$*****************************************************************************
$
$ mc_x_FeAlCCrMnNSiV.tdb
$
$ Subset of MatCalc Fe database, version 1.009, created 2011-09-30 by Georg
$ Stechauner. This database contains thermodynamic data for system 
$ Fe-Al-C-Cr-Mn-N-Si-V
$
$ This database contains a selection of published thermodynamic data for 
$ Fe-base alloys as well as newly assessed data from various projects.
$
$ ############################################################################
$
$ requires MatCalc version 5.44.0.008 or higher
$
$ ############################################################################
$ 
$ Copyright by Ernst Kozeschnik (ernst.kozeschnik@tuwien.ac.at)
$
$ Editor: Erwin Povoden-Karadeniz (erwin.povoden-karadeniz@tuwien.ac.at)
$
$ You are not eligible for distributing or publishing this database. 
$
$ ###########################################################################


$ The following assessments are incorporated in this database:
$
$ ... see list of publications in the reference section at the end of this file ...


$ The following elements are included in this database:
$
$ Fe, Al, C, Cr, Mn, N, Si, V


$ The following phases are included in this database:
$ They are listed in the order of their appearance in part D) Thermodynamic model parameters for phases 
$ For their documentation see part D). 
$ Documentation and priority rankings suggested by the editor are visible after reading the database and marking the phase of interest.
$   
$ FCC_A1 
$ BCC_A2 
$ HCP_A3 
$
$ 
$
$ Carbides 
$ CEMENTITE  M7C3  M23C6  
$   
$ Nitrides
$ ALN 
$
$*****************************************************************************
$
$ A) Definition of elements
$ From A. T. Dinsdale, SGTE data for pure elements (REF 0)
$
$*****************************************************************************
$
$Element     Standard state   mass [g/mol]    enthalpy_298    entropy_298
ELEMENT VA   VACUUM            0.0                0.00            0.00      !
ELEMENT AL   FCC_A1           26.98154         4540.0            28.30      !
ELEMENT  C   HEX_A9           12.011           1054.0             5.7423    !
ELEMENT CR   BCC_A2           51.996           4050.0            23.5429    !
ELEMENT FE   BCC_A2           55.847           4489.0            27.2797    !
ELEMENT MN   BCC_A12          54.9380          4995.696          32.2206    !
ELEMENT  N   1/2_MOLE_N2(G)   14.007           4335.0            95.751     !
ELEMENT SI   DIA_A4           28.0855          3217.0            18.81      !
ELEMENT  V   BCC_A2           50.9415          4507.0            30.89      !
$
$*****************************************************************************
$
$ B) MatCalc specific commands
$
$*****************************************************************************
$
$ This command allows using this database in the free version of MatCalc
SET_EVALUATION_STRING mx410a92098e !
$
$ Defines Fe as reference element
REFERENCE_ELEMENT FE !
$
$ if phase FCC_A1 is selected, add composition set for carbonitrides ...
ADD_COMPOSITION_SET FCC_A1 :TI,NB,V:C,N: !

$ simple carbide/nitride phases derived from parent are defined by new MatCalc syntax (5.44.0.008) 
$ CREATE_NEW_PHASE parent_phase_name c :El1,El2,...:El3,El4,...: new_name
$
$ if phase HCP_A3 is selected, add composition set for carbides and nitrides
ADD_COMPOSITION_SET HCP_A3 :CR:N: !
ADD_COMPOSITION_SET HCP_A3 :MO:C: !
ADD_COMPOSITION_SET HCP_A3 :CR,V:C: !
$
$ ATTACH_CONTRIBUTION MO2C HCP_A3 PARENT_PHASE !
$
$
$ ##############################################################
$           Enthalpies of vacancy formation - FCC_A1
$ ##############################################################
$
$ default is Fe
PARAMETER HMVA(FCC_A1,*;0)
 273.00 +135000; 6000.00  N
REF:151 !

PARAMETER HMVA(FCC_A1,AL:*;0)
 273.00 +64200; 6000.00  N
REF:pov10 !

PARAMETER HMVA(FCC_A1,FE:*;0)
 273.00 +135000; 6000.00  N
REF:151 !
$
$ ##############################################################
$           Enthalpies of vacancy formation - BCC_A2
$ ##############################################################
$
$ default is Fe
PARAMETER HMVA(BCC_A2,*;0)
 273.00 +163000; 6000.00  N
REF:pov10 !

PARAMETER HMVA(BCC_A2,CR:*;0)
 273.00 +203000; 6000.00  N
REF:pov10 !
PARAMETER HMVA(BCC_A2,FE:*;0)
 273.00 +163000; 6000.00  N
REF:pov10 !
PARAMETER HMVA(BCC_A2,MN:*;0)
 273.00 +101000; 6000.00  N
REF:pov10 !
PARAMETER HMVA(BCC_A2,V:*;0)
 273.00 +204000; 6000.00  N
REF:pov10 !
$
$*****************************************************************************
$
$ C) Gibbs energy functions of elements
$
$*****************************************************************************
$
$ ###########################################################
$             SER (Standard elements references)
$ ###########################################################
$
FUNCTION GHSERAL
 273.00 -7976.15+137.093038*T-24.3671976*T*LN(T)
 -1.884662E-3*T**2-0.877664E-6*T**3+74092*T**(-1); 700.00  Y
 -11276.24+223.048446*T-38.5844296*T*LN(T)
 +18.531982E-3*T**2-5.764227E-6*T**3+74092*T**(-1); 933.47  Y
 -11278.378+188.684153*T-31.748192*T*LN(T)-1.231E+28*T**(-9); 2900.00  N
REF:0 !
$ low T part of next function from REF 156
FUNCTION GHSERCC
 273.00 -988.25091-7.39898691*T+1.76583*T*LN(T)-0.01706952*T**2; 350.00  Y
 -17368.441+170.73*T-24.3*T*LN(T)
 -4.723E-4*T**2+2562600*T**(-1)-2.643E+8*T**(-2)+1.2E+10*T**(-3); 6000.00  N
REF:0 !
FUNCTION GHSERCR
 273.00 -8856.94+157.48*T-26.908*T*LN(T)
 +0.00189435*T**2-1.47721E-6*T**3+139250*T**(-1); 2180.00  Y
 -34869.344+344.18*T-50*T*LN(T)-2.88526E+32*T**(-9); 6000.00  N
REF:0 !
FUNCTION GHSERFE
 273.00 +1225.7+124.134*T-23.5143*T*LN(T)-0.00439752*T**2
 -5.89269E-8*T**3+77358.5*T**(-1); 1811.00  Y
 -25383.581+299.31255*T-46*T*LN(T)+2.2960305E+31*T**(-9); 6000.00  N
REF:0 !
FUNCTION GHSERMN
 273.00 -8115.28+130.059*T-23.4582*T*LN(T)
 -7.34768E-3*T**2+69827.1*T**(-1); 1519.00  Y
 -28733.41+312.2648*T-48.0*T*LN(T)+1.656847E+30*T**(-9); 2000.00  N
REF:0 !
$ 1/2N2 gas
FUNCTION GHSERNN
 273.00 -3750.675-9.45425*T-12.7819*T*LN(T)
 -0.00176686*T**2+2.680735E-09*T**3-32374*T**(-1); 950.00  Y
 -7358.85+17.2003*T-16.3699*T*LN(T)
 -6.5107E-04*T**2+3.0097E-8*T**3+563070*T**(-1); 3350.00  Y
 -16392.8+50.26*T-20.4695*T*LN(T)
 +2.39754E-04*T**2-8.3331E-9*T**3+4596375*T**(-1); 6000.00  N
REF:0 !
FUNCTION GHSERSI
 273.00 -8162.609+137.236859*T-22.8317533*T*LN(T)
 -1.912904E-3*T**2-0.003552E-6*T**3+176667*T**(-1); 1687.00  Y
 -9457.642+167.271767*T-27.196*T*LN(T)-4.2037E+30*T**(-9); 3600.00  N
REF:0 !
FUNCTION GHSERVV
 273.00 -7930.43+133.346053*T-24.134*T*LN(T)
 -3.098E-3*T**2+1.2175E-07*T**3+69460*T**(-1); 790.00  Y
 -7967.842+143.291093*T-25.9*T*LN(T)+0.0625E-3*T**2-0.68E-6*T**3; 2183.00  Y
 -41689.864+321.140783*T-47.43*T*LN(T)+6.44389E+31*T**(-9); 4000.00  N
REF:0 !
$
$ ###########################################################
$           Gibbs energy functions other than SER
$ ###########################################################
$
$ bcc
FUNCTION GALBCC
 273.00 +10083-4.813*T+GHSERAL#; 6000.00  N
REF:0 !
FUNCTION GMNBCC
 273.00 -3235.3+127.85*T-23.7*T*LN(T)
 -0.00744271*T**2+60000*T**(-1); 1519.00  Y
 -23188.83+307.7043*T-48*T*LN(T)+1.265152E+30*T**(-9); 2000.00  N
REF:0 !
