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NI_AL_DUPIN_2001.TDB
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NI_AL_DUPIN_2001.TDB
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$ Database file written 2014-10-21
$ From database: USER
ELEMENT /- ELECTRON_GAS 0.0000E+00 0.0000E+00 0.0000E+00!
ELEMENT VA VACUUM 0.0000E+00 0.0000E+00 0.0000E+00!
ELEMENT AL FCC_A1 2.6982E+01 4.5773E+03 2.8322E+01!
ELEMENT NI FCC_A1 5.8690E+01 4.7870E+03 2.9796E+01!
FUNCTION F154T 2.98150E+02 +323947.58-25.1480943*T-20.859*T*LN(T)
+4.5665E-05*T**2-3.942E-09*T**3-24275.5*T**(-1); 4.30000E+03 Y
+342017.233-54.0526109*T-17.7891*T*LN(T)+6.822E-05*T**2
-1.91111667E-08*T**3-14782200*T**(-1); 8.20000E+03 Y
+542396.07-411.214335*T+22.2419*T*LN(T)-.00349619*T**2+4.0491E-08*T**3
-2.0366965E+08*T**(-1); 1.00000E+04 N !
FUNCTION F625T 2.98150E+02 +496408.232+35.479739*T-41.6397*T*LN(T)
+.00249636*T**2-4.90507333E-07*T**3+85390.3*T**(-1); 9.00000E+02 Y
+497613.221+17.368131*T-38.85476*T*LN(T)-2.249805E-04*T**2
-9.49003167E-09*T**3-5287.23*T**(-1); 2.80000E+03 N !
FUNCTION GHSERAL 2.98150E+02 -7976.15+137.093038*T-24.3671976*T*LN(T)
-.001884662*T**2-8.77664E-07*T**3+74092*T**(-1); 7.00000E+02 Y
-11276.24+223.048446*T-38.5844296*T*LN(T)+.018531982*T**2
-5.764227E-06*T**3+74092*T**(-1); 9.33600E+02 Y
-11278.378+188.684153*T-31.748192*T*LN(T)-1.231E+28*T**(-9);
6.00000E+03 N !
FUNCTION GBCCAL 2.98150E+02 +10083-4.813*T+GHSERAL#; 6.00000E+03 N
!
FUNCTION LB2ALVA 2.98150E+02 150000; 6.00000E+03 N !
FUNCTION B2ALVA 2.98150E+02 +10000-T; 6.00000E+03 N !
FUNCTION F13191T 2.98150E+02 +417658.868-44.7777921*T-20.056*T*LN(T)
-.0060415*T**2+1.24774E-06*T**3-16320*T**(-1); 8.00000E+02 Y
+413885.448+9.41787679*T-28.332*T*LN(T)+.00173115*T**2-8.399E-08*T**3
+289050*T**(-1); 3.90000E+03 Y
+440866.732-62.5810038*T-19.819*T*LN(T)+5.067E-04*T**2
-4.93233333E-08*T**3-15879735*T**(-1); 7.60000E+03 Y
+848806.287-813.398164*T+64.69*T*LN(T)-.00731865*T**2
+8.71833333E-08*T**3-3.875846E+08*T**(-1); 1.00000E+04 N !
FUNCTION F13265T 2.98150E+02 +638073.279-68.1901928*T-24.897*T*LN(T)
-.0313584*T**2+5.93355333E-06*T**3-14215*T**(-1); 8.00000E+02 Y
+611401.772+268.084821*T-75.25401*T*LN(T)+.01088525*T**2
-7.08741667E-07*T**3+2633835*T**(-1); 2.10000E+03 Y
+637459.339+72.0712678*T-48.587*T*LN(T)-9.09E-05*T**2
+9.12933333E-08*T**3-1191755*T**(-1); 4.50000E+03 Y
+564540.781+329.599011*T-80.11301*T*LN(T)+.00578085*T**2
-1.08841667E-07*T**3+29137900*T**(-1); 6.00000E+03 N !
