


                                     +
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             +     + + +   + + +   + + +   + + +   + + +     +
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             +     + + +   + + +   + + +   + + +   + + +     +
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                   + + +   + + +   + + +   + + +   + + +
                   + + +   + + +   + + +   + + +   + + +
                     +       +     + + +     +       +
                                   + + +
                                   + + +
                                   + + +
 ASPENTECH                         + + +
                                   + + +
 FLOWSHEET SIMULATION              + + +
 FOR THE PROCESS INDUSTRIES        + + +
                                     +


                                                                        TM
 AAAAA   SSSSS   PPPPP   EEEEE   NN    N   PPPPP   L       U   U   SSSSS
 A   A   S       P   P   E       N N   N   P   P   L       U   U   S    
 AAAAA   SSSSS   PPPPP   EEEEE   N   N N   PPPPP   L       U   U   SSSSS
 A   A       S   P       E       N    NN   P       L       U   U       S
 A   A   SSSSS   P       EEEEE   N     N   P       LLLLL   UUUUU   SSSSS

 ASPEN PLUS IS A TRADEMARK OF           HOTLINE:
 ASPEN TECHNOLOGY, INC.                 U.S.A. 888/996-7001
 TEN CANAL PARK                         EUROPE (32) 2/724-0100
 CAMBRIDGE, MASSACHUSETTS 02141                             
 617/949-1000

 PLATFORM: WIN32                                         NOVEMBER 13, 2016   
 VERSION: 11.1   Build 192                               SUNDAY      
 INSTALLATION: TEAM_EAT                                  11:27:36 A.M.       

 THIS COPY OF ASPEN PLUS LICENSED TO                                 


      ASPEN PLUS (R) IS A PROPRIETARY PRODUCT OF ASPEN TECHNOLOGY, INC.
      (ASPENTECH), AND MAY BE USED ONLY UNDER AGREEMENT WITH ASPENTECH.
      RESTRICTED RIGHTS LEGEND:  USE, REPRODUCTION, OR DISCLOSURE BY THE
      U.S. GOVERNMENT IS SUBJECT TO RESTRICTIONS SET FORTH IN 
      (i) FAR 52.227-14, Alt. III, (ii) FAR 52.227-19, (iii) DFARS 
      252.227-7013(c)(1)(ii), or (iv) THE ACCOMPANYING LICENSE AGREEMENT,
      AS APPLICABLE. FOR PURPOSES OF THE FAR, THIS SOFTWARE SHALL BE DEEMED
      TO BE "UNPUBLISHED" AND LICENSED WITH DISCLOSURE PROHIBITIONS.
      CONTRACTOR/SUBCONTRACTOR: ASPEN TECHNOLOGY, INC. TEN CANAL PARK,
      CAMBRIDGE, MA 02141.
 *** INPUT SUMMARY ***