FUNCTION GNIBCC
 273.00 +8715.084-3.556*T+GHSERNI#; 6000.00  N
REF:0 !
FUNCTION GSIBCC
 273.00 +47000-22.5*T+GHSERSI#; 6000.00  N
REF:0 !
$ fcc
FUNCTION GCRFCC
 273.00 +7284+0.163*T+GHSERCR#; 6000.00  N
REF:0 !
FUNCTION GFEFCC
 273.00 -1462.4+8.282*T-1.15*T*LN(T)+6.4E-04*T**2+GHSERFE#; 1811.00  Y
 -27098.266+300.25256*T-46*T*LN(T)+2.78854E+31*T**(-9); 6000.00  N
REF:0 !
FUNCTION GFECEM
 273.00 -10195.860754+690.949887637*T-118.47637*T*LN(T)
 -0.0007*T**2+590527*T**(-1); 6000.00  N
REF:156 !
FUNCTION GMNFCC
 273.00 -3439.3+131.884*T-24.5177*T*LN(T)
 -0.006*T**2+69600*T**(-1); 1519.00  Y
 -26070.1+309.6664*T-48*T*LN(T)+3.86196E+30*T**(-9); 2000.00  N
REF:0 !
FUNCTION GSIFCC
 273.00 +51000-21.8*T+GHSERSI#; 6000.00  N
REF:0 !
$ hcp
FUNCTION GMOHCP
273.00 +3803.698+131.9197*T-23.56414*T*LN(T)
 -3.443396E-3*T**2+0.566283E-6*T**3
 +65812*T**(-1)-0.130927E-9*T**4; 2896.00  Y
 -19006.41+283.559746*T-42.63829*T*LN(T)
 -4849.315E30*T**(-9); 5000.00  N
REF:92 !
FUNCTION GHEXTNB
 273.00 -8519.35+142.048*T-26.4711*T*LN(T)
 +0.203475E-3*T**2-0.350119E-6*T**3+93398.8*T**(-1); 6000.00  N
REF:19 !
FUNCTION GCOM23C6
 273.00 +23*GHSERCO#+6*GHSERCC#+145000+116*T; 6000.00  N
REF:73 !
FUNCTION GCRM23C6
 273.00 -521983+3622.24*T-620.965*T*LN(T)
 -0.126431*T**2; 6000.00  N
REF:11 !
FUNCTION GFEM23C6
 273.00 +7.666667*GFECEM#-1.666667*GHSERCC#+66920-40*T; 6000.00  N
REF:15 !
FUNCTION GMNM23C6
 273.00 -308065+50.966*T+23*GHSERMN#+6*GHSERCC#; 6000.00  N
REF:15 !
FUNCTION GNIM23C6
 273.00 +23*GHSERNI#+6*GHSERCC#+210000-84.71*T; 6000.00  N
REF:11 !
FUNCTION GVM23C6
 273.00 -990367+4330.63*T-728.829*T*LN(T)+5003425*T**(-1); 6000.00  N
REF:15 !
FUNCTION GCRM7C3
 273.00 -201690+1103.128*T-190.177*T*LN(T)-0.0578207*T**2; 6000.00  N
REF:11 !
FUNCTION GCRM3C2
 273.00 -100823.8+530.66989*T-89.6694*T*LN(T)-0.0301188*T**2; 6000.00  N
REF:68 !
FUNCTION ETCFESI
 273.00 +63; 6000.00  N
REF:92 !
FUNCTION GTIN
 273.00 -357905+330.4982*T-52.458723*T*LN(T)-9.2840476E-4*T**2
 +871489.25*T**(-1)-2.4139721E+9*T**(-3); 6000.00  N
REF:16 !
FUNCTION GSSLIQ
 273.00 -4001.549+77.905686*T-15.504*T*LN(T)-1.8629E-2*T**2
 -2.4942E-7*T**3-113945*T**(-1); 388.36  Y
 -5285183.35+118449.601*T-19762.4*T*LN(T)+32.79275*T**2
 -1.0221416667E-2*T**3+264673500*T**(-1); 428.15  Y
 -8174995.226+319914.094*T-57607.3*T*LN(T)+135.3045*T**2
 -5.2997333333E-2*T**3; 432.25  Y
 -219408.801+7758.85593*T-1371.85*T*LN(T)+2.845035*T**2
 -1.013803333E-3*T**3; 453.15  Y
 +92539.872-1336.35027*T+202.958*T*LN(T)-0.2531915*T**2
 +51.8835E-6*T**3-8202200*T**(-1); 717.00  Y
 -6889.972+176.37082*T-32*T*LN(T); 1300.00  N
REF:0 !
FUNCTION GDIG
 273.00 +2*GHSERCU#+GHSERSS#-73851.5-97.82124*T+8.1715*T*LN(T); 3000.00  N
REF:82 !
$FUNCTION GTIC
$ 273.00 -168261+293.73187*T-48.0195*T*LN(T)
$ -0.00272*T**2+819000*T**(-1)-2.03E+9*T**(-3); 6000.00  N
$REF:16 !
FUNCTION GTIC
 273.00 -194244+264.4*T-42.248*T*LN(T)
 -0.0044617*T**2+31263*T**(-1)+6.96E+9*T**(-3); 6000.00  N
REF:88 !
$ Functions for ordered bcc
FUNCTION B2ALNI
 273.00 -152397.88+26.40575*T; 6000.00  N
REF:89 !
FUNCTION LB2ALNI
 273.00 -52440.88+11.30117*T; 6000.00  N
REF:89 !
$ Functions for ordered fcc
FUNCTION UALNI
273.00 -22212.8931+4.39570389*T; 6000.00  N
REF:89 !
FUNCTION U1ALNI
273.00 +0.666666667*UALNI#; 6000.00  N
REF:89 !
FUNCTION U3ALNI
273.00 +1e-8; 6000.00  N
REF:89 !
FUNCTION U4ALNI
273.00 +7203.60609-3.74273030*T; 6000.00  N
REF:89 !
FUNCTION L04ALNI
273.00 +U3ALNI#; 6000.00  N
REF:89 !
FUNCTION L14ALNI
273.00 +U4ALNI#; 6000.00  N
REF:89 !
FUNCTION ALNI3
273.00 +3*U1ALNI#; 6000.00  N
REF:89 !
FUNCTION AL2NI2
273.00 +4*U1ALNI#; 6000.00  N
REF:89 !
FUNCTION AL3NI
273.00 +3*U1ALNI#; 6000.00  N
REF:89 !
$ 
FUNCTION FESIW1  
273.00 +10476.27; 6000.00  N
REF:24 !
FUNCTION LFESIB0   
273.00 -27809+11.62*T; 6000.00  N
REF:24 !
FUNCTION LFESIB1   
273.00 -23088; 6000.00  N
REF:24 !
FUNCTION LFESIB2   
273.00 +3890; 6000.00  N
REF:24 !
$
FUNCTION UNDEF
273.00 +1e-8; 6000.00  N !
$
$*****************************************************************************
$*****************************************************************************
$
$ D) Thermodynamic model parameters for phases
$
$*****************************************************************************
$*****************************************************************************
$
$
$##################################################################################
$                   THERMODYNAMIC PARAMETERS: FCC_A1
$##################################################################################
$
 TYPE_DEFINITION ' GES A_P_D FCC_A1 MAGNETIC  -3.0    0.28 !
 PHASE FCC_A1  %'  2 1   1 > 
Face-centered cubic Austenite phase with Va on interstitial sublattice; 
V- and/or W-rich MC carbo-nitride phase is denoted "fcc_A1#01" in the MatCalc databases,
with C and N on substitutional sublattice. MC carbo-nitride composition sets can be
defined by the user (syntax see top of database). Typically MC is precipitating on dislocations and/or lath boundaries. 
MC is an important hardening phase in many types of steel. 
>> 6 !
    CONSTITUENT FCC_A1  : AL,CR,FE%,MN,SI,V : C,N,VA% :  !
$-------------------------------------------------------------------
     $ FCC_A1 endmember compounds with VA
$-------------------------------------------------------------------
PARAMETER G(FCC_A1,AL:VA;0) 273.00 +GHSERAL#; 2900.00  N
REF:0 !
PARAMETER G(FCC_A1,CR:VA;0) 273.00 +7284+0.163*T+GHSERCR#; 6000.00  N
REF:0 !
PARAMETER G(FCC_A1,FE:VA;0) 273.00 -1462.4+8.282*T-1.15*T*LN(T)
   +0.00064*T**2+GHSERFE#; 1811.00  Y
   -1713.815+0.94001*T+0.4925095E+31*T**(-9)+GHSERFE#; 6000.00  N
REF:0 !
PARAMETER G(FCC_A1,MN:VA;0) 273.00 -3439.3+131.884*T-24.5177*T*LN(T)
   -0.006*T**2+69600*T**(-1); 1519.00  Y
   -26070.1+309.6664*T-48*T*LN(T)+3.86196E+30*T**(-9); 2000.00  N
REF:66 !