FUNCTION GHSERNI 2.98140E+02 -5179.159+117.854*T-22.096*T*LN(T)
-.0048407*T**2; 1.72800E+03 Y
-27840.655+279.135*T-43.1*T*LN(T)+1.12754E+31*T**(-9); 6.00000E+03 N
!
FUNCTION GBCCNI 2.98150E+02 +8715.084-3.556*T+GHSERNI#; 6.00000E+03
N !
FUNCTION LB2NIVA 2.98150E+02 -64024.38+26.49419*T; 6.00000E+03 N !
FUNCTION B2NIVA 2.98150E+02 +162397.3-27.40575*T; 6.00000E+03 N !
FUNCTION LB2ALNI 2.98150E+02 -52440.88+11.30117*T; 6.00000E+03 N !
FUNCTION B2ALNI 2.98150E+02 -152397.3+26.40575*T; 6.00000E+03 N !
FUNCTION ALNI3 2.98150E+02 +3*U1ALNI#; 6.00000E+03 N !
FUNCTION AL3NI 2.98150E+02 +3*U1ALNI#; 6.00000E+03 N !
FUNCTION AL2NI2 2.98150E+02 +4*U1ALNI#; 6.00000E+03 N !
FUNCTION L04ALNI 2.98150E+02 +U3ALNI#; 6.00000E+03 N !
FUNCTION L14ALNI 2.98150E+02 +U4ALNI#; 6.00000E+03 N !
FUNCTION U3ALNI 298.15 0.0; 6000.00 N !
FUNCTION U4ALNI 2.98150E+02 +7203.60609-3.7427303*T; 6.00000E+03 N
!
FUNCTION U1ALNI 2.98150E+02 +2*UNTIER#*UALNI#; 6.00000E+03 N !
FUNCTION UNTIER 2.98150E+02 +TROIS#**(-1); 6.00000E+03 N !
FUNCTION UALNI 2.98150E+02 -22212.8931+4.39570389*T; 6.00000E+03
N !
FUNCTION TROIS 2.98150E+02 3; 6.00000E+03 N !
FUNCTION UN_ASS 298.15 0; 300 N !
TYPE_DEFINITION % SEQ *!
DEFINE_SYSTEM_DEFAULT ELEMENT 2 !
DEFAULT_COMMAND DEF_SYS_ELEMENT VA /- !
PHASE LIQUID % 1 1.0 !
CONSTITUENT LIQUID :AL,NI : !
PARAMETER G(LIQUID,AL;0) 2.98130E+02 +11005.029-11.841867*T
+7.934E-20*T**7+GHSERAL#; 9.33600E+02 Y
+10482.382-11.253974*T+1.231E+28*T**(-9)+GHSERAL#; 6.00000E+03 N REF3 !
PARAMETER G(LIQUID,NI;0) 2.98130E+02 +16414.686-9.397*T
-3.82318E-21*T**7+GHSERNI#; 1.72800E+03 Y
+18290.88-10.537*T-1.12754E+31*T**(-9)+GHSERNI#; 6.00000E+03 N REF3 !
PARAMETER G(LIQUID,AL,NI;0) 2.98150E+02 -207109.28+41.31501*T;
6.00000E+03 N REF7 !
PARAMETER G(LIQUID,AL,NI;1) 2.98150E+02 -10185.79+5.8714*T;
6.00000E+03 N REF7 !
PARAMETER G(LIQUID,AL,NI;2) 2.98150E+02 +81204.81-31.95713*T;
6.00000E+03 N REF7 !
PARAMETER G(LIQUID,AL,NI;3) 2.98150E+02 +4365.35-2.51632*T;
6.00000E+03 N REF7 !
PARAMETER G(LIQUID,AL,NI;4) 2.98150E+02 -22101.64+13.16341*T;
6.00000E+03 N REF7 !
PHASE AL3NI1 % 2 .75 .25 !
CONSTITUENT AL3NI1 :AL : NI : !
