Date and time of run 15-JAN-2007 11:11:59 > 20070115110339 MTDATA 4.74 2004-11-18 12:00, LOG D:\MTDATA\Work\mt48.log > 20070115110339 user2 on DVF-400-* using D:\MTDATA\DVF\mtdata.exe > 20070115111156 MODULE 3 creates MPI file D:\MTDATA\Work\def.mpi > 20070115111159 MODULE 3 reads MPI file D:\MTDATA\Work\def.mpi > 20070115111159 MODULE 3 creates MPR file D:\MTDATA\Work\def.mpr $(Number of lines of title) 8 * DATAFILE = D:\MTDATA\Work\def.mpi - CREATED 11:11:56 15-JAN-2007 * SYSTEM = C,Mn,Ni,Fe, * NUMBER OF PHASES = 23 * NUMBER OF SPECIES = 81 * DATA FILE = D:\MTDATA\Work\def.mpi *** PROBLEM settings *** SYSTEM ELEMENTS : CFeMnNi NUMBER COMPONENT STATUS AMOUNT DELTA REF.P 1 C NORMAL 10.4321 2 Mn #PARA! 41.2647 3 Ni #PARA! 85.5342 4 Fe # TO BAL 1657.88 NUMBER PHASE STATUS MODEL 1 DIAMOND_A4 absent PURE SUBSTANCE 2 GRAPHITE absent PURE SUBSTANCE 3 LIQUID absent REDLICH-KISTER 4 BCC_A2 NORMAL SUBLATTICE 5 CBCC_A12 absent SUBLATTICE 6 CEMENTITE absent SUBLATTICE 7 CUB_A13 absent SUBLATTICE 8 FCC_A1 1 M-G SUBLATTICE 9 FE4N absent SUBLATTICE 10 FECN_CHI absent PURE SUBSTANCE 11 HCP_A3 absent SUBLATTICE 12 KSI_CARBIDE absent PURE SUBSTANCE 13 M3C2 absent SUBLATTICE 14 M5C2 absent SUBLATTICE 15 M7C3 absent SUBLATTICE 16 V3C2 absent SUBLATTICE 17 M23C6 absent SUBLATTICE 18 AL5FE4 absent REDLICH-KISTER 19 ORTHORHOMBIC_A20 absent PURE SUBSTANCE 20 TETRAGONAL_U absent PURE SUBSTANCE 21 LAVES_C14 absent SUBLATTICE 22 LAVES_C15 absent SUBLATTICE 23 BCC_B2 absent CHEMICAL ORDERING(C) NUMBER SUBSTANCE STATUS/CONSTRAINT 1 C NORMAL 2 C NORMAL 3 C NORMAL 4 Fe NORMAL 5 Mn NORMAL 6 Ni NORMAL 7 Fe:1 NORMAL 8 Mn:1 NORMAL 9 Ni:1 NORMAL 10 C:2 NORMAL 11 Va:2 NORMAL 12 Fe:1 NORMAL 13 Mn:1 NORMAL 14 Ni:1 NORMAL 15 C:2 NORMAL 16 Va:2 NORMAL 17 Fe:1 NORMAL 18 Mn:1 NORMAL 19 Ni:1 NORMAL 20 C:2 NORMAL 21 Fe:1 NORMAL 22 Mn:1 NORMAL 23 Ni:1 NORMAL 24 C:2 NORMAL 25 Va:2 NORMAL 26 Fe:1 NORMAL 27 Mn:1 NORMAL 28 Ni:1 NORMAL 29 C:2 NORMAL 30 Va:2 NORMAL 31 Fe:1 NORMAL 32 Mn:1 NORMAL 33 Ni:1 NORMAL 34 C:2 NORMAL 35 Va:2 NORMAL 36 Fe5C2 NORMAL 37 Fe:1 NORMAL 38 Mn:1 NORMAL 39 Ni:1 NORMAL 40 C:2 NORMAL 41 Va:2 NORMAL 42 Fe3C NORMAL 43 Fe:1 NORMAL 44 Mn:1 NORMAL 45 C:2 NORMAL 46 Fe:1 NORMAL 47 Mn:1 NORMAL 48 C:2 NORMAL 49 Fe:1 NORMAL 50 Mn:1 NORMAL 51 Ni:1 NORMAL 52 C:2 NORMAL 53 Fe:1 NORMAL 54 Mn:1 NORMAL 55 C:2 NORMAL 56 Fe:1 NORMAL 57 Mn:1 NORMAL 58 Ni:1 NORMAL 59 Fe:2 NORMAL 60 Mn:2 NORMAL 61 Ni:2 NORMAL 62 C:3 NORMAL 63 Fe NORMAL 64 Mn NORMAL 65 Fe NORMAL 66 Fe NORMAL 67 Fe:1 NORMAL 68 Mn:1 NORMAL 69 Ni:1 NORMAL 70 Fe:2 NORMAL 71 Mn:2 NORMAL 72 Ni:2 NORMAL 73 Fe:1 NORMAL 74 Ni:1 NORMAL 75 Fe:2 NORMAL 76 Ni:2 NORMAL 77 Fe:1 NORMAL 78 Ni:1 NORMAL 79 Fe:2 NORMAL 80 Ni:2 NORMAL 81 Va:3 NORMAL UNARY SOURCE Tmin/K Tmax/K C mtsol 298.15 6000.00 C mtsol 298.15 6000.00 C mtsol 298.15 6000.00 Fe mtsol 298.15 6000.00 Mn mtsol 298.15 2000.00 Ni mtsol 298.15 3000.00 Fe:C mtsol 298.15 6000.00 Fe:Va mtsol 298.15 6000.00 Mn:C mtsol 298.15 2000.00 Mn:Va mtsol 298.15 2000.00 Ni:C mtsol 298.15 3000.00 Ni:Va mtsol 298.15 3000.00 Fe:C mtsol 298.15 6000.00 Fe:Va mtsol 298.15 6000.00 Mn:C mtsol 298.15 2000.00 Mn:Va mtsol 298.15 2000.00 Ni:C NODATA 298.15 298.00 Ni:Va mtsol 298.15 3000.00 Fe:C mtsol 298.15 6000.00 Mn:C mtsol 298.15 2000.00 Ni:C mtsol 298.15 3000.00 Fe:C mtsol 298.15 6000.00 Fe:Va mtsol 298.15 6000.00 Mn:C mtsol 298.15 2000.00 Mn:Va mtsol 298.15 2000.00 Ni:C NODATA 298.15 298.00 Ni:Va mtsol 298.15 3000.00 Fe:C mtsol 298.15 6000.00 Fe:Va mtsol 298.15 6000.00 Mn:C mtsol 298.15 2000.00 Mn:Va mtsol 298.15 2000.00 Ni:C mtsol 298.15 3000.00 Ni:Va mtsol 298.15 3000.00 Fe:C mtsol 298.15 6000.00 Fe:Va mtsol 298.15 6000.00 Mn:C NODATA 298.15 298.00 Mn:Va mtsol 298.15 2000.00 Ni:C NODATA 298.15 298.00 Ni:Va mtsol 298.15 3000.00 Fe5C2 mtsol 298.15 6000.00 Fe:C mtsol 298.15 6000.00 Fe:Va mtsol 298.15 6000.00 Mn:C mtsol 298.15 2000.00 Mn:Va mtsol 298.15 