3081 lines
132 KiB
Plaintext
3081 lines
132 KiB
Plaintext
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$ Version 4.4 of Unary database - 20 July 2001
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$TITLE=SGTE Unary Database version v4.4 - 20 July 2001
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$ General changes since version 3.0:
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$ Revised data for Ag CUB_A13
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$ New data for BCT_A5
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$ New data for Al HCP_ZN
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$ New data for As RED_P
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$ New data for B BCC_A2
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$ Revised data for GRAPHITE
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$ New data for Bi BIIN_EPSILON
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$ New data for Cd RHOMBO_A10, BCT_A5
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$ New data for Ce HCP_A3, DHCP
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$ New data for Cr HCP_ZN
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$ New data for Cu HCP_ZN
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$ Revised data for HCP_A3
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$ New data for Er BCC_A2
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$ New data for Fe ORTHORHOMBIC_A20, TETRAGONAL_U
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$ Revised data FCC_A1, HCP_A3
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$ New data for Gd FCC_A1
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$ New data for Ge RHOMBOHEDRAL_A7, BCT_A5
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$ New data for Hg TETRAGONAL_A6, HCP_A3
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$ Revised data for Ho BCC_A2, LIQUID
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$ New data for In BCT_A5, RHOMBOHEDRAL_A7, BIIN_EPSILON, HCP_ZN
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$ Revised data for FCC_A1, TET_ALPHA1
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$ New data for Mg HCP_ZN
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$ Revised data for Mn CBCC_A12, CUB_A13, FCC_A1, BCC_A2, LIQUID, HCP_A3
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$ Remove LAVES_C14
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$ New data for Nd HCP_A3
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$ Revised data for Os BCC_A2
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$ New data for P RHOMBOHEDRAL_A7
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$ Revised data for Pb RHOMBOHEDRAL_A7, TETRAGONAL_A6, TET_ALPHA1
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$ Revised data for Re BCC_A2
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$ Revised data for Ru BCC_A2
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$ Revised data for S ORTHORHOMBIC_S, MONOCLINIC, LIQUID
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$ New data for Sc DHCP, FCC_A1
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$ New data for Si HCP_ZN
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$ New data for Sm HCP_A3
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$ Phase name change RHOMB to RHOMB_C19
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$ New data for Sn TETRAGONAL_A6, HCP_ZN, CBCC_A12, CUB_A13
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$ Revised data for HCP_A3
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$ Revised data for Th FCC_A1, BCC_A2, LIQUID
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$ New data for U FCC_A1, HCP_A3
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$ New data for Y FCC_A1
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$ New data for Zn RHOMBOHEDRAL_A7, HCP_ZN, CBCC_A12, CUB_A13
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$ Revised data for HCP_A3, TETRAGONAL_A6
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$ New data for Zr CUB_A13, CBCC_A12, ORTHORHOMBIC_A20, TETRAGONAL_U
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PHASE ALPHA_PU I 1 1 !
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PHASE BCT_A5 I 1 1 !
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PHASE BETA_PU I 1 1 !
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PHASE BETA_RHOMBO_B I 1 1 !
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PHASE CBCC_A12 I 2 1 1 !
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PHASE CUB_A13 I 2 1 1 !
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PHASE BCC_A2 I 2 1 3 !
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PHASE BCT_AA I 1 1 !
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PHASE DHCP I 1 1 !
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PHASE DIAMOND_A4 I 1 1 !
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PHASE FCC_A1 I 2 1 1 !
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PHASE GAMMA_PU I 1 1 !
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PHASE GAS % 1 1 !
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PHASE GRAPHITE I 1 1 !
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PHASE HCP_A3 I 2 1 .5 !
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PHASE HCP_ZN % 2 1 .5 !
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PHASE HEXAGONAL_A8 I 1 1 !
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PHASE LIQUID I 1 1 !
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PHASE MONOCLINIC I 1 1 !
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PHASE OMEGA I 1 1 !
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PHASE ORTHORHOMBIC_GA I 1 1 !
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PHASE ORTHORHOMBIC_S I 1 1 !
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PHASE ORTHORHOMBIC_A20 I 1 1 !
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PHASE ORTHO_AC I 1 1 !
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PHASE RED_P I 1 1 !
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PHASE RHOMB_C19 I 1 1 !
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PHASE RHOMBOHEDRAL_A7 I 1 1 !
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PHASE RHOMBO_A10 I 1 1 !
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PHASE TETRAGONAL_U I 1 1 !
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PHASE TETRAGONAL_A6 I 1 1 !
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PHASE TETRAG_AD I 1 1 !
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PHASE TET_ALPHA1 I 1 1 !
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PHASE WHITE_P I 1 1 !
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$ Ag
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$ -------------------------------------
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PARAMETER G(FCC_A1,AG:VA;0) 298.15
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-7209.512+118.202013*T-23.8463314*T*LN(T)-1.790585E-3*T**2-0.398587E-6*T**3
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-12011*T**(-1); 1234.93 Y
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-15095.252+190.266404*T-33.472*T*LN(T)+1411.773E26*T**(-9); 3000.00 N !
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PARAMETER G(HCP_A3,AG:VA;0) 298.15
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-6909.512+118.502013*T-23.8463314*T*LN(T)-1.790585E-3*T**2-0.398587E-6*T**3
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-12011*T**(-1); 1234.93 Y
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-14795.252+190.566404*T-33.472*T*LN(T)+1411.773E26*T**(-9); 3000.00 N !
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PARAMETER G(BCC_A2,AG:VA;0) 298.15
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-3809.512+117.152013*T-23.8463314*T*LN(T)-1.790585E-3*T**2-0.398587E-6*T**3
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-12011*T**(-1); 1234.93 Y
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-11695.252+189.216404*T-33.472*T*LN(T)+1411.773E26*T**(-9); 3000.00 N !
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PARAMETER G(LIQUID,AG;0) 298.15
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3815.564+109.310993*T-23.8463314*T*LN(T)-1.790585E-3*T**2-0.398587E-6*T**3
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-12011*T**(-1)-1033.905E-23*T**7; 1234.93 Y
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-3587.111+180.964656*T-33.472*T*LN(T); 3000.00 N !
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$ Source of data: Assessment of the Ag-Al system
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$ S S Lim, P L Rossiter and J W Tibballs; CALPHAD, 1995, 19(2),
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$ 131-142. "Assessment of the Al-Ag binary phase diagram"
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PARAMETER G(CUB_A13,AG:VA;0) 298.15
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-3809.512+117.152013*T-23.8463314*T*LN(T)-1.790585E-3*T**2-0.398587E-6*T**3
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-12011*T**(-1); 1234.93 Y
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-11695.252+189.216404*T-33.472*T*LN(T)+1411.773E26*T**(-9); 3000.00 N !
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$ Oh, Shim, Lee and Lee
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$ J. Alloys Compounds, 1996, 238, 155-66
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$ A thermodynamic study on the Ag-Sb-Sn system
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PARAMETER G(BCT_A5,AG;0) 298.15
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-3025.412+118.202013*T-23.8463314*T*LN(T)-1.790585E-3*T**2-0.398587E-6*T**3
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-12011*T**(-1); 1234.93 Y
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-10911.152+190.266404*T-33.472*T*LN(T)+1411.773E26*T**(-9); 3000.00 N !
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$ -------------------------------------
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$ Al
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$ -------------------------------------
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PARAMETER G(FCC_A1,AL:VA;0) 298.15
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-7976.15+137.093038*T-24.3671976*T*LN(T)-1.884662E-3*T**2-0.877664E-6*T**3
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+74092*T**(-1); 700.00 Y
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-11276.24+223.048446*T-38.5844296*T*LN(T)+18.531982E-3*T**2-5.764227E-6*T**3
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+74092*T**(-1); 933.47 Y
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-11278.378+188.684153*T-31.748192*T*LN(T)-1230.524E25*T**(-9); 2900.00 N !