PARAMETER G(AL3NI1,AL:NI;0) 2.98150E+02 -48483.73+12.29913*T
+.75*GHSERAL#+.25*GHSERNI#; 6.00000E+03 N REF7 !
PHASE AL3NI2 % 3 3 2 1 !
CONSTITUENT AL3NI2 :AL : AL,NI : NI,VA : !
PARAMETER G(AL3NI2,AL:AL:NI;0) 2.98150E+02 +5*GBCCAL#+GBCCNI#-39465.978
+7.89525*T; 6.00000E+03 N REF7 !
PARAMETER G(AL3NI2,AL:NI:NI;0) 2.98150E+02 +3*GBCCAL#+3*GBCCNI#
-427191.9+79.21725*T; 6.00000E+03 N REF7 !
PARAMETER G(AL3NI2,AL:AL:VA;0) 2.98150E+02 +5*GBCCAL#+30000-3*T;
6.00000E+03 N REF7 !
PARAMETER G(AL3NI2,AL:NI:VA;0) 2.98150E+02 +3*GBCCAL#+2*GBCCNI#
-357725.92+68.322*T; 6.00000E+03 N REF7 !
PARAMETER G(AL3NI2,AL:AL,NI:*;0) 2.98150E+02 -193484.18+131.79*T;
6.00000E+03 N REF7 !
$ PARAMETER G(AL3NI2,AL:AL,NI:NI;0) 2.98150E+02 -193484.18+131.79*T;
$ 6.00000E+03 N REF7 !
$ PARAMETER G(AL3NI2,AL:AL,NI:VA;0) 2.98150E+02 -193484.18+131.79*T;
$ 6.00000E+03 N REF7 !
PARAMETER G(AL3NI2,AL:*:NI,VA;0) 2.98150E+02 -22001.7+7.0332*T;
6.00000E+03 N REF7 !
$ PARAMETER G(AL3NI2,AL:AL:NI,VA;0) 2.98150E+02 -22001.7+7.0332*T;
$ 6.00000E+03 N REF7 !
$ PARAMETER G(AL3NI2,AL:NI:NI,VA;0) 2.98150E+02 -22001.7+7.0332*T;
$ 6.00000E+03 N REF7 !
PHASE AL3NI5 % 2 .375 .625 !
CONSTITUENT AL3NI5 :AL : NI : !
PARAMETER G(AL3NI5,AL:NI;0) 2.98150E+02 +.375*GHSERAL#+.625*GHSERNI#
-55507.7594+7.2648103*T; 6.00000E+03 N REF7 !
TYPE_DEFINITION & GES A_P_D BCC_A2 MAGNETIC -1.0 4.00000E-01 !
PHASE BCC_A2 %& 2 1 3 !
CONSTITUENT BCC_A2 :AL,NI,VA : VA : !
PARAMETER G(BCC_A2,AL:VA;0) 2.98150E+02 +GBCCAL#; 6.00000E+03 N
REF3 !
PARAMETER G(BCC_A2,NI:VA;0) 2.98150E+02 +GBCCNI#; 6.00000E+03 N
REF3 !
PARAMETER TC(BCC_A2,NI:VA;0) 2.98150E+02 575; 6.00000E+03 N REF2 !
PARAMETER BMAGN(BCC_A2,NI:VA;0) 2.98150E+02 .85; 6.00000E+03 N REF2 !
PARAMETER G(BCC_A2,VA:VA;0) 298.15 0; 6000 N!
PARAMETER G(BCC_A2,AL,VA:VA;0) 2.98150E+02 +B2ALVA#+LB2ALVA#;
6.00000E+03 N REF8 !
PARAMETER G(BCC_A2,AL,NI:VA;0) 2.98150E+02 +B2ALNI#+LB2ALNI#;
6.00000E+03 N REF8 !
PARAMETER G(BCC_A2,NI,VA:VA;0) 2.98150E+02 +B2NIVA#+LB2NIVA#;
6.00000E+03 N REF8 !
