000 3050.0000

ENTHALPY, M*KJ/HR 8.2662 9.4899

MOLECULAR WEIGHT 80.4877 80.4877

MOLE FRAC VAPOR 0.0000 0.0000

MOLE FRAC LIQUID 1.0000 1.0000

SIMULATION SCIENCES INC. R PAGE P-8

PROJECT PRO/II VERSION 8.3 ELEC V7.0

PROBLEM OUTPUT

STREAM WEIGHT COMPONENT RATES 12/04/14

==============================================================================

STREAM ID S1 S2

NAME

PHASE LIQUID LIQUID

THERMO ID SRKM01 SRKM01

FLUID RATES, KG/HR

1 22PR 6.0000 1470.2397

2 IPENTANE 450.0000 3918.4540

3 PENTANE 6320.0000 1387.3063

4 22MB 650.0000 3096.3625

5 23MB 510.0000 1073.3444

6 2MP 2200.0000 3730.8757

7 3MP 1300.0000 2513.6232

8 HEXANE 7200.0000 1445.7942

TOTAL RATE, KG/HR 18636.0000 18636.0000

TEMPERATURE, C 170.0000 188.0511

PRESSURE, KPA 3100.0000 3050.0000

ENTHALPY, M*KJ/HR 8.2662 9.4899

MOLECULAR WEIGHT 80.4877 80.4877

WEIGHT FRAC VAPOR 0.0000 0.0000

WEIGHT FRAC LIQUID 1.0000 1.0000

SIMULATION SCIENCES INC. R PAGE P-9

PROJECT PRO/II VERSION 8.3 ELEC V7.0

PROBLEM OUTPUT

STREAM WEIGHT COMPONENT FRACTIONS 12/04/14

==============================================================================

STREAM ID S1 S2

NAME

PHASE LIQUID LIQUID

THERMO ID SRKM01 SRKM01

FLUID WEIGHT FRACTIONS

1 22PR 3.2196E-04 0.0789

2 IPENTANE 0.0241 0.2103

3 PENTANE 0.3391 0.0744

4 22MB 0.0349 0.1661

5 23MB 0.0274 0.0576

6 2MP 0.1181 0.2002

7 3MP 0.0698 0.1349

8 HEXANE 0.3863 0.0776

TOTAL RATE, KG/HR 18636.0000 18636.0000

TEMPERATURE, C 170.0000 188.0511

PRESSURE, KPA 3100.0000 3050.0000

ENTHALPY, M*KJ/HR 8.2662 9.4899

MOLECULAR WEIGHT 80.4877 80.4877

WEIGHT FRAC VAPOR 0.0000 0.0000

WEIGHT FRAC LIQUID 1.0000 1.0000

SIMULATION SCIENCES INC. R PAGE P-10

PROJECT PRO/II VERSION 8.3 ELEC V7.0

PROBLEM OUTPUT

STREAM WEIGHT COMPONENT PERCENTS 12/04/14

==============================================================================

STREAM ID S1 S2

NAME

PHASE LIQUID LIQUID

THERMO ID SRKM01 SRKM01

FLUID WEIGHT PERCENTS

1 22PR 0.0322 7.8892

2 IPENTANE 2.4147 21.0263

3 PENTANE 33.9129 7.4442

4 22MB 3.4879 16.6150

5 23MB 2.7366 5.7595

6 2MP 11.8051 20.0197

7 3MP 6.9757 13.4880

8 HEXANE 38.6349 7.7581

TOTAL RATE, KG/HR 18636.0000 18636.0000

TEMPERATURE, C 170.0000 188.0511

PRESSURE, KPA 3100.0000 3050.0000

ENTHALPY, M*KJ/HR 8.2662 9.4899

MOLECULAR WEIGHT 80.4877 80.4877

WEIGHT FRAC VAPOR 0.0000 0.0000

WEIGHT FRAC LIQUID 1.0000 1.0000

SIMULATION SCIENCES INC. R PAGE P-11

PROJECT PRO/II VERSION 8.3 ELEC V7.0

PROBLEM OUTPUT

STREAM SUMMARY 12/04/14

==============================================================================

STREAM ID S1 S2

NAME

PHASE LIQUID LIQUID

THERMO ID SRKM01 SRKM01

----- TOTAL STREAM -----

RATE, KG-MOL/HR 231.539 231.539

K*KG/HR 18.636 18.636

STD LIQ RATE, M3/HR 28.633 28.889

TEMPERATURE, C 170.000 188.051

PRESSURE, KPA 3100.000 3050.000

MOLECULAR WEIGHT 80.488 80.488

ENTHALPY, M*KJ/HR 8.266 9.490

KJ/KG 443.559 509.224

MOLE FRACTION LIQUID 1.0000 1.0000

REDUCED TEMP (KAYS RULE) 0.9047 0.9583

PRES (KAYS RULE) 0.9766 0.9602

ACENTRIC FACTOR 0.2724 0.2494

WATSON K (UOPK) 12.862 12.873

STD LIQ DENSITY, KG/M3 650.859 645.080

SPECIFIC GRAVITY 0.6515 0.6457

API GRAVITY 85.690 87.636

-------- VAPOR ---------

RATE, KG-MOL/HR N/A N/A

K*KG/HR N/A N/A

K*M3/HR N/A N/A

NORM VAP RATE(1), K*M3/HR N/A N/A

SPECIFIC GRAVITY (AIR=1.0) N/A N/A

MOLECULAR WEIGHT N/A N/A

ENTHALPY, KJ/KG N/A N/A

CP, KJ/KG-C N/A N/A

DENSITY, KG/K*M3 N/A N/A

Z (FROM DENSITY) N/A N/A

TH COND, W/M-K N/A N/A

VISCOSITY, PAS N/A N/A

KVIS (VISC/DENS), CSTOKE N/A N/A

(1) NORMAL VAPOR VOLUME IS 22.414 M3/KG-MOLE (273.15 K AND 1 ATM)

SIMULATION SCIENCES INC. R PAGE P-12

PROJECT PRO/II VERSION 8.3 ELEC V7.0

PROBLEM OUTPUT

STREAM SUMMARY 12/04/14

==============================================================================

STREAM ID S1 S2

NAME

PHASE LIQUID LIQUID

THERMO ID SRKM01 SRKM01

-------- LIQUID --------

RATE, KG-MOL/HR 231.539 231.539

K*KG/HR 18.636 18.636

M3/HR 39.392 43.641

GAL/MIN 173.435 192.145

STD LIQ RATE, M3/HR 28.633 28.889

SPECIFIC GRAVITY (H2O=1.0) 0.6515 0.6457

MOLECULAR WEIGHT 80.488 80.488

ENTHALPY, KJ/KG 443.559 509.224

CP, KJ/KG-C 3.279 3.980

DENSITY, KG/M3 473.097 427.031

Z (FROM DENSITY) 0.1431 0.1499

SURFACE TENSION, N/M 2.9365E-03 1.3400E-03

THERMAL COND, W/M-K 0.07947 0.08629

VISCOSITY, PAS 1.00795E-04 8.62298E-05

KVIS (VISC/DENS), CSTOKE 0.2131 0.2019