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PARAMETER G(HCP_A3,AL:VA;0) 298.15
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-2495.15+135.293038*T-24.3671976*T*LN(T)-1.884662E-3*T**2-0.877664E-6*T**3
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+74092*T**(-1); 700.00 Y
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-5795.24+221.248446*T-38.5844296*T*LN(T)+18.531982E-3*T**2-5.764227E-6*T**3
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+74092*T**(-1); 933.47 Y
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-5797.378+186.884153*T-31.748192*T*LN(T)-1230.524E25*T**(-9); 2900.00 N !
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$ Introduced for version 4.1 of database
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PARAMETER G(HCP_ZN,AL:VA;0) 298.15
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-2495.15+135.293038*T-24.3671976*T*LN(T)-1.884662E-3*T**2-0.877664E-6*T**3
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+74092*T**(-1); 700.00 Y
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-5795.24+221.248446*T-38.5844296*T*LN(T)+18.531982E-3*T**2-5.764227E-6*T**3
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+74092*T**(-1); 933.47 Y
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-5797.378+186.884153*T-31.748192*T*LN(T)-1230.524E25*T**(-9); 2900.00 N !
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PARAMETER G(CBCC_A12,AL:VA;0) 298.15
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2107.25+132.280038*T-24.3671976*T*LN(T)-1.884662E-3*T**2-0.877664E-6*T**3
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+74092*T**(-1); 700.00 Y
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-1192.84+218.235446*T-38.5844296*T*LN(T)+18.531982E-3*T**2-5.764227E-6*T**3
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+74092*T**(-1); 933.47 Y
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-1194.978+183.871153*T-31.748192*T*LN(T)-1230.524E25*T**(-9); 2900.00 N !
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PARAMETER G(BCC_A2,AL:VA;0) 298.15
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2106.85+132.280038*T-24.3671976*T*LN(T)-1.884662E-3*T**2-0.877664E-6*T**3
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+74092*T**(-1); 700.00 Y
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-1193.24+218.235446*T-38.5844296*T*LN(T)+18.531982E-3*T**2-5.764227E-6*T**3
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+74092*T**(-1); 933.47 Y
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-1195.378+183.871153*T-31.748192*T*LN(T)-1230.524E25*T**(-9); 2900.00 N !
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PARAMETER G(CUB_A13,AL:VA;0) 298.15
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2944.29+132.281438*T-24.3671976*T*LN(T)-1.884662E-3*T**2-0.877664E-6*T**3
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+74092*T**(-1); 700.00 Y
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-355.8+218.236846*T-38.5844296*T*LN(T)+18.531982E-3*T**2-5.764227E-6*T**3
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+74092*T**(-1); 933.47 Y
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-357.938+183.872553*T-31.748192*T*LN(T)-1230.524E25*T**(-9); 2900.00 N !
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PARAMETER G(LIQUID,AL;0) 298.15
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3028.879+125.251171*T-24.3671976*T*LN(T)-1.884662E-3*T**2-0.877664E-6*T**3
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+74092*T**(-1)+79.337E-21*T**7; 700.00 Y
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-271.21+211.206579*T-38.5844296*T*LN(T)+18.531982E-3*T**2-5.764227E-6*T**3
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+74092*T**(-1)+79.337E-21*T**7; 933.47 Y
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-795.996+177.430178*T-31.748192*T*LN(T); 2900.00 N !
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$ From COST507 database
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PARAMETER G(BCT_A5,AL;0) 298.15
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2106.85+132.280038*T-24.3671976*T*LN(T)-1.884662E-3*T**2-0.877664E-6*T**3
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+74092*T**(-1); 700.00 Y
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-1193.24+218.235446*T-38.5844296*T*LN(T)+18.531982E-3*T**2-5.764227E-6*T**3
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+74092*T**(-1); 933.47 Y
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-1195.378+183.871153*T-31.748192*T*LN(T)-1230.524E25*T**(-9); 2900.00 N !
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$ From COST507 database
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PARAMETER G(DIAMOND_A4,AL;0) 298.15
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-7976.15+167.093038*T-24.3671976*T*LN(T)-1.884662E-3*T**2-0.877664E-6*T**3
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+74092*T**(-1); 700.00 Y
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-11276.24+253.048446*T-38.5844296*T*LN(T)+18.531982E-3*T**2-5.764227E-6*T**3
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+74092*T**(-1); 933.47 Y
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-11278.378+218.684153*T-31.748192*T*LN(T)-1230.524E25*T**(-9); 2900.00 N !
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$ -------------------------------------
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$ Am
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$ -------------------------------------
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PARAMETER G(DHCP,AM;0) 298.15
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-6639.201+89.645685*T-21.1868*T*LN(T)-5.59955E-3*T**2-0.541038E-6*T**3
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-30424*T**(-1); 1329.00 Y
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-21702.938+241.107269*T-41.84*T*LN(T); 3000.00 N !
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PARAMETER G(FCC_A1,AM:VA;0) 298.15
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-5224.899+99.204329*T-23.1377*T*LN(T)-2.94694E-3*T**2-0.664773E-6*T**3
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-18507*T**(-1); 1018.00 Y
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-2935.853+73.800069*T-19.4406*T*LN(T)-5.418E-3*T**2-0.375233E-6*T**3
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-260435*T**(-1); 1548.70 Y
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-22179.593+241.353807*T-41.84*T*LN(T); 3000.00 N !
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PARAMETER G(BCC_A2,AM:VA;0) 298.15
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-665.396+85.114354*T-21.1868*T*LN(T)-5.5995E-3*T**2-0.541033E-6*T**3
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-30424*T**(-1); 999.00 Y
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-7800.332+63.93115*T-15.8832*T*LN(T)-19.0671E-3*T**2+2.291117E-6*T**3
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+2287195*T**(-1); 1339.00 Y
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-13153.887+219.600832*T-39.748*T*LN(T); 1449.00 Y
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70352.138-326.394464*T+33.413*T*LN(T)-27.36485E-3*T**2+1.801717E-6*T**3
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-17379450*T**(-1); 2183.60 Y
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-16925.244+237.367028*T-41.84*T*LN(T); 3000.00 N !
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PARAMETER G(LIQUID,AM;0) 298.15
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13271.499+75.525185*T-21.1868*T*LN(T)-5.59955E-3*T**2-0.541038E-6*T**3
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-30424*T**(-1); 1329.00 Y
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-1792.238+226.986769*T-41.84*T*LN(T); 3000.00 N !
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$ -------------------------------------
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$ As
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$ -------------------------------------
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PARAMETER G(RHOMBOHEDRAL_A7,AS;0) 298.15
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-7270.447+122.211069*T-23.3144*T*LN(T)-2.71613E-3*T**2+11600*T**(-1); 1090.00 Y
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-10454.913+163.457433*T-29.216037*T*LN(T); 1200.00 N !
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PARAMETER G(LIQUID,AS;0) 298.15
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17172.453+99.78639*T-23.3144*T*LN(T)-2.71613E-3*T**2+11600*T**(-1); 1090.00 Y
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13987.987+141.032754*T-29.216037*T*LN(T); 1200.00 N !
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PARAMETER G(FCC_A1,AS:VA;0) 298.15
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17603.553+107.471069*T-23.3144*T*LN(T)-2.71613E-3*T**2+11600*T**(-1); 1090.00 Y
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14419.087+148.717433*T-29.216037*T*LN(T); 1200.00 N !
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PARAMETER G(BCC_A2,AS:VA;0) 298.15
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17603.553+106.111069*T-23.3144*T*LN(T)-2.71613E-3*T**2+11600*T**(-1); 1090.00 Y
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14419.087+147.357433*T-29.216037*T*LN(T); 1200.00 N !