PARAMETER G(FCC_A1,SI:VA;0) 273.00 +51000-21.8*T+GHSERSI#; 3600.00  N
REF:0 !
PARAMETER G(FCC_A1,V:VA;0) 273.00 +7500+1.7*T+GHSERVV#; 4000.00  N
REF:0 !
$-------------------------------------------------------------------
     $ FCC_A1 endmember compounds with C
$-------------------------------------------------------------------
PARAMETER G(FCC_A1,AL:C;0) 273.00 +GHSERAL#+GHSERCC#
   +81000; 6000.00  N
REF:155 !
PARAMETER G(FCC_A1,CR:C;0) 273.00 +GHSERCR#+GHSERCC#+1200-1.94*T; 6000.00  N
REF:11 !
PARAMETER G(FCC_A1,FE:C;0) 273.00 +77207-15.877*T+GFEFCC#+GHSERCC#; 6000.00  N
REF:11 !
PARAMETER G(FCC_A1,MN:C;0) 273.00 +502+15.261*T+GHSERMN#+GHSERCC#; 6000.00  N
REF:15 !
$PARAMETER G(FCC_A1,NB:C;0) 273.00 -156735+284.1689*T-46.34274*T*LN(T)
$   -0.0029287*T**2-1.02788144E+9*T**(-3)+563374*T**(-1); 6000.00  N
$REF:16 !
$PARAMETER G(FCC_A1,NB:C;0) 273.00 -153054+283.912*T-46.34274*T*LN(T)
$   -0.0029287*T**2-1.02788144E+9*T**(-3)+563374*T**(-1); 6000.00  N
$REF:19 !
$PARAMETER G(FCC_A1,NB:C;0) 273.00 -155600+271.98*T-44.816*T*LN(T)
$   -0.00362*T**2+2.917E-10*T**3+449700*T**(-1); 6000.00  N
$REF:113 ! 
PARAMETER G(FCC_A1,SI:C;0) 273.00 +GHSERSI#+GHSERCC#-20510+38.7*T; 6000.00  N
REF:24 !
PARAMETER G(FCC_A1,V:C;0) 273.00 -117302+262.57*T-41.756*T*LN(T)
  -0.00557101*T**2+590546*T**(-1); 6000.00  N
REF:15 !
$-------------------------------------------------------------------
     $ FCC_A1 endmember compounds with N
$-------------------------------------------------------------------
$ the following parameter is set 0 for reproduction of 
$ published carbonitride simulation (pov)
$PARAMETER G(FCC_A1,AL:N;0) 273.00 +80*T+GHSERAL#+GHSERNN#+UNDEF#; 6000.00  N
$REF:92 !
PARAMETER G(FCC_A1,AL:N;0) 273.00 +1e-8; 6000.00  N
REF:pov09 !
PARAMETER G(FCC_A1,CR:N;0) 273.00 -124460+142.16*T-8.5*T*LN(T)
   +GHSERCR#+GHSERNN#; 6000.00  N
REF:22 !
PARAMETER G(FCC_A1,FE:N;0) 273.00 -37460+375.42*T-37.6*T*LN(T)
   +GHSERFE#+GHSERNN#; 6000.00  N
REF:47 !
PARAMETER G(FCC_A1,MN:N;0) 273.00 -75940+292.226*T-50.294*T*LN(T)
   +265051*T**(-1); 2500.00  N
REF:22 !
PARAMETER G(FCC_A1,V:N;0) 273.00 -215000+101*T-2.22*T*LN(T)
   +0.00073*T**2+GHSERVV#+GHSERNN#; 6000.00  N
REF:48 !
$******************** binary interactions ***************************
$-------------------------------------------------------------------
       $ FCC_A1 binary interactions with VA
$-------------------------------------------------------------------
PARAMETER L(FCC_A1,AL,CR:VA;0) 273.00 -45900+6*T; 6000.00  N
REF:92 !
PARAMETER L(FCC_A1,AL,FE:VA;0) 273.00 -104700+30.65*T; 6000.00  N
REF:155 !
PARAMETER L(FCC_A1,AL,FE:VA;1) 273.00 +22600; 6000.00  N
REF:155 !
PARAMETER L(FCC_A1,AL,FE:VA;2) 273.00 +29100-13*T; 6000.00  N
REF:155 !
PARAMETER L(FCC_A1,AL,MN:VA;0) 273.00 -69300+25*T; 6000.00  N
REF:12 !
PARAMETER L(FCC_A1,AL,MN:VA;1) 273.00 +8800; 6000.00  N
REF:12 !
PARAMETER L(FCC_A1,AL,SI:VA;0) 273.00 -3423.91-0.09584*T; 6000.00  N
REF:101 !
PARAMETER L(FCC_A1,AL,V:VA;0) 273.00 -61980+12.3*T; 6000.00  N
REF:92 !
PARAMETER L(FCC_A1,AL,V:VA;1) 273.00 -8000; 6000.00  N
REF:92 !
PARAMETER L(FCC_A1,CR,FE:VA;0) 273.00 +10833-7.477*T; 6000.00  N
REF:11 !
PARAMETER L(FCC_A1,CR,FE:VA;1) 273.00 +1410; 6000.00  N
REF:11 !
PARAMETER L(FCC_A1,CR,MN:VA;0) 273.00 -19088+17.5423*T; 6000.00  N
REF:22 !
PARAMETER L(FCC_A1,CR,SI:VA;0) 273.00 -120000+10.69527*T; 6000.00  N
REF:46 !
PARAMETER L(FCC_A1,CR,SI:VA;1) 273.00 -47614.7+12.17363*T; 6000.00  N
REF:46 !
PARAMETER L(FCC_A1,CR,V:VA;0) 273.00 -9874-2.6964*T; 6000.00  N
REF:68 !
PARAMETER L(FCC_A1,CR,V:VA;1) 273.00 -1720-2.5237*T; 6000.00  N
REF:68 !
PARAMETER L(FCC_A1,FE,MN:VA;0) 273.00 -7762+3.865*T; 6000.00  N
REF:15 !
PARAMETER L(FCC_A1,FE,MN:VA;1) 273.00 -259; 6000.00  N
REF:15 !
PARAMETER L(FCC_A1,FE,SI:VA;0) 273.00 -125248+41.116*T; 6000.00  N
REF:25 !
PARAMETER L(FCC_A1,FE,SI:VA;1) 273.00 -142707.6; 6000.00  N
REF:25 !
PARAMETER L(FCC_A1,FE,SI:VA;2) 273.00 +89907.3; 6000.00  N
REF:25 !
PARAMETER L(FCC_A1,FE,V:VA;0) 273.00 -15291-4.138*T; 6000.00  N
REF:15 !
PARAMETER L(FCC_A1,MN,SI:VA;0) 273.00 -101253; 6000.00  N
REF:150 !
PARAMETER L(FCC_A1,MN,SI:VA;1) 273.00 +17991; 6000.00  N
REF:150 !
PARAMETER L(FCC_A1,MN,V:VA;0) 273.00 -11820; 6000.00  N
REF:15 !
PARAMETER L(FCC_A1,SI,V:VA;0) 273.00 -205373.1+61.02211*T; 6000.00  N
REF:129 !
$-------------------------------------------------------------------
       $ FCC_A1 binary interactions with C
$-------------------------------------------------------------------
PARAMETER L(FCC_A1,AL,CR:C;0) 273.00 +1e-8; 6000.00  N
REF:pov11 !
PARAMETER L(FCC_A1,AL,FE:C;0) 273.00 -104000+80*T; 6000.00  N
REF:155 !
PARAMETER L(FCC_A1,AL,FE:C;1) 273.00 +81000; 6000.00  N
REF:155 !
PARAMETER L(FCC_A1,AL,FE:C;2) 273.00 +1e-8; 6000.00  N
REF:155 !
PARAMETER L(FCC_A1,AL,FE:C,VA;0) 273.00 +1e-8; 6000.00  N
REF:pov11 !
PARAMETER L(FCC_A1,AL,FE:C,VA;1) 273.00 +1e-8; 6000.00  N
REF:pov11 !
PARAMETER L(FCC_A1,CR,FE:C;0) 273.00 -74319+3.2353*T; 6000.00  N
REF:11 !
PARAMETER L(FCC_A1,CR,MN:C;0) 273.00 -19088+17.5423*T; 6000.00  N
REF:141 !
PARAMETER L(FCC_A1,CR,V:C;0) 273.00 +35698-50.0981*T; 6000.00  N
REF:68 !
PARAMETER L(FCC_A1,CR,V:C;1) 273.00 -47500; 6000.00  N
REF:pov11 !
PARAMETER L(FCC_A1,CR,V:C;2) 273.00 -30000; 6000.00  N
REF:pov11 !
PARAMETER L(FCC_A1,FE,MN:C;0) 273.00 +34052-23.467*T; 6000.00  N
REF:15 !