2000.00 Ni:C mtsol 298.15 3000.00 Ni:Va mtsol 298.15 3000.00 Fe3C mtsol 298.15 6000.00 Fe:C mtsol 298.15 6000.00 Mn:C mtsol 298.15 6000.00 Fe:C mtsol 298.15 6000.00 Mn:C mtsol 298.15 2000.00 Fe:C mtsol 298.15 6000.00 Mn:C mtsol 298.15 2000.00 Ni:C mtsol 298.15 3000.00 Fe:C mtsol 298.15 6000.00 Mn:C mtsol 298.15 6000.00 Fe:Fe:C mtsol 298.15 6000.00 Fe:Mn:C mtsol 298.15 2000.00 Fe:Ni:C mtsol 298.15 3000.00 Mn:Fe:C mtsol 298.15 2000.00 Mn:Mn:C mtsol 298.15 2000.00 Mn:Ni:C NODATA 298.15 298.00 Ni:Fe:C mtsol 298.15 3000.00 Ni:Mn:C NODATA 298.15 298.00 Ni:Ni:C mtsol 298.15 3000.00 Fe mtsol 298.15 6000.00 Mn mtsol 298.15 6000.00 Fe mtsol 298.15 6000.00 Fe mtsol 298.15 6000.00 Fe:Fe mtsol 298.15 6000.00 Fe:Mn NODATA 298.15 298.00 Fe:Ni NODATA 298.15 298.00 Mn:Fe NODATA 298.15 298.00 Mn:Mn mtsol 298.15 2000.00 Mn:Ni NODATA 298.15 298.00 Ni:Fe NODATA 298.15 298.00 Ni:Mn NODATA 298.15 298.00 Ni:Ni mtsol 298.15 3000.00 Fe:Fe mtsol 298.15 6000.00 Fe:Ni NODATA 298.15 298.00 Ni:Fe NODATA 298.15 298.00 Ni:Ni mtsol 298.15 3000.00 Fe:Fe:Va mtsol 298.15 6000.00 Fe:Ni:Va NODATA 298.15 298.00 Ni:Fe:Va NODATA 298.15 298.00 Ni:Ni:Va mtsol 298.15 3000.00 TEMPERATURE : 993.1500 PRESSURE/Pa : 101325.0 VOLUME/m3 : undefined SYSTEM AMOUNT/mol : undefined COMP. AMOUNTS/mol : 10.43210 41.26470 85.53416 1657.881 SYSTEM MASS/kg : 100.0000 COMP. MASSES/kg : 0.1253000 2.267000 5.020000 92.58770 STEPPED VARIABLE INITIAL, FINAL AND STEP VALUES OF VARIABLE TEMPERATURE 993.150 to 573.150 by -20.0000 Stage 1* only requested *** MULTIPHASE - Stage 1* Results *** Temperature = 993.1500 K Fixed pressure = 1.013250E+05 Pa, 1.000000E+00 atm Component Ref.Phase Chem.Pot. Activity Amount/mol Mass/kg C undef undef 1.043210E+01 1.253000E-01 Mn undef undef 4.126470E+01 2.267000E+00 Ni undef undef 8.553416E+01 5.020000E+00 Fe undef undef 1.657881E+03 9.258770E+01 Total 1.795112E+03 1.000000E+02 Amount Phase Mole fraction of component within phase compnt moles C Mn Ni 1.7951E+03 FCC_A1 0.0058114 0.0229873 0.0476484 Fe 1.7951E+03 FCC_A1 0.9235530 Gibbs Energy = -7.9766105259E+07 J System Enthalpy = 4.9690200561E+07 J *** PROBLEM settings *** Changes only listed under components/phases/substances NUMBER COMPONENT STATUS AMOUNT DELTA REF.P NUMBER PHASE STATUS MODEL NUMBER SUBSTANCE STATUS/CONSTRAINT TEMPERATURE : 973.1500 PRESSURE/Pa : 101325.0 VOLUME/m3 : undefined SYSTEM AMOUNT/mol : undefined COMP. AMOUNTS/mol : 10.43210 41.26470 85.53416 1657.881 SYSTEM MASS/kg : 100.0000 COMP. MASSES/kg : 0.1253000 2.267000 5.020000 92.58770 STEPPED VARIABLE INITIAL, FINAL AND STEP VALUES OF VARIABLE TEMPERATURE 993.150 to 573.150 by -20.0000 *** MULTIPHASE - Stage 1* Results *** Temperature = 973.1500 K Fixed pressure = 1.013250E+05 Pa, 1.000000E+00 atm Component Ref.Phase Chem.Pot. Activity Amount/mol Mass/kg C undef undef 1.043210E+01 1.253000E-01 Mn undef undef 4.126470E+01 2.267000E+00 Ni undef undef 8.553416E+01 5.020000E+00 Fe undef undef 1.657881E+03 9.258770E+01 Total 1.795112E+03 1.000000E+02 Amount Phase Mole fraction of component within phase compnt moles C Mn Ni 1.2345E+02 BCC_A2 0.0001094 0.0074939 0.0155335 1.6717E+03 FCC_A1 0.0062325 0.0241314 0.0500201 Fe 1.2345E+02 BCC_A2 0.9768632 1.6717E+03 FCC_A1 0.9196160 Gibbs Energy = -7.7172213259E+07 J System Enthalpy = 4.8080913175E+07 J *** PROBLEM settings *** Changes only listed under components/phases/substances NUMBER COMPONENT STATUS AMOUNT DELTA REF.P NUMBER PHASE STATUS MODEL NUMBER SUBSTANCE STATUS/CONSTRAINT TEMPERATURE : 953.1500 PRESSURE/Pa : 101325.0 VOLUME/m3 : undefined SYSTEM AMOUNT/mol : undefined COMP. AMOUNTS/mol : 10.43210 41.26470 85.53416 1657.881 SYSTEM MASS/kg : 100.0000 COMP. MASSES/kg : 0.1253000 2.267000 5.020000 92.58770 STEPPED VARIABLE INITIAL, FINAL AND STEP VALUES OF VARIABLE TEMPERATURE 993.150 to 573.150 by -20.0000 *** MULTIPHASE - Stage 1* Results *** Temperature = 953.1500 