$ THIS PHASE HAS A DISORDERED CONTRIBUTION FROM BCC_A2
TYPE_DEFINITION ' GES A_P_D BCC_B2 DIS_PART BCC_A2 ,,,!
TYPE_DEFINITION ( GES A_P_D BCC_B2 MAGNETIC -1.0 4.00000E-01 !
PHASE BCC_B2 %(' 3 .5 .5 3 !
CONSTITUENT BCC_B2 :AL,NI,VA : AL,NI,VA : VA : !
PARAMETER G(BCC_B2,AL:AL:VA;0) 298.15 0; 6000 N!
PARAMETER G(BCC_B2,NI:AL:VA;0) 2.98150E+02 +.5*B2ALNI#-.5*LB2ALNI#;
6.00000E+03 N REF8 !
PARAMETER G(BCC_B2,VA:AL:VA;0) 2.98150E+02 +.5*B2ALVA#-.5*LB2ALVA#;
6.00000E+03 N REF8 !
PARAMETER G(BCC_B2,AL:NI:VA;0) 2.98150E+02 +.5*B2ALNI#-.5*LB2ALNI#;
6.00000E+03 N REF8 !
PARAMETER G(BCC_B2,NI:NI:VA;0) 298.15 0; 6000 N!
PARAMETER G(BCC_B2,VA:NI:VA;0) 2.98150E+02 +.5*B2NIVA#-.5*LB2NIVA#;
6.00000E+03 N REF8 !
PARAMETER G(BCC_B2,AL:VA:VA;0) 2.98150E+02 +.5*B2ALVA#-.5*LB2ALVA#;
6.00000E+03 N REF8 !
PARAMETER G(BCC_B2,NI:VA:VA;0) 2.98150E+02 +.5*B2NIVA#-.5*LB2NIVA#;
6.00000E+03 N REF8 !
PARAMETER G(BCC_B2,VA:VA:VA;0) 298.15 0; 6000 N!
TYPE_DEFINITION ) GES A_P_D FCC_A1 MAGNETIC -3.0 2.80000E-01 !
PHASE FCC_A1 %) 2 1 1 !
CONSTITUENT FCC_A1 :AL,NI : VA : !
PARAMETER G(FCC_A1,AL:VA;0) 2.98150E+02 +GHSERAL#; 6.00000E+03 N
REF3 !
PARAMETER G(FCC_A1,NI:VA;0) 2.98150E+02 +GHSERNI#; 6.00000E+03 N
REF3 !
PARAMETER TC(FCC_A1,NI:VA;0) 2.98150E+02 633; 6.00000E+03 N REF2 !
PARAMETER BMAGN(FCC_A1,NI:VA;0) 2.98150E+02 .52; 6.00000E+03 N REF2 !
PARAMETER TC(FCC_A1,AL,NI:VA;0) 2.98150E+02 -1112; 6.00000E+03 N
REF7 !
PARAMETER TC(FCC_A1,AL,NI:VA;1) 2.98150E+02 1745; 6.00000E+03 N
REF7 !
PARAMETER G(FCC_A1,AL,NI:VA;0) 2.98150E+02 -162407.75+16.212965*T;
6.00000E+03 N REF7 !
PARAMETER G(FCC_A1,AL,NI:VA;1) 2.98150E+02 +73417.798-34.914168*T;
6.00000E+03 N REF7 !
PARAMETER G(FCC_A1,AL,NI:VA;2) 2.98150E+02 +33471.014-9.8373558*T;
6.00000E+03 N REF7 !
PARAMETER G(FCC_A1,AL,NI:VA;3) 2.98150E+02 -30758.01+10.25267*T;
6.00000E+03 N REF7 !
$ THIS PHASE HAS A DISORDERED CONTRIBUTION FROM FCC_A1
TYPE_DEFINITION * GES A_P_D FCC_L12 DIS_PART FCC_A1 ,,,!