PARAMETER L(FCC_A1,FE,SI:C;0) 273.00 +226100-34.25*T; 6000.00  N
REF:25 !
PARAMETER L(FCC_A1,FE,SI:C;1) 273.00 -202400; 6000.00  N
REF:25 !
PARAMETER L(FCC_A1,FE,V:C;0) 273.00 -7645.5-2.069*T; 6000.00  N
REF:15 !
PARAMETER L(FCC_A1,FE,V:C;1) 273.00 -7645.5-2.069*T; 6000.00  N
REF:15 !
$-------------------------------------------------------------------
       $ FCC_A1 binary interactions with N
$-------------------------------------------------------------------   
PARAMETER L(FCC_A1,CR,FE:N;0) 273.00 -128930+86.49*T; 6000.00  N
REF:22 !
PARAMETER L(FCC_A1,CR,FE:N;1) 273.00 +24330; 6000.00  N
REF:22 !
PARAMETER L(FCC_A1,CR,MN:N;0) 273.00 -21237; 6000.00  N
REF:22 !
PARAMETER L(FCC_A1,FE,MN:N;0) 273.00 +53968-38.102*T; 6000.00  N
REF:22 !
PARAMETER L(FCC_A1,FE,MN:N;1) 273.00 -28787; 6000.00  N
REF:22 !
PARAMETER L(FCC_A1,FE,V:N;0) 273.00 -60000; 6000.00  N
REF:32 !
$PARAMETER L(FCC_A1,NB,TI:N;0) 273.00 +1E-8; 6000.00  N
$REF:16 !
$-------------------------------------------------------------------
       $ FCC_A1 binary interactions with C,VA
$-------------------------------------------------------------------
PARAMETER L(FCC_A1,AL:C,VA;0) 273.00 -80000+8*T; 6000.00  N
REF:155 !
PARAMETER L(FCC_A1,CR:C,VA;0) 273.00 -11977+6.8194*T; 6000.00  N
REF:11 !
PARAMETER L(FCC_A1,FE:C,VA;0) 273.00 -34671; 6000.00  N
REF:11 !
PARAMETER L(FCC_A1,MN:C,VA;0) 273.00 -43433; 6000.00  N
REF:15 !
PARAMETER L(FCC_A1,V:C,VA;0) 273.00 -74811+10.201*T; 6000.00  N
REF:15 !
PARAMETER L(FCC_A1,V:C,VA;1) 273.00 -30394; 6000.00  N
REF:15 !
$
PARAMETER L(FCC_A1,AL,MN:C,VA;0) 273.00 -50000; 6000.00  N
REF:155 !
PARAMETER L(FCC_A1,FE,V:C,VA;0) 273.00 -40000; 6000.00  N
REF:15 !
$-------------------------------------------------------------------
       $ FCC_A1 binary interactions with N,VA
$-------------------------------------------------------------------
PARAMETER L(FCC_A1,AL:N,VA;0) 273.00 +1E-8; 6000.00  N
REF:pov09 !
PARAMETER L(FCC_A1,CR:N,VA;0) 273.00 +20000; 6000.00  N
REF:22 !
PARAMETER L(FCC_A1,FE:N,VA;0) 273.00 -26150; 6000.00  N
REF:22 !
PARAMETER L(FCC_A1,MN:N,VA;0) 273.00 -69698+11.5845*T; 6000.00  N
REF:22 !
PARAMETER L(FCC_A1,V:N,VA;0) 273.00 -131000+47.1*T; 6000.00  N
REF:48 !
$
PARAMETER L(FCC_A1,CR,FE:N,VA;0) 273.00 -162516; 6000.00  N
REF:22 !
PARAMETER L(FCC_A1,FE,V:N,VA;0) 273.00 -120000; 6000.00  N
REF:32 !
$-------------------------------------------------------------------
       $ FCC_A1 binary interactions with C,N
$-------------------------------------------------------------------
PARAMETER L(FCC_A1,V:C,N;0) 273.00 -20000; 6000.00  N
REF:88 !
$******************** ternary interactions ***************************
$-------------------------------------------------------------------
       $ FCC_A1 ternary interactions with VA
$-------------------------------------------------------------------
PARAMETER L(FCC_A1,AL,FE,MN:VA;0) 273.00 +1e-8; 6000.00  N
REF:155 !
PARAMETER L(FCC_A1,AL,FE,MN:VA;1) 273.00 +1e-8; 6000.00  N
REF:155 !
PARAMETER L(FCC_A1,AL,FE,MN:VA;2) 273.00 +1e-8; 6000.00  N
REF:155 !
PARAMETER L(FCC_A1,CR,FE,MN:VA;0) 273.00 +6715-10.393*T; 6000.00  N
REF:22 !
PARAMETER L(FCC_A1,CR,FE,SI:VA;0) 273.00 -79000; 6000.00  N
REF:pov09 !
PARAMETER L(FCC_A1,CR,FE,V:VA;0) 273.00 +1E-7; 6000.00  N
REF:12 !
PARAMETER L(FCC_A1,FE,MN,SI:VA;0) 273.00 -56655-55.613*T; 6000.00  N
REF:53 !
$-------------------------------------------------------------------
       $ FCC_A1 ternary interactions with C
$-------------------------------------------------------------------
PARAMETER L(FCC_A1,AL,FE,MN:C;0) 273.00 -679200+400*T; 6000.00  N
REF:155 !
$-------------------------------------------------------------------
       $ FCC_A1 ternary interactions with N
$-------------------------------------------------------------------
PARAMETER L(FCC_A1,CR,FE,MN:N;0) 273.00 -137300; 6000.00  N
REF:22 !
$-------------------------------------------------------------------
    $ FCC_A1 magnetic contribution
$-------------------------------------------------------------------
PARAMETER TC(FCC_A1,CR:VA;0) 273.00 -1109; 6000.00  N
REF:11 !
PARAMETER BMAGN(FCC_A1,CR:VA;0) 273.00 -2.46; 6000.00  N
REF:11 !
PARAMETER TC(FCC_A1,FE:VA;0) 273.00 -201; 6000.00  N
REF:20 !
PARAMETER BMAGN(FCC_A1,FE:VA;0) 273.00 -2.1; 6000.00  N
REF:20 !
PARAMETER TC(FCC_A1,FE,MN:VA;0) 273.00 -2282; 6000.00  N
REF:92 !
PARAMETER TC(FCC_A1,FE,MN:VA;1) 273.00 -2068; 6000.00  N
REF:92 !
PARAMETER BMAGN(FCC_A1,FE,MN:VA;0)  273.00 +1e-8; 6000.00  N
REF:92 !
PARAMETER TC(FCC_A1,FE,MN,SI:VA;0) 273.00 +13854; 6000.00  N
REF:53 !
PARAMETER TC(FCC_A1,FE:C;0) 273.00 -201; 6000.00  N
REF:11 !
PARAMETER BMAGN(FCC_A1,FE:C;0) 273.00 -2.1; 6000.00  N
REF:11 !
PARAMETER TC(FCC_A1,MN:VA;0) 273.00 -1620; 2000.00  N
REF:0 !
PARAMETER BMAGN(FCC_A1,MN:VA;0) 273.00 -1.86; 2000.00  N
REF:0 !
$
$##################################################################################
                  $ THERMODYNAMIC PARAMETERS: BCC_A2  
$##################################################################################
$
 TYPE_DEFINITION & GES A_P_D BCC_A2 MAGNETIC  -1.0    0.4 !
 PHASE BCC_A2  %&  2 1   3 > 
Body-centered cubic Ferrite phase. 
>> 6 !
    CONSTITUENT BCC_A2  : AL,CR,FE%,MN,SI,V : C,N,VA% :  !
$-------------------------------------------------------------------
     $ BCC_A2 endmember compounds with VA
$-------------------------------------------------------------------
PARAMETER G(BCC_A2,AL:VA;0) 273.00 +10083-4.813*T+GHSERAL#; 2900.00  N
REF:0 !
PARAMETER G(BCC_A2,CR:VA;0) 273.00 +GHSERCR#; 6000.00  N
REF:0 !
PARAMETER G(BCC_A2,FE:VA;0) 273.00 +GHSERFE#; 6000.00  N
REF:0 !
PARAMETER G(BCC_A2,MN:VA;0) 273.00 +GMNBCC#; 6000.00  N
REF:66 !
PARAMETER G(BCC_A2,SI:VA;0) 273.00 +47000-22.5*T+GHSERSI#; 3600.00  N
REF:0 !
PARAMETER G(BCC_A2,V:VA;0) 273.00 +GHSERVV#; 4000.00  N
REF:0 !
$-------------------------------------------------------------------
     $ BCC_A2 endmember compounds with C
$-------------------------------------------------------------------
PARAMETER G(BCC_A2,AL:C;0) 273.00 +GHSERAL#+3*GHSERCC#
  +100000+80*T; 6000.0  N
REF:155 !
PARAMETER G(BCC_A2,CR:C;0) 273.00 +GHSERCR#+3*GHSERCC#
   +416000; 6000.00  N
REF:11 !