K Fixed pressure = 1.013250E+05 Pa, 1.000000E+00 atm Component Ref.Phase Chem.Pot. Activity Amount/mol Mass/kg C undef undef 1.043210E+01 1.253000E-01 Mn undef undef 4.126470E+01 2.267000E+00 Ni undef undef 8.553416E+01 5.020000E+00 Fe undef undef 1.657881E+03 9.258770E+01 Total 1.795112E+03 1.000000E+02 Amount Phase Mole fraction of component within phase compnt moles C Mn Ni 4.7259E+02 BCC_A2 0.0001220 0.0079789 0.0165387 1.3225E+03 FCC_A1 0.0078444 0.0283503 0.0587649 Fe 4.7259E+02 BCC_A2 0.9753605 1.3225E+03 FCC_A1 0.9050404 Gibbs Energy = -7.4625211489E+07 J System Enthalpy = 4.5484180323E+07 J *** PROBLEM settings *** Changes only listed under components/phases/substances NUMBER COMPONENT STATUS AMOUNT DELTA REF.P NUMBER PHASE STATUS MODEL NUMBER SUBSTANCE STATUS/CONSTRAINT TEMPERATURE : 933.1500 PRESSURE/Pa : 101325.0 VOLUME/m3 : undefined SYSTEM AMOUNT/mol : undefined COMP. AMOUNTS/mol : 10.43210 41.26470 85.53416 1657.881 SYSTEM MASS/kg : 100.0000 COMP. MASSES/kg : 0.1253000 2.267000 5.020000 92.58770 STEPPED VARIABLE INITIAL, FINAL AND STEP VALUES OF VARIABLE TEMPERATURE 993.150 to 573.150 by -20.0000 *** MULTIPHASE - Stage 1* Results *** Temperature = 933.1500 K Fixed pressure = 1.013250E+05 Pa, 1.000000E+00 atm Component Ref.Phase Chem.Pot. Activity Amount/mol Mass/kg C undef undef 1.043210E+01 1.253000E-01 Mn undef undef 4.126470E+01 2.267000E+00 Ni undef undef 8.553416E+01 5.020000E+00 Fe undef undef 1.657881E+03 9.258770E+01 Total 1.795112E+03 1.000000E+02 Amount Phase Mole fraction of component within phase compnt moles C Mn Ni 7.3056E+02 BCC_A2 0.0001338 0.0083830 0.0173764 1.0645E+03 FCC_A1 0.0097077 0.0330096 0.0684229 Fe 7.3056E+02 BCC_A2 0.9741067 1.0645E+03 FCC_A1 0.8888597 Gibbs Energy = -7.2130816601E+07 J System Enthalpy = 4.3064203775E+07 J *** PROBLEM settings *** Changes only listed under components/phases/substances NUMBER COMPONENT STATUS AMOUNT DELTA REF.P NUMBER PHASE STATUS MODEL NUMBER SUBSTANCE STATUS/CONSTRAINT TEMPERATURE : 913.1500 PRESSURE/Pa : 101325.0 VOLUME/m3 : undefined SYSTEM AMOUNT/mol : undefined COMP. AMOUNTS/mol : 10.43210 41.26470 85.53416 1657.881 SYSTEM MASS/kg : 100.0000 COMP. MASSES/kg : 0.1253000 2.267000 5.020000 92.58770 STEPPED VARIABLE INITIAL, FINAL AND STEP VALUES OF VARIABLE TEMPERATURE 993.150 to 573.150 by -20.0000 *** MULTIPHASE - Stage 1* Results *** Temperature = 913.1500 K Fixed pressure = 1.013250E+05 Pa, 1.000000E+00 atm Component Ref.Phase Chem.Pot. Activity Amount/mol Mass/kg C undef undef 1.043210E+01 1.253000E-01 Mn undef undef 4.126470E+01 2.267000E+00 Ni undef undef 8.553416E+01 5.020000E+00 Fe undef undef 1.657881E+03 9.258770E+01 Total 1.795112E+03 1.000000E+02 Amount Phase Mole fraction of component within phase compnt moles C Mn Ni 9.2365E+02 BCC_A2 0.0001446 0.0086947 0.0180224 8.7147E+02 FCC_A1 0.0118175 0.0381356 0.0790481 Fe 9.2365E+02 BCC_A2 0.9731383 8.7147E+02 FCC_A1 0.8709987 Gibbs Energy = -6.9686519443E+07 J System Enthalpy = 4.0805134682E+07 J *** PROBLEM settings *** Changes only listed under components/phases/substances NUMBER COMPONENT STATUS AMOUNT DELTA REF.P NUMBER PHASE STATUS MODEL NUMBER SUBSTANCE STATUS/CONSTRAINT TEMPERATURE : 893.1500 PRESSURE/Pa : 101325.0 VOLUME/m3 : undefined SYSTEM AMOUNT/mol : undefined COMP. AMOUNTS/mol : 10.43210 41.26470 85.53416 1657.881 SYSTEM MASS/kg : 100.0000 COMP. MASSES/kg : 0.1253000 2.267000 5.020000 92.58770 STEPPED VARIABLE INITIAL, FINAL AND STEP VALUES OF VARIABLE TEMPERATURE 993.150 to 573.150 by -20.0000 *** MULTIPHASE - Stage 1* Results *** Temperature = 893.1500 K Fixed pressure = 1.013250E+05 Pa, 1.000000E+00 atm Component Ref.Phase Chem.Pot. Activity Amount/mol Mass/kg C undef undef 1.043210E+01 1.253000E-01 Mn undef undef 4.126470E+01 2.267000E+00 Ni undef undef 8.553416E+01 5.020000E+00 Fe undef undef 1.657881E+03 9.258770E+01 Total 1.795112E+03 