 >>CURRENT RUN

   ORIGINAL RUN                           NOVEMBER 13, 2016   
   11:27:36 A.M.                          SUNDAY      
   INPUT FILE: _0437fpq.inm                                                                    
   RUN ID : _0437fpq
     1    ;
     2    ;Input file created by Aspen Plus Rel. 11.1 at 11:27:36 Sun Nov 13, 2016
     3    ;Directory C:\Program Files (x86)\AspenTech\Working Folders\Aspen Plus 11.1  Runid REACTOR SIMULATION 1
     4    ;
     5
     6
     7
     8    TITLE 'bz plz'
     9
    10    IN-UNITS ENG
    11
    12    DEF-STREAMS CONVEN ALL
    13
    14    ACCOUNT-INFO ACCOUNT=1 PROJECT-ID=1 PROJECT-NAME="1"  &
    15            USER-NAME="1"
    16
    17    DESCRIPTION "
    18        General Simulation with English Units :
    19        F, psi, lb/hr, lbmol/hr, Btu/hr, cuft/hr.
    20
    21        Property Method: None
    22
    23        Flow basis for input: Mole
    24
    25        Stream report composition: Mole flow
    26        "
    27
    28    DATABANKS PURE11  / AQUEOUS  / SOLIDS  / INORGANIC  /  &
    29            NOASPENPCD
    30
    31    PROP-SOURCES PURE11  / AQUEOUS  / SOLIDS  / INORGANIC
    32
    33    COMPONENTS
    34        C6H6 C6H6 /
    35        C12H10 C12H10 /
    36        H2 H2 /
    37        C18H14 C18H14-2
    38
    39    FLOWSHEET
    40        BLOCK PLUG IN=FEED OUT=PRODUCT
    41
    42    PROPERTIES SYSOP0
    43
    44    STREAM FEED
    45        SUBSTREAM MIXED TEMP=1400. PRES=14.69595 MOLE-FLOW=0.0682
    46        MOLE-FRAC C6H6 1. / C12H10 0. / H2 0. / C18H14 0.
    47
    48    BLOCK PLUG RPLUG
    49        PARAM TYPE=T-SPEC LENGTH=37.5 <in> DIAM=0.5 <in>
    50        REACTIONS RXN-IDS=R-1
    51
    52    EO-CONV-OPTI
    53
    54    STREAM-REPOR NOMOLEFLOW MOLEFRAC
    55
    56    REACTIONS R-1 POWERLAW
    57        REAC-DATA 1 PHASE=V
    58        REAC-DATA 2 PHASE=V
    59        REAC-DATA 3 PHASE=V
    60        REAC-DATA 4 PHASE=V
    61        RATE-CON 1 PRE-EXP=3.235E-006 ACT-ENERGY=30190. <cal/mol>
    62        RATE-CON 2 PRE-EXP=1.0205 ACT-ENERGY=301090. <cal/mol>
    63        RATE-CON 3 PRE-EXP=3.7545E-006 ACT-ENERGY=30190.
    64        RATE-CON 4 PRE-EXP=7.9544 ACT-ENERGY=30190.
    65        STOIC 1 MIXED C6H6 -1. / C12H10 0.5 / H2 0.5
    66        STOIC 2 MIXED C12H10 -0.5 / H2 -0.5 / C6H6 1.
    67        STOIC 3 MIXED C6H6 -1. / C12H10 -1. / C18H14 1. / H2  &
    68            1.
    69        STOIC 4 MIXED C18H14 -1. / H2 -1. / C6H6 1. / C12H10  &
    70            1.
    71        POWLAW-EXP 1 MIXED C6H6 2.
    72        POWLAW-EXP 2 MIXED C12H10 1. / MIXED H2 1.
    73    ;
    74    ;
    75    ;
    76    ;
    77    ;
 *** INPUT TRANSLATOR MESSAGES ***


      INFORMATION WHILE CHECKING INPUT SPECIFICATIONS                           
      BLOCK NAME: PLUG    MODEL NAME: RPLUG                    (ZURE04.21)      
      THE REACTOR TYPE IS "SPECIFIED TEMPERATURE" AND NO TEMPERATURE            
      IS GIVEN WITH A "T-SPEC" SENTENCE. THE REACTOR TEMPERATURE                
      WILL BE SET TO THE (MIXED) INLET TEMPERATURE.                             
 
 

 PDF updated                                                                      TIME =      1.20

 *** CALCULATION TRACE ***

 BZ PLZ                                                          

 *** FLOWSHEET ANALYSIS MESSAGES ***

 FLOWSHEET CONNECTIVITY BY STREAMS       

   STREAM     SOURCE     DEST           STREAM     SOURCE     DEST
   FEED       ----       PLUG           PRODUCT    PLUG       ----    

 FLOWSHEET CONNECTIVITY BY BLOCKS        

   BLOCK        INLETS                         OUTLETS
   PLUG         FEED                           PRODUCT                     

      COMPUTATION ORDER FOR THE FLOWSHEET IS:
      PLUG 

Calculations begin                                                              time      0.09


 SIMULATION CALCULATIONS BEGIN                                                    TIME =      0.09

      ENTHALPY CALCULATION FOR INLET STREAM FEED OF BLOCK PLUG                    TIME =      0.09
      KODE = 2  NTRIAL =   1  T =  1033.15  P =  0.1013E+06  V =   1.000      Q =  0.0000E+00

      UOS BLOCK PLUG     MODEL: RPLUG                                             TIME =      0.15

  *   WARNING WHILE EXECUTING UNIT OPERATIONS BLOCK: "PLUG" (MODEL: "RPLUG")    
                                                               (RXNERR.3)       
      AT Z =   0.95250E-02 :                                                    
      REACTION RATE IS GREATER THAN ZERO FOR REACTION (3) BUT                   
      REACTANT "C12H10" IS NOT PRESENT.  POSSIBLE CAUSE:                        
      ZEROTH ORDER REACTANT NOT PRESENT.  RATE IS SET TO ZERO.                  

  *   WARNING WHILE EXECUTING UNIT OPERATIONS BLOCK: "PLUG" (MODEL: "RPLUG")    
                                                               (RXNERR.3)       
      AT Z =   0.95250E-02 :                                                    
      REACTION RATE IS GREATER THAN ZERO FOR REACTION (4) BUT                   
      REACTANT "H2" IS NOT PRESENT.  POSSIBLE CAUSE:                            
      ZEROTH ORDER REACTANT NOT PRESENT.  RATE IS SET TO ZERO.                  