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PARAMETER G(HCP_A3,AS:VA;0) 298.15
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17603.553+108.211069*T-23.3144*T*LN(T)-2.71613E-3*T**2+11600*T**(-1); 1090.00 Y
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14419.087+149.457433*T-29.216037*T*LN(T); 1200.00 N !
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PARAMETER G(RED_P,AS;0) 298.15
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-1488.447+118.356409*T-23.3144*T*LN(T)-2.71613E-3*T**2+11600*T**(-1); 1090.00 Y
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-4672.913+159.602773*T-29.216037*T*LN(T); 1200.00 N !
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$ -------------------------------------
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$ Au
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$ -------------------------------------
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PARAMETER G(FCC_A1,AU:VA;0) 298.15
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-6938.856+106.830098*T-22.75455*T*LN(T)-3.85924E-3*T**2+0.379625E-6*T**3
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-25097*T**(-1); 929.40 Y
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-93586.481+1021.69543*T-155.7067449*T*LN(T)+87.56015E-3*T**2
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-11.518713E-6*T**3+10637210*T**(-1); 1337.33 Y
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314067.829-2016.378254*T+263.2522592*T*LN(T)-118.216828E-3*T**2
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+8.923844E-6*T**3-67999832*T**(-1); 1735.80 Y
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-12133.783+165.272524*T-30.9616*T*LN(T); 3200.00 N !
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PARAMETER G(HCP_A3,AU:VA;0) 298.15
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-6698.106+108.430098*T-22.75455*T*LN(T)-3.85924E-3*T**2+0.379625E-6*T**3
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-25097*T**(-1); 929.40 Y
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-93345.731+1023.29543*T-155.7067449*T*LN(T)+87.56015E-3*T**2
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-11.518713E-6*T**3+10637210*T**(-1); 1337.33 Y
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||
|
314308.579-2014.778254*T+263.2522592*T*LN(T)-118.216828E-3*T**2
|
||
|
+8.923844E-6*T**3-67999832*T**(-1); 1735.80 Y
|
||
|
-11893.033+166.872524*T-30.9616*T*LN(T); 3200.00 N !
|
||
|
|
||
|
PARAMETER G(BCC_A2,AU:VA;0) 298.15
|
||
|
-2688.856+105.730098*T-22.75455*T*LN(T)-3.85924E-3*T**2+0.379625E-6*T**3
|
||
|
-25097*T**(-1); 929.40 Y
|
||
|
-89336.481+1020.59543*T-155.7067449*T*LN(T)+87.56015E-3*T**2
|
||
|
-11.518713E-6*T**3+10637210*T**(-1); 1337.33 Y
|
||
|
318317.829-2017.478254*T+263.2522592*T*LN(T)-118.216828E-3*T**2
|
||
|
+8.923844E-6*T**3-67999832*T**(-1); 1735.80 Y
|
||
|
-7883.783+164.172524*T-30.9616*T*LN(T); 3200.00 N !
|
||
|
|
||
|
PARAMETER G(LIQUID,AU;0) 298.15
|
||
|
5613.144+97.444232*T-22.75455*T*LN(T)-3.85924E-3*T**2+0.379625E-6*T**3
|
||
|
-25097*T**(-1); 929.40 Y
|
||
|
-81034.481+1012.309564*T-155.7067449*T*LN(T)+87.56015E-3*T**2
|
||
|
-11.518713E-6*T**3+10637210*T**(-1); 1337.33 Y
|
||
|
326619.829-2025.76412*T+263.2522592*T*LN(T)-118.216828E-3*T**2
|
||
|
+8.923844E-6*T**3-67999832*T**(-1); 1735.80 Y
|
||
|
418.217+155.886658*T-30.9616*T*LN(T); 3200.00 N !
|
||
|
$ -------------------------------------
|
||
|
|
||
|
$ B
|
||
|
$ -------------------------------------
|
||
|
PARAMETER G(BETA_RHOMBO_B,B;0) 298.15
|
||
|
-7735.284+107.111864*T-15.6641*T*LN(T)-6.864515E-3*T**2+0.618878E-6*T**3
|
||
|
+370843*T**(-1); 1100.00 Y
|
||
|
-16649.474+184.801744*T-26.6047*T*LN(T)-0.79809E-3*T**2-0.02556E-6*T**3
|
||
|
+1748270*T**(-1); 2348.00 Y
|
||
|
-36667.582+231.336244*T-31.5957527*T*LN(T)-1.59488E-3*T**2+0.134719E-6*T**3
|
||
|
+11205883*T**(-1); 3000.00 Y
|
||
|
-21530.653+222.396264*T-31.4*T*LN(T); 6000.00 N !
|
||
|
|
||
|
PARAMETER G(LIQUID,B;0) 298.15
|
||
|
40723.275+86.843839*T-15.6641*T*LN(T)-6.864515E-3*T**2+0.618878E-6*T**3
|
||
|
+370843*T**(-1); 500.00 Y
|
||
|
41119.703+82.101722*T-14.9827763*T*LN(T)-7.095669E-3*T**2+0.507347E-6*T**3
|
||
|
+335484*T**(-1); 2348.00 Y
|
||
|
28842.012+200.94731*T-31.4*T*LN(T); 6000.00 N !
|
||
|
|
||
|
$ From COST507 database
|
||
|
PARAMETER G(FCC_A1,B:VA;0) 298.15
|
||
|
35778.716+94.894864*T-15.6641*T*LN(T)-6.864515E-3*T**2+0.618878E-6*T**3
|
||
|
+370843*T**(-1); 1100.00 Y
|
||
|
26864.526+172.584744*T-26.6047*T*LN(T)-0.79809E-3*T**2-0.02556E-6*T**3
|
||
|
+1748270*T**(-1); 2348.00 Y
|
||
|
6846.418+219.119244*T-31.5957527*T*LN(T)-1.59488E-3*T**2+0.134719E-6*T**3
|
||
|
+11205883*T**(-1); 3000.00 Y
|
||
|
21983.347+210.179264*T-31.4*T*LN(T); 6000.00 N !
|
||
|
|
||
|
$ From COST507 database - add 10 to data to make unstable relative to
|
||
|
$ BETA_RHOMBO_B
|
||
|
PARAMETER G(DIAMOND_A4,B;0) 298.15
|
||
|
-7725.284+107.111864*T-15.6641*T*LN(T)-6.864515E-3*T**2+0.618878E-6*T**3
|
||
|
+370843*T**(-1); 1100.00 Y
|
||
|
-16639.474+184.801744*T-26.6047*T*LN(T)-0.79809E-3*T**2-0.02556E-6*T**3
|
||
|
+1748270*T**(-1); 2348.00 Y
|
||
|
-36657.582+231.336244*T-31.5957527*T*LN(T)-1.59488E-3*T**2+0.134719E-6*T**3
|
||
|
+11205883*T**(-1); 3000.00 Y
|
||
|
-21520.653+222.396264*T-31.4*T*LN(T); 6000.00 N !
|
||
|
|
||
|
$ From COST507 database
|
||
|
PARAMETER G(HCP_A3,B:VA;0) 298.15
|
||
|
42472.716+97.405864*T-15.6641*T*LN(T)-6.864515E-3*T**2+0.618878E-6*T**3
|
||
|
+370843*T**(-1); 1100.00 Y
|
||
|
33558.526+175.095744*T-26.6047*T*LN(T)-0.79809E-3*T**2-0.02556E-6*T**3
|
||
|
+1748270*T**(-1); 2348.00 Y
|
||
|
13540.418+221.630244*T-31.5957527*T*LN(T)-1.59488E-3*T**2+0.134719E-6*T**3
|
||
|
+11205883*T**(-1); 3000.00 Y
|
||
|
28677.347+212.690264*T-31.4*T*LN(T); 6000.00 N !