1.000000E+02 Amount Phase Mole fraction of component within phase compnt moles C Mn Ni 1.0701E+03 BCC_A2 0.0001540 0.0089065 0.0184615 7.2499E+02 FCC_A1 0.0141621 0.0437713 0.0907298 Fe 1.0701E+03 BCC_A2 0.9724780 7.2499E+02 FCC_A1 0.8513369 Gibbs Energy = -6.7290127692E+07 J System Enthalpy = 3.8685347260E+07 J *** PROBLEM settings *** Changes only listed under components/phases/substances NUMBER COMPONENT STATUS AMOUNT DELTA REF.P NUMBER PHASE STATUS MODEL NUMBER SUBSTANCE STATUS/CONSTRAINT TEMPERATURE : 873.1500 PRESSURE/Pa : 101325.0 VOLUME/m3 : undefined SYSTEM AMOUNT/mol : undefined COMP. AMOUNTS/mol : 10.43210 41.26470 85.53416 1657.881 SYSTEM MASS/kg : 100.0000 COMP. MASSES/kg : 0.1253000 2.267000 5.020000 92.58770 STEPPED VARIABLE INITIAL, FINAL AND STEP VALUES OF VARIABLE TEMPERATURE 993.150 to 573.150 by -20.0000 *** MULTIPHASE - Stage 1* Results *** Temperature = 873.1500 K Fixed pressure = 1.013250E+05 Pa, 1.000000E+00 atm Component Ref.Phase Chem.Pot. Activity Amount/mol Mass/kg C undef undef 1.043210E+01 1.253000E-01 Mn undef undef 4.126470E+01 2.267000E+00 Ni undef undef 8.553416E+01 5.020000E+00 Fe undef undef 1.657881E+03 9.258770E+01 Total 1.795112E+03 1.000000E+02 Amount Phase Mole fraction of component within phase compnt moles C Mn Ni 1.1828E+03 BCC_A2 0.0001618 0.0090145 0.0186853 6.1233E+02 FCC_A1 0.0167242 0.0499773 0.1035937 Fe 1.1828E+03 BCC_A2 0.9721384 6.1233E+02 FCC_A1 0.8297048 Gibbs Energy = -6.4939841646E+07 J System Enthalpy = 3.6683210863E+07 J *** PROBLEM settings *** Changes only listed under components/phases/substances NUMBER COMPONENT STATUS AMOUNT DELTA REF.P NUMBER PHASE STATUS MODEL NUMBER SUBSTANCE STATUS/CONSTRAINT TEMPERATURE : 853.1500 PRESSURE/Pa : 101325.0 VOLUME/m3 : undefined SYSTEM AMOUNT/mol : undefined COMP. AMOUNTS/mol : 10.43210 41.26470 85.53416 1657.881 SYSTEM MASS/kg : 100.0000 COMP. MASSES/kg : 0.1253000 2.267000 5.020000 92.58770 STEPPED VARIABLE INITIAL, FINAL AND STEP VALUES OF VARIABLE TEMPERATURE 993.150 to 573.150 by -20.0000 *** MULTIPHASE - Stage 1* Results *** Temperature = 853.1500 K Fixed pressure = 1.013250E+05 Pa, 1.000000E+00 atm Component Ref.Phase Chem.Pot. Activity Amount/mol Mass/kg C undef undef 1.043210E+01 1.253000E-01 Mn undef undef 4.126470E+01 2.267000E+00 Ni undef undef 8.553416E+01 5.020000E+00 Fe undef undef 1.657881E+03 9.258770E+01 Total 1.795112E+03 1.000000E+02 Amount Phase Mole fraction of component within phase compnt moles C Mn Ni 1.2706E+03 BCC_A2 0.0001680 0.0090172 0.0186910 5.2448E+02 FCC_A1 0.0194834 0.0568322 0.1178027 Fe 1.2706E+03 BCC_A2 0.9721237 5.2448E+02 FCC_A1 0.8058817 Gibbs Energy = -6.2634252034E+07 J System Enthalpy = 3.4779258362E+07 J *** PROBLEM settings *** Changes only listed under components/phases/substances NUMBER COMPONENT STATUS AMOUNT DELTA REF.P NUMBER PHASE STATUS MODEL NUMBER SUBSTANCE STATUS/CONSTRAINT TEMPERATURE : 833.1500 PRESSURE/Pa : 101325.0 VOLUME/m3 : undefined SYSTEM AMOUNT/mol : undefined COMP. AMOUNTS/mol : 10.43210 41.26470 85.53416 1657.881 SYSTEM MASS/kg : 100.0000 COMP. MASSES/kg : 0.1253000 2.267000 5.020000 92.58770 STEPPED VARIABLE INITIAL, FINAL AND STEP VALUES OF VARIABLE TEMPERATURE 993.150 to 573.150 by -20.0000 *** MULTIPHASE - Stage 1* Results *** Temperature = 833.1500 K Fixed pressure = 1.013250E+05 Pa, 1.000000E+00 atm Component Ref.Phase Chem.Pot. Activity Amount/mol Mass/kg C undef undef 1.043210E+01 1.253000E-01 Mn undef undef 4.126470E+01 2.267000E+00 Ni undef undef 8.553416E+01 5.020000E+00 Fe undef undef 1.657881E+03 9.258770E+01 Total 1.795112E+03 1.000000E+02 Amount Phase Mole fraction of component within phase compnt moles C Mn Ni 1.3401E+03 BCC_A2 0.0001727 0.0089157 0.0184806 4.5502E+02 FCC_A1 0.0224181 0.0644301 0.1335518 Fe 1.3401E+03 BCC_A2 0.9724310 4.5502E+02 FCC_A1 0.7796000 Gibbs Energy = -6.0372306866E+07 J System Enthalpy = 3.2956854971E+07 