  *   WARNING WHILE EXECUTING UNIT OPERATIONS BLOCK: "PLUG" (MODEL: "RPLUG")    
                                                               (RXNERR.3)       
      AT Z =   0.10478     :                                                    
      REACTION RATE IS GREATER THAN ZERO FOR REACTION (3) BUT                   
      REACTANT "C12H10" IS NOT PRESENT.  POSSIBLE CAUSE:                        
      ZEROTH ORDER REACTANT NOT PRESENT.  RATE IS SET TO ZERO.                  

  *   WARNING WHILE EXECUTING UNIT OPERATIONS BLOCK: "PLUG" (MODEL: "RPLUG")    
                                                               (RXNERR.3)       
      AT Z =   0.10478     :                                                    
      REACTION RATE IS GREATER THAN ZERO FOR REACTION (4) BUT                   
      REACTANT "H2" IS NOT PRESENT.  POSSIBLE CAUSE:                            
      ZEROTH ORDER REACTANT NOT PRESENT.  RATE IS SET TO ZERO.                  

  *   WARNING WHILE EXECUTING UNIT OPERATIONS BLOCK: "PLUG" (MODEL: "RPLUG")    
                                                               (RXNERR.3)       
      AT Z =    1.0573     :                                                    
      REACTION RATE IS GREATER THAN ZERO FOR REACTION (3) BUT                   
      REACTANT "C12H10" IS NOT PRESENT.  POSSIBLE CAUSE:                        
      ZEROTH ORDER REACTANT NOT PRESENT.  RATE IS SET TO ZERO.                  

  *   WARNING WHILE EXECUTING UNIT OPERATIONS BLOCK: "PLUG" (MODEL: "RPLUG")    
                                                               (RXNERR.3)       
      AT Z =    1.0573     :                                                    
      REACTION RATE IS GREATER THAN ZERO FOR REACTION (4) BUT                   
      REACTANT "H2" IS NOT PRESENT.  POSSIBLE CAUSE:                            
      ZEROTH ORDER REACTANT NOT PRESENT.  RATE IS SET TO ZERO.                  
        AT REACTOR EXIT :
        LENGTH =  0.95250      DIAMETER =  0.12700E-01  RESIDENCE TIME =  0.16563    
        PROCESS STREAM T =    1033.2     P =   0.10133E+06 H =    1745.3     V =    1.0000    


*** INPUT SPECIFICATION MESSAGES ***

 BLOCK        PLUG     IS GENERATED BECAUSE OF OTHER CHANGES 11/13/2016   11:35:17:99 
 BLOCK PLUG RPLUG
     PARAM TYPE=T-SPEC LENGTH=37.5 <IN> DIAM=0.5 <IN>
     REACTIONS RXN-IDS=R-1

 CHANGES WERE MADE TO REACTIONS    R-1      11/13/2016   11:35:17:99 
 ;
 ;Input file created by Aspen Plus Rel. 11.1 at 11:35:15 Sun Nov 13, 2016
 ;Directory C:\Program Files (x86)\AspenTech\Working Folders\Aspen Plus 11.1  Runid REACTOR SIMULATION 1
 ;
 
 
 
 REACTIONS R-1 POWERLAW
     REAC-DATA 1 PHASE=V
     REAC-DATA 2 PHASE=V
     REAC-DATA 3 PHASE=V
     REAC-DATA 4 PHASE=V
     RATE-CON 1 PRE-EXP=3.235E-006 ACT-ENERGY=30190. <cal/mol>
     RATE-CON 2 PRE-EXP=1.0205E-006 ACT-ENERGY=301090. <cal/mol>
     RATE-CON 3 PRE-EXP=3.7545E-006 ACT-ENERGY=30190. <cal/mol>
     RATE-CON 4 PRE-EXP=7.9544E-006 ACT-ENERGY=30190. <cal/mol>
     STOIC 1 MIXED C6H6 -1. / C12H10 0.5 / H2 0.5
     STOIC 2 MIXED C12H10 -0.5 / H2 -0.5 / C6H6 1.
     STOIC 3 MIXED C6H6 -0.5 / C12H10 -0.5 / C18H14 1. /  &
         H2 1.
     STOIC 4 MIXED C18H14 -0.5 / H2 -0.5 / C6H6 1. /  &
         C12H10 1.
     POWLAW-EXP 1 MIXED C6H6 2.
     POWLAW-EXP 2 MIXED C12H10 1. / MIXED H2 1.
     POWLAW-EXP 3 MIXED C6H6 1. / MIXED C12H10 1.
     POWLAW-EXP 4 MIXED C18H14 1. / MIXED H2 1.