|
||
|
|
||
|
$ From COST507 Round 2 database
|
||
|
PARAMETER G(GRAPHITE,B;0) 298.15
|
||
|
2264.716+105.111864*T-15.6641*T*LN(T)-6.864515E-3*T**2+0.618878E-6*T**3
|
||
|
+370843*T**(-1); 1100.00 Y
|
||
|
-6649.474+182.801744*T-26.6047*T*LN(T)-0.79809E-3*T**2-0.02556E-6*T**3
|
||
|
+1748270*T**(-1); 2348.00 Y
|
||
|
-26667.582+229.336244*T-31.5957527*T*LN(T)-1.59488E-3*T**2+0.134719E-6*T**3
|
||
|
+11205883*T**(-1); 3000.00 Y
|
||
|
-11530.653+220.396264*T-31.4*T*LN(T); 6000.00 N !
|
||
|
|
||
|
$ Source of data: Hallemans, Wollants and Roos
|
||
|
$ JPE 1995, 16(2), 137-149
|
||
|
$ Thermodynamic assessment of the Fe-Nb-B phase diagram
|
||
|
PARAMETER G(BCC_A2,B:VA;0) 298.15
|
||
|
35778.716+94.894864*T-15.6641*T*LN(T)-6.864515E-3*T**2+0.618878E-6*T**3
|
||
|
+370843*T**(-1); 1100.00 Y
|
||
|
26864.526+172.584744*T-26.6047*T*LN(T)-0.79809E-3*T**2-0.02556E-6*T**3
|
||
|
+1748270*T**(-1); 2348.00 Y
|
||
|
6846.418+219.119244*T-31.5957527*T*LN(T)-1.59488E-3*T**2+0.134719E-6*T**3
|
||
|
+11205883*T**(-1); 3000.00 N !
|
||
|
|
||
|
$ -------------------------------------
|
||
|
|
||
|
$ Ba
|
||
|
$ -------------------------------------
|
||
|
PARAMETER G(BCC_A2,BA:VA;0) 298.15
|
||
|
-17685.226+233.78606*T-42.889*T*LN(T)-1.8314E-3*T**2-0.000095E-6*T**3
|
||
|
+705880*T**(-1); 1000.00 Y
|
||
|
-64873.614+608.188389*T-94.2824199*T*LN(T)+19.504772E-3*T**2-1.051353E-6*T**3
|
||
|
+8220192*T**(-1); 2995.00 Y
|
||
|
8083.889+136.780042*T-32.2*T*LN(T); 4000.00 N !
|
||
|
|
||
|
PARAMETER G(LIQUID,BA;0) 298.15
|
||
|
-9738.988+229.540143*T-43.4961089*T*LN(T)-2.346416E-3*T**2+0.991223E-6*T**3
|
||
|
+723016*T**(-1); 1000.00 Y
|
||
|
-7381.093+235.49642*T-45.103*T*LN(T)+2.154E-3*T**2+0.000027E-6*T**3
|
||
|
-365*T**(-1); 2995.00 Y
|
||
|
11940.282+132.212*T-32.2*T*LN(T); 4000.00 N !
|
||
|
|
||
|
PARAMETER G(HCP_A3,BA:VA;0) 298.15
|
||
|
-15685.226+235.08606*T-42.889*T*LN(T)-1.8314E-3*T**2-0.000095E-6*T**3
|
||
|
+705880*T**(-1); 1000.00 Y
|
||
|
-62873.614+609.488389*T-94.2824199*T*LN(T)+19.504772E-3*T**2-1.051353E-6*T**3
|
||
|
+8220192*T**(-1); 2995.00 Y
|
||
|
10083.889+138.080042*T-32.2*T*LN(T); 4000.00 N !
|
||
|
|
||
|
PARAMETER G(FCC_A1,BA:VA;0) 298.15
|
||
|
-15885.226+234.38606*T-42.889*T*LN(T)-1.8314E-3*T**2-0.000095E-6*T**3
|
||
|
+705880*T**(-1); 1000.00 Y
|
||
|
-63073.614+608.788389*T-94.2824199*T*LN(T)+19.504772E-3*T**2-1.051353E-6*T**3
|
||
|
+8220192*T**(-1); 2995.00 Y
|
||
|
9883.889+137.380042*T-32.2*T*LN(T); 4000.00 N !
|
||
|
$ -------------------------------------
|
||
|
|
||
|
$ Be
|
||
|
$ -------------------------------------
|
||
|
PARAMETER G(HCP_A3,BE:VA;0) 298.15
|
||
|
-8553.651+137.560219*T-21.204*T*LN(T)-2.84715E-3*T**2-0.160413E-6*T**3
|
||
|
+293690*T**(-1); 1527.00 Y
|
||
|
-121305.858+772.405844*T-103.9842999*T*LN(T)+21.078651E-3*T**2
|
||
|
-1.119065E-6*T**3+27251743*T**(-1); 3000.00 N !
|
||
|
|
||
|
PARAMETER G(BCC_A2,BE:VA;0) 298.15
|
||
|
-1076.057+109.411712*T-17.1727841*T*LN(T)-8.672487E-3*T**2+0.961427E-6*T**3
|
||
|
+242309*T**(-1); 1527.00 Y
|
||
|
-6970.378+196.411689*T-30*T*LN(T); 1560.00 Y
|
||
|
-2609.973+178.131722*T-27.7823769*T*LN(T)-0.103629E-3*T**2-0.059331E-6*T**3
|
||
|
-1250847*T**(-1); 3000.00 N !
|
||
|
|
||
|
PARAMETER G(LIQUID,BE;0) 298.15
|
||
|
7511.838+120.362788*T-20.0497038*T*LN(T)-4.821347E-3*T**2+0.415958E-6*T**3
|
||
|
+281044*T**(-1); 1560.00 Y
|
||
|
5364.713+156.961141*T-25.486*T*LN(T)-1.0572E-3*T**2-0.001117E-6*T**3
|
||
|
+15920*T**(-1); 3000.00 N !
|
||
|
|
||
|
PARAMETER G(FCC_A1,BE:VA;0) 298.15
|
||
|
-2204.651+136.475219*T-21.204*T*LN(T)-2.84715E-3*T**2-0.160413E-6*T**3
|
||
|
+293690*T**(-1); 1527.00 Y
|
||
|
-114956.858+771.320844*T-103.9842999*T*LN(T)+21.078651E-3*T**2
|
||
|
-1.119065E-6*T**3+27251743*T**(-1); 3000.00 N !
|
||
|
$ -------------------------------------
|
||
|
|
||
|
$ Bi
|
||
|
$ -------------------------------------
|
||
|
PARAMETER G(RHOMBOHEDRAL_A7,BI;0) 298.15
|
||
|
-7817.776+128.418925*T-28.4096529*T*LN(T)+12.338888E-3*T**2-8.381598E-6*T**3;
|
||
|
544.55 Y
|
||
|
30208.022-393.650351*T+51.8556592*T*LN(T)-75.311163E-3*T**2+13.499885E-6*T**3
|
||
|
-3616168*T**(-1)+166.145E23*T**(-9); 800.00 Y
|
||
|
-11045.664+182.548971*T-35.9824*T*LN(T)+7.4266E-3*T**2-1.046E-6*T**3
|
||
|
+166.145E23*T**(-9); 1200.00 Y
|
||
|
-7581.312+124.77144*T-27.196*T*LN(T)+166.145E23*T**(-9); 3000.00 N !
|
||
|
|
||
|
PARAMETER G(LIQUID,BI;0) 298.15
|
||
|
3428.29+107.782416*T-28.4096529*T*LN(T)+12.338888E-3*T**2-8.381598E-6*T**3
|
||
|
-59.549E-20*T**7; 544.55 Y
|
||
|
41544.282-414.460769*T+51.8556592*T*LN(T)-75.311163E-3*T**2+13.499885E-6*T**3
|
||
|
-3616168*T**(-1); 800.00 Y
|
||
|
290.595+161.738553*T-35.9824*T*LN(T)+7.4266E-3*T**2-1.046E-6*T**3; 1200.00 Y
|
||
|
3754.947+103.961021*T-27.196*T*LN(T); 3000.00 N !