J *** PROBLEM settings *** Changes only listed under components/phases/substances NUMBER COMPONENT STATUS AMOUNT DELTA REF.P NUMBER PHASE STATUS MODEL NUMBER SUBSTANCE STATUS/CONSTRAINT TEMPERATURE : 813.1500 PRESSURE/Pa : 101325.0 VOLUME/m3 : undefined SYSTEM AMOUNT/mol : undefined COMP. AMOUNTS/mol : 10.43210 41.26470 85.53416 1657.881 SYSTEM MASS/kg : 100.0000 COMP. MASSES/kg : 0.1253000 2.267000 5.020000 92.58770 STEPPED VARIABLE INITIAL, FINAL AND STEP VALUES OF VARIABLE TEMPERATURE 993.150 to 573.150 by -20.0000 *** MULTIPHASE - Stage 1* Results *** Temperature = 813.1500 K Fixed pressure = 1.013250E+05 Pa, 1.000000E+00 atm Component Ref.Phase Chem.Pot. Activity Amount/mol Mass/kg C undef undef 1.043210E+01 1.253000E-01 Mn undef undef 4.126470E+01 2.267000E+00 Ni undef undef 8.553416E+01 5.020000E+00 Fe undef undef 1.657881E+03 9.258770E+01 Total 1.795112E+03 1.000000E+02 Amount Phase Mole fraction of component within phase compnt moles C Mn Ni 1.3958E+03 BCC_A2 0.0001760 0.0087134 0.0180612 3.9936E+02 FCC_A1 0.0255072 0.0728748 0.1510561 Fe 1.3958E+03 BCC_A2 0.9730494 3.9936E+02 FCC_A1 0.7505620 Gibbs Energy = -5.8153268048E+07 J System Enthalpy = 3.1202271140E+07 J *** PROBLEM settings *** Changes only listed under components/phases/substances NUMBER COMPONENT STATUS AMOUNT DELTA REF.P NUMBER PHASE STATUS MODEL NUMBER SUBSTANCE STATUS/CONSTRAINT TEMPERATURE : 793.1500 PRESSURE/Pa : 101325.0 VOLUME/m3 : undefined SYSTEM AMOUNT/mol : undefined COMP. AMOUNTS/mol : 10.43210 41.26470 85.53416 1657.881 SYSTEM MASS/kg : 100.0000 COMP. MASSES/kg : 0.1253000 2.267000 5.020000 92.58770 STEPPED VARIABLE INITIAL, FINAL AND STEP VALUES OF VARIABLE TEMPERATURE 993.150 to 573.150 by -20.0000 *** MULTIPHASE - Stage 1* Results *** Temperature = 793.1500 K Fixed pressure = 1.013250E+05 Pa, 1.000000E+00 atm Component Ref.Phase Chem.Pot. Activity Amount/mol Mass/kg C undef undef 1.043210E+01 1.253000E-01 Mn undef undef 4.126470E+01 2.267000E+00 Ni undef undef 8.553416E+01 5.020000E+00 Fe undef undef 1.657881E+03 9.258770E+01 Total 1.795112E+03 1.000000E+02 Amount Phase Mole fraction of component within phase compnt moles C Mn Ni 1.4409E+03 BCC_A2 0.0001779 0.0084168 0.0174465 3.5418E+02 FCC_A1 0.0287303 0.0822650 0.1705202 Fe 1.4409E+03 BCC_A2 0.9739587 3.5418E+02 FCC_A1 0.7184846 Gibbs Energy = -5.5976663140E+07 J System Enthalpy = 2.9504654111E+07 J *** PROBLEM settings *** Changes only listed under components/phases/substances NUMBER COMPONENT STATUS AMOUNT DELTA REF.P NUMBER PHASE STATUS MODEL NUMBER SUBSTANCE STATUS/CONSTRAINT TEMPERATURE : 773.1500 PRESSURE/Pa : 101325.0 VOLUME/m3 : undefined SYSTEM AMOUNT/mol : undefined COMP. AMOUNTS/mol : 10.43210 41.26470 85.53416 1657.881 SYSTEM MASS/kg : 100.0000 COMP. MASSES/kg : 0.1253000 2.267000 5.020000 92.58770 STEPPED VARIABLE INITIAL, FINAL AND STEP VALUES OF VARIABLE TEMPERATURE 993.150 to 573.150 by -20.0000 *** MULTIPHASE - Stage 1* Results *** Temperature = 773.1500 K Fixed pressure = 1.013250E+05 Pa, 1.000000E+00 atm Component Ref.Phase Chem.Pot. Activity Amount/mol Mass/kg C undef undef 1.043210E+01 1.253000E-01 Mn undef undef 4.126470E+01 2.267000E+00 Ni undef undef 8.553416E+01 5.020000E+00 Fe undef undef 1.657881E+03 9.258770E+01 Total 1.795112E+03 1.000000E+02 Amount Phase Mole fraction of component within phase compnt moles C Mn Ni 1.4780E+03 BCC_A2 0.0001785 0.0080361 0.0166573 3.1713E+02 FCC_A1 0.0320639 0.0926679 0.1920836 Fe 1.4780E+03 BCC_A2 0.9751282 3.1713E+02 FCC_A1 0.6831846 Gibbs Energy = -5.3842232996E+07 J System Enthalpy = 2.7856034139E+07 J *** PROBLEM settings *** Changes only listed under components/phases/substances NUMBER COMPONENT STATUS AMOUNT DELTA REF.P NUMBER PHASE STATUS MODEL NUMBER SUBSTANCE STATUS/CONSTRAINT TEMPERATURE : 753.1500 PRESSURE/Pa : 101325.0 VOLUME/m3 : undefined SYSTEM AMOUNT/mol : undefined