PARAMETER G(BCC_A2,FE:C;0) 273.00 +322050+75.667*T+GHSERFE#
   +3*GHSERCC#; 6000.00  N
REF:11 !
PARAMETER G(BCC_A2,MN:C;0) 273.00 +10000+30*T+GHSERMN#+3*GHSERCC#; 6000.00  N
REF:15 !
PARAMETER G(BCC_A2,SI:C;0) 273.00 +369050-98.167*T+GHSERSI#+3*GHSERCC#; 6000.00  N
REF:24 !
PARAMETER G(BCC_A2,V:C;0) 273.00 +108449+GHSERVV#+3*GHSERCC#; 6000.00  N
REF:15 !
$-------------------------------------------------------------------
     $ BCC_A2 endmember compounds with N
$-------------------------------------------------------------------
PARAMETER G(BCC_A2,AL:N;0) 273.00 +23000+10*T+GHSERAL#+3*GHSERNN#; 6000.00  N
REF:92 !
PARAMETER G(BCC_A2,CR:N;0) 273.00 +GHSERCR#+3*GHSERNN#+311870+29.12*T; 6000.00  N
REF:22 !
PARAMETER G(BCC_A2,FE:N;0) 273.00 +93562+165.07*T+GHSERFE#+3*GHSERNN#; 6000.00  N
REF:22 !
PARAMETER G(BCC_A2,MN:N;0) 273.00 -55600+606.648*T
  -100.41*T*LN(T)+844897*T**(-1); 2500.00  N
REF:22 !
PARAMETER G(BCC_A2,V:N;0) 273.00 +843000+GHSERVV#+3*GHSERNN#; 6000.00  N
REF:48 !
$******************** binary interactions ***************************
$-------------------------------------------------------------------
       $ BCC_A2 binary interactions with VA
$-------------------------------------------------------------------
PARAMETER L(BCC_A2,AL,CR:VA;0) 273.00 -54900+10*T; 6000.00  N
REF:92 !
PARAMETER L(BCC_A2,AL,FE:VA;0) 273.00 -122960+31.9888*T; 6000.00  N
REF:92 !
PARAMETER L(BCC_A2,AL,FE:VA;1) 273.00 +3089.2; 6000.00  N
REF:92 !
PARAMETER L(BCC_A2,AL,MN:VA;0) 273.00 -120077+52.851*T; 6000.00  N
REF:12 !
PARAMETER L(BCC_A2,AL,MN:VA;1) 273.00 -40652+29.276*T; 6000.00  N
REF:12 !
PARAMETER L(BCC_A2,AL,SI:VA;0) 273.00 -3432+0.204*T; 6000.00  N
REF:pov09 !
PARAMETER L(BCC_A2,AL,V:VA;0) 273.00 -95000+20*T; 6000.00  N
REF:12 !
PARAMETER L(BCC_A2,AL,V:VA;1) 273.00 -6000; 6000.00  N
REF:12 !
PARAMETER L(BCC_A2,CR,FE:VA;0) 273.00 +20500-9.68*T; 6000.00  N
REF:11 !
PARAMETER L(BCC_A2,CR,MN:VA;0) 273.00 -20328+18.7339*T; 6000.00  N
REF:22 !
PARAMETER L(BCC_A2,CR,MN:VA;1) 273.00 -9162+4.4183*T; 6000.00  N
REF:22 !
PARAMETER L(BCC_A2,CR,SI:VA;0) 273.00 -104537.94+10.69527*T; 6000.00  N
REF:46 !
PARAMETER L(BCC_A2,CR,SI:VA;1) 273.00 -47614.70+12.17363*T; 6000.00  N
REF:46 !
PARAMETER L(BCC_A2,CR,V:VA;0) 273.00 -9875-2.6964*T; 6000.00  N
REF:68 !
PARAMETER L(BCC_A2,CR,V:VA;1) 273.00 -1720-2.5237*T; 6000.00  N
REF 68 !
PARAMETER L(BCC_A2,FE,MN:VA;0) 273.00 -2759+1.237*T; 6000.00  N
REF:15 !
PARAMETER L(BCC_A2,FE,SI:VA;0) 273.00 +4*LFESIB0#-4*FESIW1#; 6000.00  N
REF:24 !
PARAMETER L(BCC_A2,FE,SI:VA;1) 273.00 +4*LFESIB1#; 6000.00  N
REF:24 !
PARAMETER L(BCC_A2,FE,SI:VA;2) 273.00 +16*LFESIB2#; 6000.00  N
REF:24 !
PARAMETER L(BCC_A2,FE,V:VA;0) 273.00 -23674+0.465*T; 6000.00  N
REF:15 !
PARAMETER L(BCC_A2,FE,V:VA;1) 273.00 +8283; 6000.00  N
REF:15 !
PARAMETER L(BCC_A2,MN,SI:VA;0) 273.00 -72446.85; 6000.00  N
REF:60 !
PARAMETER L(BCC_A2,MN,V:VA;0) 273.00 -10000; 6000.00  N
REF:15 !
PARAMETER L(BCC_A2,SI,V:VA;0) 273.00 -205373.1+61.02211*T; 6000.00  N
REF:129 !
$-------------------------------------------------------------------
       $ BCC_A2 binary interactions with B
$-------------------------------------------------------------------
$
$-------------------------------------------------------------------
       $ BCC_A2 binary interactions with C
$-------------------------------------------------------------------
PARAMETER L(BCC_A2,AL,FE:C;0) 273.00 +1e-8; 6000.00  N
REF:155 !
PARAMETER L(BCC_A2,AL,FE:C;1) 273.00 +1e-8; 6000.00  N
REF:155 !
PARAMETER L(BCC_A2,CR,FE:C;0) 273.00 -1250000+667.7*T; 6000.00  N
REF:11 !
PARAMETER L(BCC_A2,CR,MN:C;0) 273.00 -20328+18.7339*T; 6000.00  N
REF:141 !
PARAMETER L(BCC_A2,CR,MN:C;1) 273.00 -9162+4.4183*T; 6000.00  N
REF:141 !
PARAMETER L(BCC_A2,FE,MN:C;0) 273.00 +34052-23.467*T; 6000.00  N
REF:15 !
PARAMETER L(BCC_A2,FE,SI:C;0) 273.00 +1000000-100*T; 6000.00  N
REF:25 !
PARAMETER L(BCC_A2,FE,SI:C;1) 273.00 -900000; 6000.00  N
REF:25 !
PARAMETER L(BCC_A2,FE,V:C;0) 273.00 -23674+0.465*T; 6000.00  N
REF:15 !
PARAMETER L(BCC_A2,FE,V:C;1) 273.00 +8283; 6000.00  N
REF:15 !
PARAMETER L(BCC_A2,MN,V:C;0) 273.00 -10000; 6000.00  N
REF:15 !
$PARAMETER L(BCC_A2,MO,TI:C;0) 273.00 -459700; 6000.00  N
$REF:17 !
$-------------------------------------------------------------------
       $ BCC_A2 binary interactions with N
$-------------------------------------------------------------------
PARAMETER L(BCC_A2,CR,FE:N;0) 273.00 -799379+293*T; 6000.00  N
REF:22 !
$-------------------------------------------------------------------
       $ BCC_A2 binary interactions with C,VA
$-------------------------------------------------------------------
PARAMETER L(BCC_A2,AL:C,VA;0) 273.00 +130000+14*T; 6000.00  N
REF:155 !
PARAMETER L(BCC_A2,CR:C,VA;0) 273.00 -190*T; 6000.00  N
REF:11 !
PARAMETER L(BCC_A2,FE:C,VA;0) 273.00 -190*T; 6000.00  N
REF:11 !
PARAMETER L(BCC_A2,V:C,VA;0) 273.00 -297868; 6000.00  N
REF:15 !
$-------------------------------------------------------------------
       $ BCC_A2 binary interactions with N,VA
$-------------------------------------------------------------------
PARAMETER L(BCC_A2,CR:N,VA;0) 273.00 -200000; 6000.00  N
REF:22 !
PARAMETER L(BCC_A2,MN:N,VA;0) 273.00 -185000; 6000.00  N
REF:22 !
PARAMETER L(BCC_A2,V:N,VA;0) 273.00 -1680000+325*T; 6000.00  N
REF:48 !
$******************** ternary interactions ***************************
$-------------------------------------------------------------------
       $ BCC_A2 ternary interactions with VA
$-------------------------------------------------------------------
PARAMETER L(BCC_A2,CR,FE,MN:VA;0) 273.00 -5996; 6000.00  N
REF:22 !
PARAMETER L(BCC_A2,CR,FE,SI:VA;0) 273.00 -54000; 6000.00  N
REF:43 !
PARAMETER L(BCC_A2,CR,FE,V:VA;0) 273.00 +14881; 6000.00  N
REF:52 !
PARAMETER L(BCC_A2,CR,FE,V:VA;1) 273.00 +17968; 6000.00  N
REF:52 !