|
||
|
|
||
|
PARAMETER G(TETRAGONAL_A6,BI;0) 298.15
|
||
|
-3633.706+128.418925*T-28.4096529*T*LN(T)+12.338888E-3*T**2-8.381598E-6*T**3;
|
||
|
544.55 Y
|
||
|
34392.092-393.650351*T+51.8556592*T*LN(T)-75.311163E-3*T**2+13.499885E-6*T**3
|
||
|
-3616168*T**(-1)+166.145E23*T**(-9); 800.00 Y
|
||
|
-6861.594+182.548971*T-35.9824*T*LN(T)+7.4266E-3*T**2-1.046E-6*T**3
|
||
|
+166.145E23*T**(-9); 1200.00 Y
|
||
|
-3397.242+124.77144*T-27.196*T*LN(T)+166.145E23*T**(-9); 3000.00 N !
|
||
|
|
||
|
PARAMETER G(BCT_A5,BI;0) 298.15
|
||
|
-3633.706+128.418925*T-28.4096529*T*LN(T)+12.338888E-3*T**2-8.381598E-6*T**3;
|
||
|
544.55 Y
|
||
|
34392.092-393.650351*T+51.8556592*T*LN(T)-75.311163E-3*T**2+13.499885E-6*T**3
|
||
|
-3616168*T**(-1)+166.145E23*T**(-9); 800.00 Y
|
||
|
-6861.594+182.548971*T-35.9824*T*LN(T)+7.4266E-3*T**2-1.046E-6*T**3
|
||
|
+166.145E23*T**(-9); 1200.00 Y
|
||
|
-3397.242+124.77144*T-27.196*T*LN(T)+166.145E23*T**(-9); 3000.00 N !
|
||
|
|
||
|
PARAMETER G(BCC_A2,BI:VA;0) 298.15
|
||
|
3479.224+114.518925*T-28.4096529*T*LN(T)+12.338888E-3*T**2-8.381598E-6*T**3;
|
||
|
544.55 Y
|
||
|
41505.022-407.550351*T+51.8556592*T*LN(T)-75.311163E-3*T**2+13.499885E-6*T**3
|
||
|
-3616168*T**(-1)+166.145E23*T**(-9); 800.00 Y
|
||
|
251.336+168.648971*T-35.9824*T*LN(T)+7.4266E-3*T**2-1.046E-6*T**3
|
||
|
+166.145E23*T**(-9); 1200.00 Y
|
||
|
3715.688+110.87144*T-27.196*T*LN(T)+166.145E23*T**(-9); 3000.00 N !
|
||
|
|
||
|
PARAMETER G(FCC_A1,BI:VA;0) 298.15
|
||
|
2082.224+115.918925*T-28.4096529*T*LN(T)+12.338888E-3*T**2-8.381598E-6*T**3;
|
||
|
544.55 Y
|
||
|
40108.022-406.150351*T+51.8556592*T*LN(T)-75.311163E-3*T**2+13.499885E-6*T**3
|
||
|
-3616168*T**(-1)+166.145E23*T**(-9); 800.00 Y
|
||
|
-1145.664+170.048971*T-35.9824*T*LN(T)+7.4266E-3*T**2-1.046E-6*T**3
|
||
|
+166.145E23*T**(-9); 1200.00 Y
|
||
|
2318.688+112.27144*T-27.196*T*LN(T)+166.145E23*T**(-9); 3000.00 N !
|
||
|
|
||
|
PARAMETER G(HCP_A3,BI:VA;0) 298.15
|
||
|
2082.224+116.618925*T-28.4096529*T*LN(T)+12.338888E-3*T**2-8.381598E-6*T**3;
|
||
|
544.55 Y
|
||
|
40108.022-405.450351*T+51.8556592*T*LN(T)-75.311163E-3*T**2+13.499885E-6*T**3
|
||
|
-3616168*T**(-1)+166.145E23*T**(-9); 800.00 Y
|
||
|
-1145.664+170.748971*T-35.9824*T*LN(T)+7.4266E-3*T**2-1.046E-6*T**3
|
||
|
+166.145E23*T**(-9); 1200.00 Y
|
||
|
2318.688+112.97144*T-27.196*T*LN(T)+166.145E23*T**(-9); 3000.00 N !
|
||
|
|
||
|
PARAMETER G(TET_ALPHA1,BI;0) 298.15
|
||
|
-3583.776+128.418925*T-28.4096529*T*LN(T)+12.338888E-3*T**2-8.381598E-6*T**3;
|
||
|
544.55 Y
|
||
|
34442.022-393.650351*T+51.8556592*T*LN(T)-75.311163E-3*T**2+13.499885E-6*T**3
|
||
|
-3616168*T**(-1)+166.145E23*T**(-9); 800.00 Y
|
||
|
-6811.664+182.548971*T-35.9824*T*LN(T)+7.4266E-3*T**2-1.046E-6*T**3
|
||
|
+166.145E23*T**(-9); 1200.00 Y
|
||
|
-3347.312+124.77144*T-27.196*T*LN(T)+166.145E23*T**(-9); 3000.00 N !
|
||
|
|
||
|
$ -------------------------------------
|
||
|
|
||
|
$ C
|
||
|
$ -------------------------------------
|
||
|
PARAMETER G(GRAPHITE,C;0) 298.15
|
||
|
-17368.441+170.73*T-24.3*T*LN(T)-0.4723E-3*T**2+2562600*T**(-1)
|
||
|
-264300000*T**(-2)+1.2E10*T**(-3); 6000.00 N !
|
||
|
|
||
|
PARAMETER G(DIAMOND_A4,C;0) 298.15
|
||
|
-16359.441+175.61*T-24.31*T*LN(T)-0.4723E-3*T**2+2698000*T**(-1)
|
||
|
-261000000*T**(-2)+1.11E10*T**(-3); 6000.00 N !
|
||
|
|
||
|
PARAMETER G(LIQUID,C;0) 298.15
|
||
|
100000.559+146.1*T-24.3*T*LN(T)-0.4723E-3*T**2+2562600*T**(-1)
|
||
|
-264300000*T**(-2)+1.2E10*T**(-3); 6000.00 N !
|
||
|
$ -------------------------------------
|
||
|
|
||
|
$ Ca
|
||
|
$ -------------------------------------
|
||
|
PARAMETER G(FCC_A1,CA:VA;0) 298.15
|
||
|
-4955.062+72.794266*T-16.3138*T*LN(T)-11.10455E-3*T**2-133574*T**(-1);
|
||
|
1115.00 Y
|
||
|
-107304.428+799.982066*T-114.2922467*T*LN(T)+23.733814E-3*T**2-1.2438E-6*T**3
|
||
|
+18245540*T**(-1); 3000.00 N !
|
||
|
|
||
|
PARAMETER G(BCC_A2,CA:VA;0) 298.15
|
||
|
-7020.852+142.970155*T-28.2541*T*LN(T)+7.2326E-3*T**2-4.500217E-6*T**3
|
||
|
+60578*T**(-1); 716.00 Y
|
||
|
1640.475+1.999694*T-6.276*T*LN(T)-16.1921E-3*T**2-523000*T**(-1); 1115.00 Y
|
||
|
-142331.096+1023.549046*T-143.8726979*T*LN(T)+32.543127E-3*T**2
|
||
|
-1.704079E-6*T**3+25353771*T**(-1); 3000.00 N !
|
||
|
|
||
|
PARAMETER G(LIQUID,CA;0) 298.15
|
||
|
5844.846+62.4838*T-16.3138*T*LN(T)-11.10455E-3*T**2-133574*T**(-1); 500.00 Y
|
||
|
7838.856+18.2979*T-8.9874787*T*LN(T)-22.66537E-3*T**2+3.338303E-6*T**3
|
||
|
-230193*T**(-1); 1115.00 Y
|
||
|
-2654.938+188.9223*T-35*T*LN(T); 3000.00 N !