COMP. AMOUNTS/mol : 10.43210 41.26470 85.53416 1657.881 SYSTEM MASS/kg : 100.0000 COMP. MASSES/kg : 0.1253000 2.267000 5.020000 92.58770 STEPPED VARIABLE INITIAL, FINAL AND STEP VALUES OF VARIABLE TEMPERATURE 993.150 to 573.150 by -20.0000 *** MULTIPHASE - Stage 1* Results *** Temperature = 753.1500 K Fixed pressure = 1.013250E+05 Pa, 1.000000E+00 atm Component Ref.Phase Chem.Pot. Activity Amount/mol Mass/kg C undef undef 1.043210E+01 1.253000E-01 Mn undef undef 4.126470E+01 2.267000E+00 Ni undef undef 8.553416E+01 5.020000E+00 Fe undef undef 1.657881E+03 9.258770E+01 Total 1.795112E+03 1.000000E+02 Amount Phase Mole fraction of component within phase compnt moles C Mn Ni 1.5086E+03 BCC_A2 0.0001772 0.0075852 0.0157228 2.8653E+02 FCC_A1 0.0354761 0.1040804 0.2157396 Fe 1.5086E+03 BCC_A2 0.9765148 2.8653E+02 FCC_A1 0.6447039 Gibbs Energy = -5.1749873728E+07 J System Enthalpy = 2.6251314922E+07 J *** PROBLEM settings *** Changes only listed under components/phases/substances NUMBER COMPONENT STATUS AMOUNT DELTA REF.P NUMBER PHASE STATUS MODEL NUMBER SUBSTANCE STATUS/CONSTRAINT TEMPERATURE : 733.1500 PRESSURE/Pa : 101325.0 VOLUME/m3 : undefined SYSTEM AMOUNT/mol : undefined COMP. AMOUNTS/mol : 10.43210 41.26470 85.53416 1657.881 SYSTEM MASS/kg : 100.0000 COMP. MASSES/kg : 0.1253000 2.267000 5.020000 92.58770 STEPPED VARIABLE INITIAL, FINAL AND STEP VALUES OF VARIABLE TEMPERATURE 993.150 to 573.150 by -20.0000 *** MULTIPHASE - Stage 1* Results *** Temperature = 733.1500 K Fixed pressure = 1.013250E+05 Pa, 1.000000E+00 atm Component Ref.Phase Chem.Pot. Activity Amount/mol Mass/kg C undef undef 1.043210E+01 1.253000E-01 Mn undef undef 4.126470E+01 2.267000E+00 Ni undef undef 8.553416E+01 5.020000E+00 Fe undef undef 1.657881E+03 9.258770E+01 Total 1.795112E+03 1.000000E+02 Amount Phase Mole fraction of component within phase compnt moles C Mn Ni 1.5339E+03 BCC_A2 0.0001732 0.0070821 0.0146798 2.6121E+02 FCC_A1 0.0389203 0.1163869 0.2412487 Fe 1.5339E+03 BCC_A2 0.9780649 2.6121E+02 FCC_A1 0.6034442 Gibbs Energy = -4.9699574521E+07 J System Enthalpy = 2.4688080185E+07 J *** PROBLEM settings *** Changes only listed under components/phases/substances NUMBER COMPONENT STATUS AMOUNT DELTA REF.P NUMBER PHASE STATUS MODEL NUMBER SUBSTANCE STATUS/CONSTRAINT TEMPERATURE : 713.1500 PRESSURE/Pa : 101325.0 VOLUME/m3 : undefined SYSTEM AMOUNT/mol : undefined COMP. AMOUNTS/mol : 10.43210 41.26470 85.53416 1657.881 SYSTEM MASS/kg : 100.0000 COMP. MASSES/kg : 0.1253000 2.267000 5.020000 92.58770 STEPPED VARIABLE INITIAL, FINAL AND STEP VALUES OF VARIABLE TEMPERATURE 993.150 to 573.150 by -20.0000 *** MULTIPHASE - Stage 1* Results *** Temperature = 713.1500 K Fixed pressure = 1.013250E+05 Pa, 1.000000E+00 atm Component Ref.Phase Chem.Pot. Activity Amount/mol Mass/kg C undef undef 1.043210E+01 1.253000E-01 Mn undef undef 4.126470E+01 2.267000E+00 Ni undef undef 8.553416E+01 5.020000E+00 Fe undef undef 1.657881E+03 9.258770E+01 Total 1.795112E+03 1.000000E+02 Amount Phase Mole fraction of component within phase compnt moles C Mn Ni 1.5548E+03 BCC_A2 0.0001655 0.0065462 0.0135691 2.4035E+02 FCC_A1 0.0423338 0.1293412 0.2681005 Fe 1.5548E+03 BCC_A2 0.9797193 2.4035E+02 FCC_A1 0.5602245 Gibbs Energy = -4.7691360040E+07 J System Enthalpy = 2.3165927850E+07 J *** PROBLEM settings *** Changes only listed under components/phases/substances NUMBER COMPONENT STATUS AMOUNT DELTA REF.P NUMBER PHASE STATUS MODEL NUMBER SUBSTANCE STATUS/CONSTRAINT TEMPERATURE : 693.1500 PRESSURE/Pa : 101325.0 VOLUME/m3 : undefined SYSTEM AMOUNT/mol : undefined COMP. AMOUNTS/mol : 10.43210 41.26470 85.53416 1657.881 SYSTEM MASS/kg : 100.0000 COMP. MASSES/kg : 0.1253000 2.267000 5.020000 92.58770 STEPPED VARIABLE INITIAL, FINAL AND STEP VALUES OF VARIABLE TEMPERATURE 993.150 to 573.150 by -20.0000 *** MULTIPHASE - Stage 1* Results *** Temperature = 693.1500 K Fixed