 PDF updated                                                                      TIME =    460.19
 THIS COPY OF ASPEN PLUS LICENSED TO                                 

  **  ERROR IN A "REACTIONS" PARAGRAPH                                          
      FIRST ID: R-1    SECOND ID: POWERLAW                     (RXMBCK.1)       
      REACTION NUMBER     3 IN REACTION R-1      DOES NOT SATISFY MASS          
      BALANCE. THE ABSOLUTE ERROR IS   116.16                                   
      CHECK STOICHIOMETRY/MOLECULAR WEIGHTS.                                    

  **  ERROR IN A "REACTIONS" PARAGRAPH                                          
      FIRST ID: R-1    SECOND ID: POWERLAW                     (RXMBCK.1)       
      REACTION NUMBER     4 IN REACTION R-1      DOES NOT SATISFY MASS          
      BALANCE. THE ABSOLUTE ERROR IS   116.16                                   
      CHECK STOICHIOMETRY/MOLECULAR WEIGHTS.                                    

      INFORMATION WHILE CHECKING INPUT SPECIFICATIONS                           
      BLOCK NAME: PLUG    MODEL NAME: RPLUG                    (ZURE04.21)      
      THE REACTOR TYPE IS "SPECIFIED TEMPERATURE" AND NO TEMPERATURE            
      IS GIVEN WITH A "T-SPEC" SENTENCE. THE REACTOR TEMPERATURE                
      WILL BE SET TO THE (MIXED) INLET TEMPERATURE.                             


*** INPUT SPECIFICATION MESSAGES ***

 BLOCK        PLUG     IS GENERATED BECAUSE OF OTHER CHANGES 11/13/2016   11:38:14:04 
 BLOCK PLUG RPLUG
     PARAM TYPE=T-SPEC LENGTH=37.5 <IN> DIAM=0.5 <IN>
     REACTIONS RXN-IDS=R-1

 CHANGES WERE MADE TO REACTIONS    R-1      11/13/2016   11:38:14:04 
 ;
 ;Input file created by Aspen Plus Rel. 11.1 at 11:38:12 Sun Nov 13, 2016
 ;Directory C:\Program Files (x86)\AspenTech\Working Folders\Aspen Plus 11.1  Runid REACTOR SIMULATION 1
 ;
 
 
 
 REACTIONS R-1 POWERLAW
     REAC-DATA 1 PHASE=V
     REAC-DATA 2 PHASE=V
     REAC-DATA 3 PHASE=V
     REAC-DATA 4 PHASE=V
     RATE-CON 1 PRE-EXP=3.235E-006 ACT-ENERGY=30190. <cal/mol>
     RATE-CON 2 PRE-EXP=1.0205E-006 ACT-ENERGY=301090. <cal/mol>
     RATE-CON 3 PRE-EXP=3.7545E-006 ACT-ENERGY=30190. <cal/mol>
     RATE-CON 4 PRE-EXP=7.9544E-006 ACT-ENERGY=30190. <cal/mol>
     STOIC 1 MIXED C6H6 -1. / C12H10 0.5 / H2 0.5
     STOIC 2 MIXED C12H10 -0.5 / H2 -0.5 / C6H6 1.
     STOIC 3 MIXED C6H6 -1. / C12H10 -1. / C18H14 1. / H2  &
         1.
     STOIC 4 MIXED C18H14 -1. / H2 -1. / C6H6 1. / C12H10  &
         1.
     POWLAW-EXP 1 MIXED C6H6 2.
     POWLAW-EXP 2 MIXED C12H10 1. / MIXED H2 1.

 PDF updated                                                                      TIME =    636.21
 THIS COPY OF ASPEN PLUS LICENSED TO                                 

      INFORMATION WHILE CHECKING INPUT SPECIFICATIONS                           
      BLOCK NAME: PLUG    MODEL NAME: RPLUG                    (ZURE04.21)      
      THE REACTOR TYPE IS "SPECIFIED TEMPERATURE" AND NO TEMPERATURE            
      IS GIVEN WITH A "T-SPEC" SENTENCE. THE REACTOR TEMPERATURE                
      WILL BE SET TO THE (MIXED) INLET TEMPERATURE.                             
 