|
||
|
|
||
|
PARAMETER G(HCP_A3,CA:VA;0) 298.15
|
||
|
-4455.062+73.494266*T-16.3138*T*LN(T)-11.10455E-3*T**2-133574*T**(-1);
|
||
|
1115.00 Y
|
||
|
-106804.428+800.682066*T-114.2922467*T*LN(T)+23.733814E-3*T**2-1.2438E-6*T**3
|
||
|
+18245540*T**(-1); 3000.00 N !
|
||
|
$ -------------------------------------
|
||
|
|
||
|
$ Cd
|
||
|
$ -------------------------------------
|
||
|
PARAMETER G(HCP_A3,CD:VA;0) 298.15
|
||
|
-7083.469+99.506198*T-22.0442408*T*LN(T)-6.273908E-3*T**2-6966*T**(-1);
|
||
|
594.22 Y
|
||
|
-20064.971+256.812233*T-45.1611543*T*LN(T)+8.832011E-3*T**2-0.899604E-6*T**3
|
||
|
+1241290*T**(-1); 1500.00 Y
|
||
|
-9027.489+148.20548*T-29.7064*T*LN(T); 1600.00 N !
|
||
|
|
||
|
PARAMETER G(LIQUID,CD;0) 298.15
|
||
|
-955.025+89.209282*T-22.0442408*T*LN(T)-6.273908E-3*T**2-6966*T**(-1);
|
||
|
400.00 Y
|
||
|
21716.884-371.046869*T+53.1313898*T*LN(T)-115.159917E-3*T**2+28.899781E-6*T**3
|
||
|
-1271815*T**(-1); 594.22 Y
|
||
|
-3252.303+138.251107*T-29.7064*T*LN(T); 1600.00 N !
|
||
|
|
||
|
$From Zakulski, Moser, Rzyman et al. J. Phase Equil. 1993,14(2),184-196
|
||
|
PARAMETER G(FCC_A1,CD:VA;0) 298.15
|
||
|
-6191.169+98.586198*T-22.0442408*T*LN(T)-6.273908E-3*T**2-6966*T**(-1);
|
||
|
594.22 Y
|
||
|
-19172.671+255.892233*T-45.1611543*T*LN(T)+8.832011E-3*T**2-0.899604E-6*T**3
|
||
|
+1241290*T**(-1); 1500.00 Y
|
||
|
-8135.189+147.28548*T-29.7064*T*LN(T); 1600.00 N !
|
||
|
|
||
|
$From Zakulski, Moser, Rzyman et al. J. Phase Equil. 1993,14(2),184-196
|
||
|
PARAMETER G(TETRAGONAL_A6,CD;0) 298.15
|
||
|
-6191.169+98.586198*T-22.0442408*T*LN(T)-6.273908E-3*T**2-6966*T**(-1);
|
||
|
594.22 Y
|
||
|
-19172.671+255.892233*T-45.1611543*T*LN(T)+8.832011E-3*T**2-0.899604E-6*T**3
|
||
|
+1241290*T**(-1); 1500.00 Y
|
||
|
-8135.189+147.28548*T-29.7064*T*LN(T); 1600.00 N !
|
||
|
|
||
|
$ Source of data: Assessment of data the Cd-Hg system
|
||
|
$ Jang, Silk, Watson, Bryant, Chart and Argent, CALPHAD, 1995, 19(3),
|
||
|
$ 415. "The thermodynamics and phase diagrams of the Cd-Hg and Cd-Hg-Te
|
||
|
$ systems"
|
||
|
PARAMETER G(RHOMBO_A10,CD;0) 298.15
|
||
|
-6283.469+98.886198*T-22.0442408*T*LN(T)-6.273908E-3*T**2-6966*T**(-1);
|
||
|
594.22 Y
|
||
|
-19264.971+256.192233*T-45.1611543*T*LN(T)+8.832011E-3*T**2-0.899604E-6*T**3
|
||
|
+1241290*T**(-1); 1500.00 Y
|
||
|
-8227.489+147.58548*T-29.7064*T*LN(T); 1600.00 N !
|
||
|
|
||
|
$ Source of data: Assessment of data the Cd-Hg system
|
||
|
$ Jang, Silk, Watson, Bryant, Chart and Argent, CALPHAD, 1995, 19(3),
|
||
|
$ 415. "The thermodynamics and phase diagrams of the Cd-Hg and Cd-Hg-Te
|
||
|
$ systems"
|
||
|
PARAMETER G(BCT_A5,CD;0) 298.15
|
||
|
-2083.469+99.506198*T-22.0442408*T*LN(T)-6.273908E-3*T**2-6966*T**(-1);
|
||
|
594.22 Y
|
||
|
-15064.971+256.812233*T-45.1611543*T*LN(T)+8.832011E-3*T**2-0.899604E-6*T**3
|
||
|
+1241290*T**(-1); 1500.00 Y
|
||
|
-4027.489+148.20548*T-29.7064*T*LN(T); 1600.00 N !
|
||
|
$ -------------------------------------
|
||
|
|
||
|
$ Ce
|
||
|
$ -------------------------------------
|
||
|
PARAMETER G(FCC_A1,CE:VA;0) 298.15
|
||
|
-7160.519+84.23022*T-22.3664*T*LN(T)-6.7103E-3*T**2-0.320773E-6*T**3
|
||
|
-18117*T**(-1); 1000.00 Y
|
||
|
-79678.506+659.4604*T-101.3224803*T*LN(T)+26.046487E-3*T**2-1.930297E-6*T**3
|
||
|
+11531707*T**(-1); 2000.00 Y
|
||
|
-14198.639+190.370192*T-37.6978*T*LN(T); 4000.00 N !
|
||
|
|
||
|
PARAMETER G(BCC_A2,CE:VA;0) 298.15
|
||
|
-1354.69-5.21501*T-7.7305867*T*LN(T)-29.098402E-3*T**2+4.784299E-6*T**3
|
||
|
-196303*T**(-1); 1000.00 Y
|
||
|
-12101.106+187.449688*T-37.6142*T*LN(T); 1072.00 Y
|
||
|
-11950.375+186.333811*T-37.4627992*T*LN(T)-0.057145E-3*T**2+0.002348E-6*T**3
|
||
|
-25897*T**(-1); 4000.00 N !
|
||
|
|
||
|
PARAMETER G(LIQUID,CE;0) 298.15
|
||
|
4117.865-11.423898*T-7.5383948*T*LN(T)-29.36407E-3*T**2+4.827734E-6*T**3
|
||
|
-198834*T**(-1); 1000.00 Y
|
||
|
-6730.605+183.023193*T-37.6978*T*LN(T); 4000.00 N !
|
||
|
|
||
|
$ From Gschneider and Pecharsky, JPE 1999, 20(6), 612-4
|
||
|
PARAMETER G(DHCP,CE;0) 298.15
|
||
|
-7283.058+84.66322*T-22.3664*T*LN(T)-6.7103E-3*T**2-0.320773E-6*T**3
|
||
|
-18117*T**(-1); 1000.00 Y
|
||
|
-79801.045+659.8934*T-101.3224803*T*LN(T)+26.046487E-3*T**2-1.930297E-6*T**3
|
||
|
+11531707*T**(-1); 2000.00 Y
|
||
|
-14321.178+190.803192*T-37.6978*T*LN(T); 4000.00 N !
|
||
|
|
||
|
$ From Peter Franke - Private communication
|
||
|
PARAMETER G(HCP_A3,CE:VA;0) 298.15
|
||
|
-6860.519+84.23022*T-22.3664*T*LN(T)-6.7103E-3*T**2-0.320773E-6*T**3
|
||
|
-18117*T**(-1); 1000.00 Y
|
||
|
-79378.506+659.4604*T-101.3224803*T*LN(T)+26.046487E-3*T**2-1.930297E-6*T**3
|
||
|
+11531707*T**(-1); 2000.00 Y
|
||
|
-13898.639+190.370192*T-37.6978*T*LN(T); 4000.00 N !