pressure = 1.013250E+05 Pa, 1.000000E+00 atm Component Ref.Phase Chem.Pot. Activity Amount/mol Mass/kg C undef undef 1.043210E+01 1.253000E-01 Mn undef undef 4.126470E+01 2.267000E+00 Ni undef undef 8.553416E+01 5.020000E+00 Fe undef undef 1.657881E+03 9.258770E+01 Total 1.795112E+03 1.000000E+02 Amount Phase Mole fraction of component within phase compnt moles C Mn Ni 1.5718E+03 BCC_A2 0.0001529 0.0059965 0.0124296 2.2328E+02 FCC_A1 0.0456464 0.1425992 0.2955821 Fe 1.5718E+03 BCC_A2 0.9814211 2.2328E+02 FCC_A1 0.5161723 Gibbs Energy = -4.5725252226E+07 J System Enthalpy = 2.1685334520E+07 J *** PROBLEM settings *** Changes only listed under components/phases/substances NUMBER COMPONENT STATUS AMOUNT DELTA REF.P NUMBER PHASE STATUS MODEL NUMBER SUBSTANCE STATUS/CONSTRAINT TEMPERATURE : 673.1500 PRESSURE/Pa : 101325.0 VOLUME/m3 : undefined SYSTEM AMOUNT/mol : undefined COMP. AMOUNTS/mol : 10.43210 41.26470 85.53416 1657.881 SYSTEM MASS/kg : 100.0000 COMP. MASSES/kg : 0.1253000 2.267000 5.020000 92.58770 STEPPED VARIABLE INITIAL, FINAL AND STEP VALUES OF VARIABLE TEMPERATURE 993.150 to 573.150 by -20.0000 *** MULTIPHASE - Stage 1* Results *** Temperature = 673.1500 K Fixed pressure = 1.013250E+05 Pa, 1.000000E+00 atm Component Ref.Phase Chem.Pot. Activity Amount/mol Mass/kg C undef undef 1.043210E+01 1.253000E-01 Mn undef undef 4.126470E+01 2.267000E+00 Ni undef undef 8.553416E+01 5.020000E+00 Fe undef undef 1.657881E+03 9.258770E+01 Total 1.795112E+03 1.000000E+02 Amount Phase Mole fraction of component within phase compnt moles C Mn Ni 1.5857E+03 BCC_A2 0.0001352 0.0054485 0.0112937 2.0941E+02 FCC_A1 0.0487934 0.1557976 0.3229399 Fe 1.5857E+03 BCC_A2 0.9831227 2.0941E+02 FCC_A1 0.4724690 Gibbs Energy = -4.3801262183E+07 J System Enthalpy = 2.0246506616E+07 J *** PROBLEM settings *** Changes only listed under components/phases/substances NUMBER COMPONENT STATUS AMOUNT DELTA REF.P NUMBER PHASE STATUS MODEL NUMBER SUBSTANCE STATUS/CONSTRAINT TEMPERATURE : 653.1500 PRESSURE/Pa : 101325.0 VOLUME/m3 : undefined SYSTEM AMOUNT/mol : undefined COMP. AMOUNTS/mol : 10.43210 41.26470 85.53416 1657.881 SYSTEM MASS/kg : 100.0000 COMP. MASSES/kg : 0.1253000 2.267000 5.020000 92.58770 STEPPED VARIABLE INITIAL, FINAL AND STEP VALUES OF VARIABLE TEMPERATURE 993.150 to 573.150 by -20.0000 *** MULTIPHASE - Stage 1* Results *** Temperature = 653.1500 K Fixed pressure = 1.013250E+05 Pa, 1.000000E+00 atm Component Ref.Phase Chem.Pot. Activity Amount/mol Mass/kg C undef undef 1.043210E+01 1.253000E-01 Mn undef undef 4.126470E+01 2.267000E+00 Ni undef undef 8.553416E+01 5.020000E+00 Fe undef undef 1.657881E+03 9.258770E+01 Total 1.795112E+03 1.000000E+02 Amount Phase Mole fraction of component within phase compnt moles C Mn Ni 1.5969E+03 BCC_A2 0.0001136 0.0049134 0.0101845 1.9817E+02 FCC_A1 0.0517260 0.1686323 0.3495439 Fe 1.5969E+03 BCC_A2 0.9847885 1.9817E+02 FCC_A1 0.4300978 Gibbs Energy = -4.1919408007E+07 J System Enthalpy = 1.8848781058E+07 J *** PROBLEM settings *** Changes only listed under components/phases/substances NUMBER COMPONENT STATUS AMOUNT DELTA REF.P NUMBER PHASE STATUS MODEL NUMBER SUBSTANCE STATUS/CONSTRAINT TEMPERATURE : 633.1500 PRESSURE/Pa : 101325.0 VOLUME/m3 : undefined SYSTEM AMOUNT/mol : undefined COMP. AMOUNTS/mol : 10.43210 41.26470 85.53416 1657.881 SYSTEM MASS/kg : 100.0000 COMP. MASSES/kg : 0.1253000 2.267000 5.020000 92.58770 STEPPED VARIABLE INITIAL, FINAL AND STEP VALUES OF VARIABLE TEMPERATURE 993.150 to 573.150 by -20.0000 *** MULTIPHASE - Stage 1* Results *** Temperature = 633.1500 K Fixed pressure = 1.013250E+05 Pa, 1.000000E+00 atm Component Ref.Phase Chem.Pot. Activity Amount/mol Mass/kg C undef undef 1.043210E+01 1.253000E-01 Mn undef undef 4.126470E+01 2.267000E+00 Ni undef undef 8.553416E+01 5.020000E+00 Fe undef undef 1.657881E+03 9.258770E+01 Total 1.795112E+03 1.000000E+02 