PARAMETER L(BCC_A2,CR,FE,V:VA;2) 273.00 -7692; 6000.00  N
REF:52 !
PARAMETER L(BCC_A2,FE,MN,SI:VA;0) 273.00 -97474; 6000.00  N
REF:53 !
$-------------------------------------------------------------------
       $ BCC_A2 ternary interactions with C
$-------------------------------------------------------------------
$
$-------------------------------------------------------------------
       $ BCC_A2 ternary interactions with N
$-------------------------------------------------------------------
PARAMETER L(BCC_A2,CR,FE,MN:N;0) 273.00 +1E-8; 6000.00  N
REF:22 !
$-------------------------------------------------------------------
     $ BCC_A2 ternary interactions with C,N,VA
$-------------------------------------------------------------------
$
$-------------------------------------------------------------------
    $ BCC_A2 magnetic contribution
$-------------------------------------------------------------------
PARAMETER TC(BCC_A2,CR:VA;0) 273.00 -311.5; 6000.00  N
REF:22 !
PARAMETER BMAGN(BCC_A2,CR:VA;0) 273.00 -0.008; 6000.00  N
REF:0 !
PARAMETER TC(BCC_A2,FE:VA;0) 273.00 +1043; 6000.00  N
REF:0 !
PARAMETER BMAGN(BCC_A2,FE:VA;0) 273.00 +2.22; 6000.00  N
REF:0 !
PARAMETER TC(BCC_A2,MN:VA;0) 273.00 -580; 2000.00  N
REF:0 !
PARAMETER BMAGN(BCC_A2,MN:VA;0) 273.00 -0.27; 2000.00  N
REF:0 !
PARAMETER TC(BCC_A2,AL,FE:VA;1) 273.00 +504; 6000.00  N
REF:92 !
PARAMETER TC(BCC_A2,CR,FE:VA;0) 273.00 +1650; 6000.00  N
REF:11 !
PARAMETER TC(BCC_A2,CR,FE:VA;1) 273.00 +550; 6000.00  N
REF:11 !
PARAMETER BMAGN(BCC_A2,CR,FE:VA;0) 273.00 -0.85; 6000.00  N
REF:pov09 !
PARAMETER TC(BCC_A2,FE,SI:VA;1) 273.00 +8*ETCFESI#; 6000.00  N
REF:24 !
PARAMETER BMAGN(BCC_A2,FE,V:VA;0) 273.00 -2.26; 6000.00  N
REF:15 !
PARAMETER TC(BCC_A2,FE,V:VA;0) 273.00 -110; 6000.00  N
REF:15 !
PARAMETER TC(BCC_A2,FE,V:VA;1) 273.00 +3075; 6000.00  N
REF:15 !
PARAMETER TC(BCC_A2,FE,V:VA;2) 273.00 +808; 6000.00  N
REF:15 !
PARAMETER TC(BCC_A2,FE,V:VA;3) 273.00 -2169; 6000.00  N
REF:15 !
PARAMETER TC(BCC_A2,CR:C;0) 273.00 -311.5; 6000.00  N
REF:11 !
PARAMETER BMAGN(BCC_A2,CR:C;0) 273.00 -0.008; 6000.00  N
REF:11 !
PARAMETER TC(BCC_A2,FE:C;0) 273.00 +1043; 6000.00  N
REF:11 !
PARAMETER BMAGN(BCC_A2,FE:C;0) 273.00 +2.22; 6000.00  N
REF:11 !
PARAMETER TC(BCC_A2,CR,FE:C;0) 273.00 +1650; 6000.00  N
REF:11 !
PARAMETER TC(BCC_A2,CR,FE:C;1) 273.00 +550; 6000.00  N
REF:11 !
PARAMETER BMAGN(BCC_A2,CR,FE:C;0) 273.00 -0.85; 6000.00  N
REF:11 !
PARAMETER TC(BCC_A2,FE,MN:VA;0) 273.00 +123; 6000.00  N
REF:92 !
PARAMETER TC(BCC_A2,CR:N;0) 273.00 -311.5; 6000.00  N
REF:pov09 !
PARAMETER BMAGN(BCC_A2,CR:N;0) 273.00 -0.008; 6000.00  N
REF:22 !
PARAMETER TC(BCC_A2,FE:N;0) 273.00 +1043; 6000.00  N
REF:22 !
PARAMETER BMAGN(BCC_A2,FE:N;0) 273.00 +2.22; 6000.00  N
REF:22 !
PARAMETER TC(BCC_A2,CR,FE:N;0) 273.00 +1650; 6000.00  N
REF:22 !
PARAMETER TC(BCC_A2,CR,FE:N;1) 273.00 +550; 6000.00  N
REF:22 !
PARAMETER BMAGN(BCC_A2,CR,FE:N;0) 273.00 -0.85; 6000.00  N
REF:22 !

$------------------------------------------------------------------- 
$ BCC_A2 treatment of martensite
$-------------------------------------------------------------------

PARAMETER IS(BCC_A2,*:C;0) 298.15 -757222+1515.5*T-0.7583*T**2; 1000.00 N
REF: koze10!
$
$##################################################################################
$                   THERMODYNAMIC PARAMETERS: HCP_A3 
$##################################################################################
$
 TYPE_DEFINITION ) GES A_P_D HCP_A3 MAGNETIC  -3.0    0.28 !
 PHASE HCP_A3  %)  2 1   0.5 > 
Hexagonal close-packed. M2C, denoted "hcp#01" in the MatCalc databases, 
with C on interstitial sites and Mo as mayor constituent. 
Cr and V can dissolve with significant quantities in M2C. M2C carbide and M2N nitride composition sets can be
defined by the user (syntax see top of database). 
M2C is an important precipitate phase, e.g. in complex tool steels, etc. 
M2C is commonly precipitating on dislocations and/or martensite lath boundaries. 
>> 3 !
    CONSTITUENT HCP_A3  : AL,CR,FE,MN,SI,V : C,N,VA% :  !
$-------------------------------------------------------------------
     $ HCP_A3 endmember compounds with VA
$-------------------------------------------------------------------
PARAMETER G(HCP_A3,AL:VA;0) 273.00 +5481-1.8*T+GHSERAL#; 2900.00  N
REF:0 !
PARAMETER G(HCP_A3,CR:VA;0) 273.00 +4438+GHSERCR#; 6000.00  N
REF:0 !
PARAMETER G(HCP_A3,FE:VA;0) 273.00 -3705.78+12.591*T-1.15*T*LN(T)
   +0.00064*T**2+GHSERFE#; 1811.00  Y
   -3957.199+5.24951*T+0.49251E+31*T**(-9)+GHSERFE#; 6000.00  N
REF:0 !
PARAMETER G(HCP_A3,MN:VA;0) 273.00 -4439.3+133.007*T-24.5177*T*LN(T)
   -0.006*T**2+69600*T**(-1); 1519.00  Y
   -27070.1+310.7894*T-48*T*LN(T)+3.86196E+30*T**(-9); 2000.00  N
REF:66 !
PARAMETER G(HCP_A3,SI:VA;0) 273.00 +49200-20.8*T+GHSERSI#; 3600.00  N
REF:0 !
PARAMETER G(HCP_A3,V:VA;0) 273.00 +4000+2.4*T+GHSERVV#; 4000.00  N
REF:0 !
$-------------------------------------------------------------------
     $ HCP_A3 endmember compounds with C
$-------------------------------------------------------------------
PARAMETER G(HCP_A3,CR:C;0) 273.00 +GHSERCR#+0.5*GHSERCC#
   -18504+9.4173*T
   -2.4997*T*LN(T)+1.386E-3*T**2; 6000.00  N
REF:11 !
PARAMETER G(HCP_A3,FE:C;0) 273.00 +GFEFCC#+0.5*GHSERCC#
   +52905-11.9075*T; 6000.00  N
REF:11 !
PARAMETER G(HCP_A3,MN:C;0) 273.00 +GHSERMN#+0.5*GHSERCC#
   -16692+4.319*T; 6000.00  N
REF:15 !
PARAMETER G(HCP_A3,V:C;0) 273.00 -85473+182.441*T-30.551*T*LN(T)
   -0.00538998*T**2+229029*T**(-1); 6000.00  N
REF:15 !
$-------------------------------------------------------------------
     $ HCP_A3 endmember compounds with N
$-------------------------------------------------------------------
PARAMETER G(HCP_A3,AL:N;0) 273.00 +80000+GHSERAL#+0.5*GHSERNN#; 6000.00  N
REF:92 !
PARAMETER G(HCP_A3,CR:N;0) 273.00 -69000+64.69*T-3.93*T*LN(T)
   +GHSERCR#+0.5*GHSERNN#; 6000.00  N
REF:koze09 !
PARAMETER G(HCP_A3,FE:N;0) 273.00 -12015+37.98*T+GHSERFE#+0.5*GHSERNN#; 6000.00  N
REF:22 !