|
||
|
$ -------------------------------------
|
||
|
|
||
|
$ Co
|
||
|
$ -------------------------------------
|
||
|
PARAMETER G(HCP_A3,CO:VA;0) 298.15
|
||
|
310.241+133.36601*T-25.0861*T*LN(T)-2.654739E-3*T**2-0.17348E-6*T**3
|
||
|
+72527*T**(-1); 1768.00 Y
|
||
|
-17197.666+253.28374*T-40.5*T*LN(T)+934.88E28*T**(-9); 6000.00 N !
|
||
|
PARAMETER TC(HCP_A3,CO:VA;0) 298.15 1396.00; 6000.00 N !
|
||
|
PARAMETER BM(HCP_A3,CO:VA;0) 298.15 1.35; 6000.00 N !
|
||
|
|
||
|
PARAMETER G(FCC_A1,CO:VA;0) 298.15
|
||
|
737.832+132.750762*T-25.0861*T*LN(T)-2.654739E-3*T**2-0.17348E-6*T**3
|
||
|
+72527*T**(-1); 1768.00 Y
|
||
|
-16770.075+252.668487*T-40.5*T*LN(T)+934.88E28*T**(-9); 6000.00 N !
|
||
|
PARAMETER TC(FCC_A1,CO:VA;0) 298.15 1396.00; 6000.00 N !
|
||
|
PARAMETER BM(FCC_A1,CO:VA;0) 298.15 1.35; 6000.00 N !
|
||
|
|
||
|
PARAMETER G(LIQUID,CO;0) 298.15
|
||
|
15395.278+124.434078*T-25.0861*T*LN(T)-2.654739E-3*T**2-0.17348E-6*T**3
|
||
|
+72527*T**(-1)-219.801E-23*T**7; 1768.00 Y
|
||
|
-846.61+243.599944*T-40.5*T*LN(T); 6000.00 N !
|
||
|
|
||
|
PARAMETER G(BCC_A2,CO:VA;0) 298.15
|
||
|
3248.241+132.65221*T-25.0861*T*LN(T)-2.654739E-3*T**2-0.17348E-6*T**3
|
||
|
+72527*T**(-1); 1768.00 Y
|
||
|
-14259.666+252.56994*T-40.5*T*LN(T)+934.88E28*T**(-9); 6000.00 N !
|
||
|
PARAMETER TC(BCC_A2,CO:VA;0) 298.15 1450.00; 6000.00 N !
|
||
|
PARAMETER BM(BCC_A2,CO:VA;0) 298.15 1.35; 6000.00 N !
|
||
|
|
||
|
PARAMETER G(CBCC_A12,CO:VA;0) 298.15
|
||
|
4465.241+133.36601*T-25.0861*T*LN(T)-2.654739E-3*T**2-0.17348E-6*T**3
|
||
|
+72527*T**(-1); 1768.00 Y
|
||
|
-13042.666+253.28374*T-40.5*T*LN(T)+934.88E28*T**(-9); 6000.00 N !
|
||
|
|
||
|
PARAMETER G(CUB_A13,CO:VA;0) 298.15
|
||
|
3465.241+133.36601*T-25.0861*T*LN(T)-2.654739E-3*T**2-0.17348E-6*T**3
|
||
|
+72527*T**(-1); 1768.00 Y
|
||
|
-14042.666+253.28374*T-40.5*T*LN(T)+934.88E28*T**(-9); 6000.00 N !
|
||
|
$ -------------------------------------
|
||
|
|
||
|
$ Cr
|
||
|
$ -------------------------------------
|
||
|
PARAMETER G(BCC_A2,CR:VA;0) 298.15
|
||
|
-8856.94+157.48*T-26.908*T*LN(T)+1.89435E-3*T**2-1.47721E-6*T**3+139250*T**(-1);
|
||
|
2180.00 Y
|
||
|
-34869.344+344.18*T-50*T*LN(T)-2885.26E29*T**(-9); 6000.00 N !
|
||
|
PARAMETER TC(BCC_A2,CR:VA;0) 298.15 -311.50; 6000.00 N !
|
||
|
PARAMETER BM(BCC_A2,CR:VA;0) 298.15 -0.008; 6000.00 N !
|
||
|
|
||
|
PARAMETER G(LIQUID,CR;0) 298.15
|
||
|
15483.015+146.059775*T-26.908*T*LN(T)+1.89435E-3*T**2-1.47721E-6*T**3
|
||
|
+139250*T**(-1)+237.615E-23*T**7; 2180.00 Y
|
||
|
-16459.984+335.616316*T-50*T*LN(T); 6000.00 N !
|
||
|
|
||
|
PARAMETER G(FCC_A1,CR:VA;0) 298.15
|
||
|
-1572.94+157.643*T-26.908*T*LN(T)+1.89435E-3*T**2-1.47721E-6*T**3
|
||
|
+139250*T**(-1); 2180.00 Y
|
||
|
-27585.344+344.343*T-50*T*LN(T)-2885.26E29*T**(-9); 6000.00 N !
|
||
|
PARAMETER TC(FCC_A1,CR:VA;0) 298.15 -1109.00; 6000.00 N !
|
||
|
PARAMETER BM(FCC_A1,CR:VA;0) 298.15 -2.46; 6000.00 N !
|
||
|
|
||
|
PARAMETER G(HCP_A3,CR:VA;0) 298.15
|
||
|
-4418.94+157.48*T-26.908*T*LN(T)+1.89435E-3*T**2-1.47721E-6*T**3+139250*T**(-1);
|
||
|
2180.00 Y
|
||
|
-30431.344+344.18*T-50*T*LN(T)-2885.26E29*T**(-9); 6000.00 N !
|
||
|
PARAMETER TC(HCP_A3,CR:VA;0) 298.15 -1109.00; 6000.00 N !
|
||
|
PARAMETER BM(HCP_A3,CR:VA;0) 298.15 -2.46; 6000.00 N !
|
||
|
|
||
|
PARAMETER G(HCP_ZN,CR:VA;0) 298.15
|
||
|
-4417.94+157.48*T-26.908*T*LN(T)+1.89435E-3*T**2-1.47721E-6*T**3+139250*T**(-1);
|
||
|
2180.00 Y
|
||
|
-30430.344+344.18*T-50*T*LN(T)-2885.26E29*T**(-9); 6000.00 N !
|
||
|
|
||
|
PARAMETER G(CUB_A13,CR:VA;0) 298.15
|
||
|
7042.06+158.1076*T-26.908*T*LN(T)+1.89435E-3*T**2-1.47721E-6*T**3
|
||
|
+139250*T**(-1); 2180.00 Y
|
||
|
-18970.344+344.8076*T-50*T*LN(T)-2885.26E29*T**(-9); 6000.00 N !
|
||
|
|
||
|
PARAMETER G(CBCC_A12,CR:VA;0) 298.15
|
||
|
2230.06+160.1996*T-26.908*T*LN(T)+1.89435E-3*T**2-1.47721E-6*T**3
|
||
|
+139250*T**(-1); 2180.00 Y
|
||
|
-23782.344+346.8996*T-50*T*LN(T)-2885.26E29*T**(-9); 6000.00 N !
|
||
|
|
||
|
$ -------------------------------------
|
||
|
|
||
|
$ Cs
|
||
|
$ -------------------------------------
|
||
|
PARAMETER G(BCC_A2,CS:VA;0) 200.00
|
||
|
-17373.82+436.899787*T-90.5212584*T*LN(T)+202.9422E-3*T**2-127.907669E-6*T**3
|
||
|
+245245*T**(-1); 301.59 Y
|
||
|
-13553.817+218.689955*T-46.7273304*T*LN(T)+20.43269E-3*T**2-4.074846E-6*T**3
|
||
|
+181528*T**(-1)+78.016E20*T**(-9); 2000.00 N !