TYPE_DEFINITION + GES A_P_D FCC_L12 MAGNETIC -3.0 2.80000E-01 !
PHASE FCC_L12 %*+ 3 .75 .25 1 !
CONSTITUENT FCC_L12 :AL,NI : AL,NI : VA : !
PARAMETER G(FCC_L12,AL:AL:VA;0) 298.15 0; 6000 N!
PARAMETER G(FCC_L12,NI:AL:VA;0) 2.98150E+02 +ALNI3#; 6.00000E+03 N
REF9 !
PARAMETER G(FCC_L12,AL:NI:VA;0) 2.98150E+02 +AL3NI#; 6.00000E+03 N
REF9 !
PARAMETER G(FCC_L12,NI:NI:VA;0) 298.15 0; 6000 N!
PARAMETER G(FCC_L12,AL,NI:AL:VA;0) 2.98150E+02 -1.5*ALNI3#+1.5*AL2NI2#
+1.5*AL3NI#; 6.00000E+03 N REF9 !
PARAMETER G(FCC_L12,AL,NI:AL:VA;1) 2.98150E+02 +.5*ALNI3#-1.5*AL2NI2#
+1.5*AL3NI#; 6.00000E+03 N REF9 !
PARAMETER G(FCC_L12,AL,NI:NI:VA;0) 2.98150E+02 +1.5*ALNI3#+1.5*AL2NI2#
-1.5*AL3NI#; 6.00000E+03 N REF9 !
PARAMETER G(FCC_L12,AL,NI:NI:VA;1) 2.98150E+02 -1.5*ALNI3#+1.5*AL2NI2#
-.5*AL3NI#; 6.00000E+03 N REF9 !
PARAMETER G(FCC_L12,*:AL,NI:VA;0) 2.98150E+02 +L04ALNI#; 6.00000E+03
N REF9 !
PARAMETER G(FCC_L12,*:AL,NI:VA;1) 2.98150E+02 +L14ALNI#; 6.00000E+03
N REF9 !
PARAMETER G(FCC_L12,AL,NI:*:VA;0) 2.98150E+02 +3*L04ALNI#;
6.00000E+03 N REF9 !
PARAMETER G(FCC_L12,AL,NI:*:VA;1) 2.98150E+02 +3*L14ALNI#;
6.00000E+03 N REF9 !
LIST_OF_REFERENCES
NUMBER SOURCE
REF10 'AL1<G> CODATA KEY VALUES SGTE ** ALUMINIUM <GAS> Cp values
similar in Codata Key Values and IVTAN Vol. 3'
REF11 'AL2<G> CHATILLON(1992) Enthalpy of formation for Al1<g> taken
from Codata Key Values. Enthalpy of form. from TPIS dissociation
energy mean Value corrected with new fef from Sunil K.K. and Jordan
K.D. (J.Phys. Chem. 92(1988)2774) ab initio calculations.'
REF3 'Alan Dinsdale, SGTE Data for Pure Elements, NPL Report DMA(A)195
Rev. August 1990'
REF8 'N. Dupin, I. Ansara, Z. metallkd., Vol 90 (1999) p 76-85; Al-Ni'
REF14 'NI1<G> T.C.R.A.S Class: 1 Data provided by T.C.R.A.S. October 1996'
REF15 'NI2<G> T.C.R.A.S Class: 5 Data provided by T.C.R.A.S. October 1996'
REF2 'Alan Dinsdale, SGTE Data for Pure Elements, NPL Report DMA(A)195
September 1989'
REF7 'N. Dupin, Thesis, LTPCM, France, 1995; Al-Ni, also in I. Ansara,
N. Dupin, H.L. Lukas, B. SUndman J. Alloys Compds, 247 (1-2), 20-30
(1997)'
REF9 ' N. Dupin, I. Ansara, B. Sundman Thermodynamic Re-Assessment of
the Ternary System Al-Cr-Ni, Calphad, 25 (2), 279-298 (2001); Al-Cr
-Ni'
!