PARAMETER G(HCP_A3,MN:N;0) 273.00 -60607+211.1804*T-37.7331*T*LN(T)
   +129442*T**(-1); 2500.00  N
REF:22 !
PARAMETER G(HCP_A3,V:N;0) 273.00 -139000+50.4*T+GHSERVV#+0.5*GHSERNN#; 6000.00  N
REF:48 !
$******************** binary interactions ***************************
$-------------------------------------------------------------------
       $ HCP_A3 binary interactions with VA
$-------------------------------------------------------------------
PARAMETER L(HCP_A3,AL,CR:VA;0) 273.00 -35000+6*T; 6000.00  N
REF:92 !
PARAMETER L(HCP_A3,AL,MN:VA;0) 273.00 -108066+43.83*T; 6000.00  N
REF:92 !
PARAMETER L(HCP_A3,AL,MN:VA;1) 273.00 -54519.8+40*T; 6000.00  N
REF:92 !
PARAMETER L(HCP_A3,AL,SI:VA;0) 273.00 -3143.78+0.39297*T; 6000.00  N
REF:92 !
PARAMETER L(HCP_A3,AL,V:VA;0) 273.00 -95000+20*T; 6000.00  N
REF:92 !
PARAMETER L(HCP_A3,AL,V:VA;1) 273.00 -6000; 6000.00  N
REF:92 !
PARAMETER L(HCP_A3,CR,FE:VA;0) 273.00 +10833-7.477*T; 6000.00  N
REF:11 !
PARAMETER L(HCP_A3,CR,MN:VA;0) 273.00 -19088+17.5423*T; 6000.00  N
REF:22 !
PARAMETER L(HCP_A3,CR,V:VA;0) 273.00 -9874-2.6964*T; 6000.00  N
REF:68 !
PARAMETER L(HCP_A3,CR,V:VA;1) 273.00 -1720-2.5237*T; 6000.00  N
REF:68 !
PARAMETER L(HCP_A3,FE,MN:VA;0) 273.00 -5582+3.865*T; 6000.00  N
REF:15 !
PARAMETER L(HCP_A3,FE,MN:VA;1) 273.00 +273; 6000.00  N
REF:15 !
PARAMETER L(HCP_A3,FE,V:VA;0) 273.00 -15291-4.138*T; 6000.00  N
REF:15 !
PARAMETER L(HCP_A3,MN,SI:VA;0) 273.00 -72446.85; 6000.00  N
REF:pov09 !
PARAMETER L(HCP_A3,MN,V:VA;0) 273.00 -11820; 6000.00  N
REF:15 !
$-------------------------------------------------------------------
       $ HCP_A3 binary interactions with C
$-------------------------------------------------------------------
PARAMETER L(HCP_A3,CR,MN:C;0) 273.00 +60000; 6000.00  N
REF:141 !
PARAMETER L(HCP_A3,CR,V:C;0) 273.00 +17165-9.9072*T; 6000.00  N
REF:68 !
PARAMETER L(HCP_A3,CR,V:C;1) 273.00 +1e-8; 6000.00  N
REF:pov11 !
PARAMETER L(HCP_A3,CR,V:C;2) 273.00 +1e-8; 6000.00  N
REF:pov11 !
PARAMETER L(HCP_A3,FE,MN:C;0) 273.00 -2685-20*T; 6000.00  N
REF:15 !
PARAMETER L(HCP_A3,FE,V:C;0) 273.00 -15291-4.138*T; 6000.00  N
REF:15 !
$
$------------------------------------------
       $ HCP_A3 binary interactions with N
$------------------------------------------
$
PARAMETER L(HCP_A3,CR,FE:N;0) 273.00 +12826-19.48*T; 6000.00  N
REF:22 !
PARAMETER L(HCP_A3,CR,MN:N;0) 273.00 -42187+32.48*T; 6000.00  N
REF:22 !
PARAMETER L(HCP_A3,CR,V:N;0) 273.00 -9200; 6000.00  N
REF:koze09 !
$-------------------------------------------------------------------
       $ HCP_A3 binary interactions with C,VA
$-------------------------------------------------------------------
PARAMETER L(HCP_A3,CR:C,VA;0) 273.00 +4165; 6000.00  N
REF:11 !
PARAMETER L(HCP_A3,FE:C,VA;0) 273.00 -17335; 6000.00  N
REF:11 !
PARAMETER L(HCP_A3,MN:C,VA;0) 273.00 +8552-9.367*T; 6000.00  N
REF:15 !
PARAMETER L(HCP_A3,V:C,VA;0) 273.00 +12430-3.986*T; 6000.00  N
REF:15 !
$-------------------------------------------------------------------
       $ HCP_A3 binary interactions with N,VA
$-------------------------------------------------------------------
PARAMETER L(HCP_A3,CR:N,VA;0) 273.00 +21120-10.61*T; 6000.00  N
REF:22 !
PARAMETER L(HCP_A3,CR:N,VA;1) 273.00 -6204; 6000.00  N
REF:22 !
PARAMETER L(HCP_A3,FE:N,VA;0) 273.00 +10345-19.71*T; 6000.00  N
REF:22 !
PARAMETER L(HCP_A3,FE:N,VA;1) 273.00 -11130+11.84*T; 6000.00  N
REF:22 !
PARAMETER L(HCP_A3,MN:N,VA;0) 273.00 -7194-5.2075*T; 2500.00  N
REF:22 !
PARAMETER L(HCP_A3,MN:N,VA;1) 273.00 -11810+6.9538*T; 2500.00  N
REF:22 !
PARAMETER L(HCP_A3,V:N,VA;0) 273.00 -18400+4.84*T; 6000.00  N
REF:48 !
PARAMETER L(HCP_A3,V:N,VA;1) 273.00 -19700+2.13*T; 6000.00  N
REF:48 !
$******************** ternary interactions ***************************
$-------------------------------------------------------------------
       $ HCP_A3 ternary interactions with N
$-------------------------------------------------------------------
PARAMETER L(HCP_A3,CR,FE,MN:N;0) 273.00 -185400; 6000.00  N
REF:22 !
$-------------------------------------------------------------------
    $ HCP_A3 magnetic contribution
$-------------------------------------------------------------------
PARAMETER TC(HCP_A3,CR:VA;0) 273.00 -1109; 6000.00  N
REF:11 !
PARAMETER BMAGN(HCP_A3,CR:VA;0) 273.00 -2.46; 6000.00  N
REF:11 !
PARAMETER TC(HCP_A3,MN:VA;0) 273.00 -1620; 2000.00  N
REF:0 !
PARAMETER BMAGN(HCP_A3,MN:VA;0) 273.00 -1.86; 2000.00  N
REF:0 !
$
$
$##################################################################################
$                   THERMODYNAMIC PARAMETERS: CEMENTITE
$##################################################################################
$
 TYPE_DEFINITION M GES A_P_D CEMENTITE MAGNETIC  -3.0    0.28 !
 PHASE CEMENTITE  %M  2 3   1 > 
(Fe,M)C3; orthorhombic. Unit cell consists of four formula units.
In particular Cr and Mn can dissolve into cementite
in large quantities. W, V, Mo with limited solubilities. 
>> 5 !
    CONSTITUENT CEMENTITE  : AL,CR,FE%,MN,SI,V : C%,N :  !
PARAMETER G(CEMENTITE,AL:C;0) 273.00 +3*GHSERAL#+GHSERCC#+250000; 6000.00  N
REF:koze !
PARAMETER G(CEMENTITE,CR:C;0) 273.00 +3*GHSERCR#+GHSERCC#-48000-9.2888*T; 6000.00  N
REF:11 !
PARAMETER G(CEMENTITE,FE:C;0) 273.00 +GFECEM#; 6000.00  N
REF:11 !
PARAMETER G(CEMENTITE,MN:C;0) 273.00 -40379+3.524*T+3*GHSERMN#+GHSERCC#; 6000.00  N
REF:15 !
PARAMETER G(CEMENTITE,SI:C;0) 273.00 +3*GHSERSI#+GHSERCC#+250000; 6000.00  N
REF:35 !
PARAMETER G(CEMENTITE,V:C;0) 273.00 -156971+601.922*T-100.438*T*LN(T)
   +765557*T**(-1); 6000.00  N
REF:15 !
PARAMETER G(CEMENTITE,FE:N;0) 273.00 -9230+99.334*T+3*GHSERFE#+0.5*GHSERNN#; 6000.00  N
REF:26 !
$----------------------Interaction parameters----------------------
PARAMETER L(CEMENTITE,CR,FE:C;0) 273.00 +25278-17.5*T; 6000.00  N
REF:11 !
PARAMETER L(CEMENTITE,CR,MN:C;0) 273.00 +9000; 6000.00  N
REF:58 !
PARAMETER L(CEMENTITE,CR,V:C;0) 273.00 -29622-8.0892*T; 6000.00  N
REF:52 !
PARAMETER L(CEMENTITE,CR,V:C;1) 273.00 -5160-7.5711*T; 6000.00  N
REF:52 !