 


Calculations begin                                                              time    638.28


      UOS BLOCK PLUG     MODEL: RPLUG                                             TIME =    638.28
        AT REACTOR EXIT :
        LENGTH =  0.95250      DIAMETER =  0.12700E-01  RESIDENCE TIME =  0.16563    
        PROCESS STREAM T =    1033.2     P =   0.10133E+06 H =    1745.3     V =    1.0000    


*** INPUT SPECIFICATION MESSAGES ***

 BLOCK        PLUG     IS GENERATED BECAUSE OF OTHER CHANGES 11/13/2016   11:39:22:78 
 BLOCK PLUG RPLUG
     PARAM TYPE=T-SPEC LENGTH=37.5 <IN> DIAM=0.5 <IN>
     REACTIONS RXN-IDS=R-1

 CHANGES WERE MADE TO REACTIONS    R-1      11/13/2016   11:39:22:78 
 ;
 ;Input file created by Aspen Plus Rel. 11.1 at 11:39:20 Sun Nov 13, 2016
 ;Directory C:\Program Files (x86)\AspenTech\Working Folders\Aspen Plus 11.1  Runid REACTOR SIMULATION 1
 ;
 
 
 
 REACTIONS R-1 POWERLAW
     REAC-DATA 1 PHASE=V CBASIS=MOLARITY
     REAC-DATA 2 PHASE=V
     REAC-DATA 3 PHASE=V
     REAC-DATA 4 PHASE=V
     RATE-CON 1 PRE-EXP=3.235E-006 ACT-ENERGY=30190. <cal/mol>
     RATE-CON 2 PRE-EXP=1.0205E-006 ACT-ENERGY=301090. <cal/mol>
     RATE-CON 3 PRE-EXP=3.7545E-006 ACT-ENERGY=30190. <cal/mol>
     RATE-CON 4 PRE-EXP=7.9544E-006 ACT-ENERGY=30190. <cal/mol>
     STOIC 1 MIXED C6H6 -1. / C12H10 0.5 / H2 0.5
     STOIC 2 MIXED C12H10 -0.5 / H2 -0.5 / C6H6 1.
     STOIC 3 MIXED C6H6 -1. / C12H10 -1. / C18H14 1. / H2  &
         1.
     STOIC 4 MIXED C18H14 -1. / H2 -1. / C6H6 1. / C12H10  &
         1.
     POWLAW-EXP 1 MIXED C6H6 2.
     POWLAW-EXP 2 MIXED C12H10 1. / MIXED H2 1.

 PDF updated                                                                      TIME =    704.93
 THIS COPY OF ASPEN PLUS LICENSED TO                                 

      INFORMATION WHILE CHECKING INPUT SPECIFICATIONS                           
      BLOCK NAME: PLUG    MODEL NAME: RPLUG                    (ZURE04.21)      
      THE REACTOR TYPE IS "SPECIFIED TEMPERATURE" AND NO TEMPERATURE            
      IS GIVEN WITH A "T-SPEC" SENTENCE. THE REACTOR TEMPERATURE                
      WILL BE SET TO THE (MIXED) INLET TEMPERATURE.                             
 
 


Calculations begin                                                              time    707.00


      UOS BLOCK PLUG     MODEL: RPLUG                                             TIME =    707.00
        AT REACTOR EXIT :
        LENGTH =  0.95250      DIAMETER =  0.12700E-01  RESIDENCE TIME =  0.16563    
        PROCESS STREAM T =    1033.2     P =   0.10133E+06 H =    1745.3     V =    1.0000    

 Report Writer entered                                                            Time =   1009.17

 Results generated                                                                Time =   1009.22

 Report Writer entered                                                            Time =   1009.28

 Results generated                                                                Time =   1009.28

RUN SAVED



 *** SUMMARY OF ERRORS ***

                  PHYSICAL
                  PROPERTY  SYSTEM  SIMULATION
 TERMINAL ERRORS      0        0         0
   SEVERE ERRORS      0        0         0
          ERRORS      0        0         0
        WARNINGS      0        0         6


 *** SUMMARY OF ERRORS ***

                  PHYSICAL
                  PROPERTY  SYSTEM  SIMULATION
 TERMINAL ERRORS      0        0         0
   SEVERE ERRORS      0        0         0
          ERRORS      0        0         0
        WARNINGS      0        0         6

 Report Writer entered                                                            Time =   1307.14

 Results generated                                                                Time =   1307.15

 Report Writer entered                                                            Time =   1307.19

 Results generated                                                                Time =   1307.20

RUN SAVED



 *** SUMMARY OF ERRORS ***

                  PHYSICAL
                  PROPERTY  SYSTEM  SIMULATION
 TERMINAL ERRORS      0        0         0
   SEVERE ERRORS      0        0         0
          ERRORS      0        0         0
        WARNINGS      0        0         6