Amount Phase Mole fraction of component within phase compnt moles C Mn Ni 1.6060E+03 BCC_A2 0.0000900 0.0043984 0.0091170 1.8906E+02 FCC_A1 0.0544132 0.1808963 0.3749648 Fe 1.6060E+03 BCC_A2 0.9863945 1.8906E+02 FCC_A1 0.3897258 Gibbs Energy = -4.0079742610E+07 J System Enthalpy = 1.7490674962E+07 J *** PROBLEM settings *** Changes only listed under components/phases/substances NUMBER COMPONENT STATUS AMOUNT DELTA REF.P NUMBER PHASE STATUS MODEL NUMBER SUBSTANCE STATUS/CONSTRAINT TEMPERATURE : 613.1500 PRESSURE/Pa : 101325.0 VOLUME/m3 : undefined SYSTEM AMOUNT/mol : undefined COMP. AMOUNTS/mol : 10.43210 41.26470 85.53416 1657.881 SYSTEM MASS/kg : 100.0000 COMP. MASSES/kg : 0.1253000 2.267000 5.020000 92.58770 STEPPED VARIABLE INITIAL, FINAL AND STEP VALUES OF VARIABLE TEMPERATURE 993.150 to 573.150 by -20.0000 *** MULTIPHASE - Stage 1* Results *** Temperature = 613.1500 K Fixed pressure = 1.013250E+05 Pa, 1.000000E+00 atm Component Ref.Phase Chem.Pot. Activity Amount/mol Mass/kg C undef undef 1.043210E+01 1.253000E-01 Mn undef undef 4.126470E+01 2.267000E+00 Ni undef undef 8.553416E+01 5.020000E+00 Fe undef undef 1.657881E+03 9.258770E+01 Total 1.795112E+03 1.000000E+02 Amount Phase Mole fraction of component within phase compnt moles C Mn Ni 1.6135E+03 BCC_A2 0.0000671 0.0039078 0.0081002 1.8163E+02 FCC_A1 0.0568393 0.1924736 0.3989625 Fe 1.6135E+03 BCC_A2 0.9879250 1.8163E+02 FCC_A1 0.3517246 Gibbs Energy = -3.8282377576E+07 J System Enthalpy = 1.6170236899E+07 J *** PROBLEM settings *** Changes only listed under components/phases/substances NUMBER COMPONENT STATUS AMOUNT DELTA REF.P NUMBER PHASE STATUS MODEL NUMBER SUBSTANCE STATUS/CONSTRAINT TEMPERATURE : 593.1500 PRESSURE/Pa : 101325.0 VOLUME/m3 : undefined SYSTEM AMOUNT/mol : undefined COMP. AMOUNTS/mol : 10.43210 41.26470 85.53416 1657.881 SYSTEM MASS/kg : 100.0000 COMP. MASSES/kg : 0.1253000 2.267000 5.020000 92.58770 STEPPED VARIABLE INITIAL, FINAL AND STEP VALUES OF VARIABLE TEMPERATURE 993.150 to 573.150 by -20.0000 *** MULTIPHASE - Stage 1* Results *** Temperature = 593.1500 K Fixed pressure = 1.013250E+05 Pa, 1.000000E+00 atm Component Ref.Phase Chem.Pot. Activity Amount/mol Mass/kg C undef undef 1.043210E+01 1.253000E-01 Mn undef undef 4.126470E+01 2.267000E+00 Ni undef undef 8.553416E+01 5.020000E+00 Fe undef undef 1.657881E+03 9.258770E+01 Total 1.795112E+03 1.000000E+02 Amount Phase Mole fraction of component within phase compnt moles C Mn Ni 1.6196E+03 BCC_A2 0.0000468 0.0034441 0.0071389 1.7552E+02 FCC_A1 0.0590019 0.2033146 0.4214339 Fe 1.6196E+03 BCC_A2 0.9893702 1.7552E+02 FCC_A1 0.3162496 Gibbs Energy = -3.6527498664E+07 J System Enthalpy = 1.4885361048E+07 J *** PROBLEM settings *** Changes only listed under components/phases/substances NUMBER COMPONENT STATUS AMOUNT DELTA REF.P NUMBER PHASE STATUS MODEL NUMBER SUBSTANCE STATUS/CONSTRAINT TEMPERATURE : 573.1500 PRESSURE/Pa : 101325.0 VOLUME/m3 : undefined SYSTEM AMOUNT/mol : undefined COMP. AMOUNTS/mol : 10.43210 41.26470 85.53416 1657.881 SYSTEM MASS/kg : 100.0000 COMP. MASSES/kg : 0.1253000 2.267000 5.020000 92.58770 STEPPED VARIABLE INITIAL, FINAL AND STEP VALUES OF VARIABLE TEMPERATURE 993.150 to 573.150 by -20.0000 *** MULTIPHASE - Stage 1* Results *** Temperature = 573.1500 K Fixed pressure = 1.013250E+05 Pa, 1.000000E+00 atm Component Ref.Phase Chem.Pot. Activity Amount/mol Mass/kg C undef undef 1.043210E+01 1.253000E-01 Mn undef undef 4.126470E+01 2.267000E+00 Ni undef undef 8.553416E+01 5.020000E+00 Fe undef undef 1.657881E+03 9.258770E+01 Total 1.795112E+03 1.000000E+02 Amount Phase Mole fraction of component within phase compnt moles C Mn Ni 1.6247E+03 BCC_A2 0.0000305 0.0030086 0.0062363 1.7045E+02 FCC_A1 0.0609109 0.2134114 0.4423626 Fe 1.6247E+03 BCC_A2 0.9907246 1.7045E+02 FCC_A1 0.2833151 Gibbs Energy = -3.4815375204E+07 J System Enthalpy = 1.3633960222E+07 J