PARAMETER L(CEMENTITE,FE,MN:C;0) 273.00 +10434-14.281*T; 6000.00  N
REF:15 !
PARAMETER L(CEMENTITE,FE,SI:C;0) 273.00 +1E-8; 6000.00  N
REF:24 !
PARAMETER L(CEMENTITE,FE,V:C;0) 273.00 -45873-12.414*T; 6000.00  N
REF:15 !
$
$******************** magnetic contributions ***************************
$
PARAMETER TC(CEMENTITE,FE:C;0) 273.00 +485; 6000.00  N
REF:156 !
PARAMETER BMAGN(CEMENTITE,FE:C;0) 273.00 +1.008; 6000.00  N
REF:156 !
$
$
$##################################################################################
$                   THERMODYNAMIC PARAMETERS: M7C3
$##################################################################################
$
 PHASE M7C3  %  2 7   3 > 
Trigonal Cr-rich carbide with a large crystallographic unit cell. 
In particular Fe- and Mn-solubilities. 
>> 5 !
    CONSTITUENT M7C3  : CR%,FE,MN,SI,V : C :  !
PARAMETER G(M7C3,CR:C;0) 273.00 +GCRM7C3#; 6000.00  N
REF:11 !
PARAMETER G(M7C3,FE:C;0) 273.00 +7*GHSERFE#+3*GHSERCC#
   +75000-48.2168*T; 6000.00  N
REF:11 !
PARAMETER G(M7C3,MN:C;0) 273.00 -111765+13.092*T+7*GHSERMN#+3*GHSERCC#; 6000.00  N
REF:15 !
PARAMETER G(M7C3,SI:C;0) 273.00 +7*GHSERSI#+3*GHSERCC#+250000; 6000.00  N
REF:pov11 !
PARAMETER G(M7C3,V:C;0) 273.00 -454245+1518.48*T-250.981*T*LN(T)
   +2148691*T**(-1); 6000.00  N
REF:15 !
$----------------------Interaction parameters----------------------
PARAMETER L(M7C3,CR,FE:C;0) 273.00 -4520-10*T; 6000.00  N
REF:11 !
PARAMETER L(M7C3,CR,MN:C;0) 273.00 +72737-56.4964*T; 6000.00  N
REF:58 !
PARAMETER L(M7C3,CR,V:C;0) 273.00 -110271; 6000.00  N
REF:68 !
PARAMETER L(M7C3,FE,MN:C;0) 273.00 -43057+4.0625*T; 6000.00  N
REF:58 !
PARAMETER L(M7C3,CR,FE,V:C;0) 273.00 -250158; 6000.00  N
REF:68 !
$
$##################################################################################
$                   THERMODYNAMIC PARAMETERS: M23C6 
$##################################################################################
$
 PHASE M23C6  %  3 20   3   6 > 
Face-centered cubic Cr-rich carbide, can contain significant amounts
of W, Mo, V, Ni. Has a large crystallographic unit cell. 
Common equilibrium carbide in 9-12 mass.% Cr-steels. 
Precipitation predominantly on prior austenite grain boundaries and lath boundaries. 
>> 5 !
    CONSTITUENT M23C6  : CR%,FE%,MN,V : CR%,FE%,MN,V : C% :  !
PARAMETER G(M23C6,CR:CR:C;0) 273.00 +GCRM23C6#; 6000.00  N
REF:11 !
PARAMETER G(M23C6,CR:FE:C;0) 273.00 +0.8695652*GCRM23C6#
   +0.1304348*GFEM23C6#; 6000.00  N
REF:11 !
PARAMETER G(M23C6,CR:MN:C;0) 273.00 +0.8695652*GCRM23C6#
   +0.1304348*GMNM23C6#; 6000.00  N
REF:58 !
PARAMETER G(M23C6,CR:V:C;0) 273.00 +0.869565217*GCRM23C6#
   +0.130435*GVM23C6#; 6000.00  N
REF:52 !
PARAMETER G(M23C6,FE:CR:C;0) 273.00 +0.1304348*GCRM23C6#
   +0.8695652*GFEM23C6#; 6000.00  N
REF:11 !
PARAMETER G(M23C6,FE:FE:C;0) 273.00 +GFEM23C6#; 6000.00  N
REF:11 !
PARAMETER G(M23C6,FE:MN:C;0) 273.00 +0.869565*GFEM23C6#
   +0.130435*GMNM23C6#; 6000.00  N
REF:15 !
PARAMETER G(M23C6,FE:V:C;0) 273.00 +0.869565*GFEM23C6#
   +0.130435*GVM23C6#; 6000.00  N
REF:15 !
PARAMETER G(M23C6,MN:CR:C;0) 273.00 +0.8695652*GMNM23C6#
   +0.1304348*GCRM23C6#; 6000.00  N
REF:58 !
PARAMETER G(M23C6,MN:FE:C;0) 273.00 +0.869565*GMNM23C6#
   +0.130435*GFEM23C6#; 6000.00  N
REF:15 !
PARAMETER G(M23C6,MN:MN:C;0) 273.00 +GMNM23C6#; 6000.00  N
REF:15 !
PARAMETER G(M23C6,MN:V:C;0) 273.00 +0.869565*GMNM23C6#
   +0.130435*GVM23C6#; 6000.00  N
REF:15 !
PARAMETER G(M23C6,V:CR:C;0) 273.00 +0.869565217*GVM23C6#
   +0.130435*GCRM23C6#; 6000.00  N
REF:52 !
PARAMETER G(M23C6,V:FE:C;0) 273.00 +0.869565*GVM23C6#
   +0.130435*GFEM23C6#; 6000.00  N
REF:15 !
PARAMETER G(M23C6,V:MN:C;0) 273.00 +0.869565*GVM23C6#
   +0.130435*GMNM23C6#; 6000.00  N
REF:15 !
PARAMETER G(M23C6,V:V:C;0) 273.00 +GVM23C6#; 6000.00  N
REF:15 !
$----------------------Interaction parameters----------------------
PARAMETER L(M23C6,CR,FE:CR:C;0) 273.00 -205342+141.6667*T; 6000.00  N
REF:11 !
PARAMETER L(M23C6,CR,FE:FE:C;0) 273.00 -205342+141.6667*T; 6000.00  N
REF:11 !
PARAMETER L(M23C6,CR,FE:MN:C;0) 273.00 -205342+141.6667*T; 6000.00  N
REF:58 !
PARAMETER L(M23C6,CR,MN:CR:C;0) 273.00 -173680+160*T; 6000.00  N
REF:58 !
PARAMETER L(M23C6,CR,MN:CR:C;1) 273.00 -286614; 6000.00  N
REF:58 !
PARAMETER L(M23C6,CR,MN:FE:C;0) 273.00 -173680+160*T; 6000.00  N
REF:58 !
PARAMETER L(M23C6,CR,MN:FE:C;1) 273.00 -286614; 6000.00  N
REF:58 !
PARAMETER L(M23C6,CR,MN:MN:C;0) 273.00 -173680+160*T; 6000.00  N
REF:58 !
PARAMETER L(M23C6,CR,MN:MN:C;1) 273.00 -286614; 6000.00  N
REF:58 !
PARAMETER L(M23C6,FE,MN:CR,FE:C;0) 273.00 -100000; 6000.00  N
REF:58 !
PARAMETER L(M23C6,FE,MN:CR,MN:C;0) 273.00 -100000; 6000.00  N
REF:58 !
PARAMETER L(M23C6,FE,MN:FE,MN:C;0) 273.00 -100000; 6000.00  N
REF:15 !
PARAMETER L(M23C6,CR,FE:V:C;0) 273.00 -205342+141.6667*T; 6000.00  N
REF:52 !
PARAMETER L(M23C6,CR,V:CR:C;0) 273.00 -382069; 6000.00  N
REF:52 !
PARAMETER L(M23C6,CR,V:FE:C;0) 273.00 -382069; 6000.00  N
REF:52 !
PARAMETER L(M23C6,CR,FE,V:CR:C;0) 273.00 -1499585; 6000.00  N
REF:52 !
PARAMETER L(M23C6,CR,FE,V:FE:C;0) 273.00 -1499585; 6000.00  N
REF:52 !
PARAMETER L(M23C6,CR,FE,V:V:C;0) 273.00 -1499585; 6000.00  N
REF:52 !
PARAMETER L(M23C6,CR,V:V:C;0) 273.00 -382069; 6000.00  N
REF:52 !
$
$
$##################################################################################
$                   THERMODYNAMIC PARAMETERS: ALN
$##################################################################################
$
 PHASE ALN  %  2 1   1 > 
AlN phase description based on assessed solubility product, 
specifically designed for applications to thermokinetic precipitation simulations 
in microalloyed steels. 
>> 4 !
    CONSTITUENT ALN  : AL : N :  !
PARAMETER G(ALN,AL:N;0) 273.00 -262982+63*T+GHSERAL#+GHSERNN#; 6000.00  N
REF:Kozeschnik/Radis 2008 !
$