|
||
|
|
||
|
PARAMETER G(LIQUID,CS;0) 200.00
|
||
|
-15282.679+429.968752*T-90.5212584*T*LN(T)+202.9422E-3*T**2
|
||
|
-127.907669E-6*T**3+245245*T**(-1)-356.867E-20*T**7; 301.59 Y
|
||
|
-11454.038+211.728844*T-46.7273304*T*LN(T)+20.43269E-3*T**2-4.074846E-6*T**3
|
||
|
+181528*T**(-1); 2000.00 N !
|
||
|
|
||
|
PARAMETER G(HCP_A3,CS:VA;0) 200.00
|
||
|
-16873.82+438.899787*T-90.5212584*T*LN(T)+202.9422E-3*T**2-127.907669E-6*T**3
|
||
|
+245245*T**(-1); 301.59 Y
|
||
|
-13053.817+220.689955*T-46.7273304*T*LN(T)+20.43269E-3*T**2-4.074846E-6*T**3
|
||
|
+181528*T**(-1)+78.016E20*T**(-9); 2000.00 N !
|
||
|
|
||
|
PARAMETER G(FCC_A1,CS:VA;0) 200.00
|
||
|
-16873.82+438.199787*T-90.5212584*T*LN(T)+202.9422E-3*T**2-127.907669E-6*T**3
|
||
|
+245245*T**(-1); 301.59 Y
|
||
|
-13053.817+219.989955*T-46.7273304*T*LN(T)+20.43269E-3*T**2-4.074846E-6*T**3
|
||
|
+181528*T**(-1)+78.016E20*T**(-9); 2000.00 N !
|
||
|
$ -------------------------------------
|
||
|
|
||
|
$ Cu
|
||
|
$ -------------------------------------
|
||
|
PARAMETER G(FCC_A1,CU:VA;0) 298.15
|
||
|
-7770.458+130.485235*T-24.112392*T*LN(T)-2.65684E-3*T**2+0.129223E-6*T**3
|
||
|
+52478*T**(-1); 1357.77 Y
|
||
|
-13542.026+183.803828*T-31.38*T*LN(T)+364.167E27*T**(-9); 3200.00 N !
|
||
|
|
||
|
PARAMETER G(BCC_A2,CU:VA;0) 298.15
|
||
|
-3753.458+129.230235*T-24.112392*T*LN(T)-2.65684E-3*T**2+0.129223E-6*T**3
|
||
|
+52478*T**(-1); 1357.77 Y
|
||
|
-9525.026+182.548828*T-31.38*T*LN(T)+364.167E27*T**(-9); 3200.00 N !
|
||
|
|
||
|
PARAMETER G(HCP_A3,CU:VA;0) 298.15
|
||
|
-7170.458+130.685235*T-24.112392*T*LN(T)-2.65684E-3*T**2+0.129223E-6*T**3
|
||
|
+52478*T**(-1); 1357.77 Y
|
||
|
-12942.026+184.003828*T-31.38*T*LN(T)+364.167E27*T**(-9); 3200.00 N !
|
||
|
|
||
|
PARAMETER G(HCP_ZN,CU:VA;0) 298.15
|
||
|
-7170.458+130.685235*T-24.112392*T*LN(T)-2.65684E-3*T**2+0.129223E-6*T**3
|
||
|
+52478*T**(-1); 1357.77 Y
|
||
|
-12942.026+184.003828*T-31.38*T*LN(T)+364.167E27*T**(-9); 3200.00 N !
|
||
|
|
||
|
PARAMETER G(LIQUID,CU;0) 298.15
|
||
|
5194.277+120.973331*T-24.112392*T*LN(T)-2.65684E-3*T**2+0.129223E-6*T**3
|
||
|
+52478*T**(-1)-584.89E-23*T**7; 1357.77 Y
|
||
|
-46.545+173.881484*T-31.38*T*LN(T); 3200.00 N !
|
||
|
|
||
|
$ -------------------------------------
|
||
|
|
||
|
$ Dy
|
||
|
$ -------------------------------------
|
||
|
$ Data from Huasen Shen, Weijing Zhang, Guoquan Liu, Run Wang and Zhenmin Du
|
||
|
$ Report F-95-01, May 1995, University of Science and Technology, Beijing
|
||
|
PARAMETER G(HCP_A3,DY:VA;0) 100 -7937.16586+102.307412*T-26.3917167*T*LN(T)
|
||
|
-7.61683657E-4*T**2-5.86914125E-7*T**3+4010.90565*T**(-1); 1000 Y
|
||
|
-13733.3280+214.012934*T-43.8283359*T*LN(T)+1.66909801E-2*T**2
|
||
|
-3.49702836E-6*T**3+1.73619874E-2*T**(-1); 1654.15 Y
|
||
|
-404681.371+2032.14150*T-272.123952*T*LN(T)+5.78301681E-2*T**2
|
||
|
-2.76169148E-6*T**3+109616238*T**(-1); 3000 N !
|
||
|
PARAMETER TC(HCP_A3,DY:VA;0) 100 179; 3000 N !
|
||
|
PARAMETER BMAGN(HCP_A3,DY:VA;0) 100 3.0; 3000 N !
|
||
|
|
||
|
$ Data from Huasen Shen, Weijing Zhang, Guoquan Liu, Run Wang and Zhenmin Du
|
||
|
$ Report F-95-01, May 1995, University of Science and Technology, Beijing
|
||
|
PARAMETER G(BCC_A2,DY:VA;0) 100 -6428.98566+101.740795819*T
|
||
|
-26.3917167*T*LN(T)-7.61683657E-4*T**2-5.86914125E-7*T**3
|
||
|
+4010.90565*T**(-1); 1000 Y
|
||
|
327500.062-2868.04585*T+391.515418*T*LN(T)-2.24042148E-1*T**2
|
||
|
+2.04076075E-5*T**3-48652656.5*T**(-1); 1654.15 Y
|
||
|
-33708.7949+291.409631*T-50.208*T*LN(T); 1685.15 Y
|
||
|
-40775.4966+330.318068*T-55.2811171*T*LN(T)+1.5254673E-3*T**2
|
||
|
-7.74371160E-8*T**3+1776589.32*T**(-1); 3000 N !
|
||
|
|
||
|
$ Data from Huasen Shen, Weijing Zhang, Guoquan Liu, Run Wang and Zhenmin Du
|
||
|
$ Report F-95-01, May 1995, University of Science and Technology, Beijing
|
||
|
PARAMETER G(LIQUID,DY;0) 100 5259.45264+94.7630477*T-26.3917167*T*LN(T)
|
||
|
-7.61683657E-4*T**2-5.86914125E-7*T**3+4010.90565*T**(-1); 1000 Y
|
||
|
300126.971-2519.78614*T+341.302578*T*LN(T)-1.96153225E-1*T**2
|
||
|
+1.76197799E-5*T**3-43071677.5*T**(-1); 1685.15 Y
|
||
|
-21864.7344+282.205014*T-49.9151*T*LN(T); 3000 N !
|
||
|
$ -------------------------------------
|
||
|
|
||
|
$ Er
|
||
|
$ -------------------------------------
|
||
|
PARAMETER G(HCP_A3,ER:VA;0) 298.15
|
||
|
-8489.136+116.698964*T-28.3846744*T*LN(T)+0.995792E-3*T**2-0.952557E-6*T**3
|
||
|
+9581*T**(-1); 1802.00 Y
|
||
|
-445688.206+2233.102116*T-298.1351305*T*LN(T)+65.950553E-3*T**2
|
||
|
-3.041405E-6*T**3+123973199*T**(-1); 3200.00 N !
|
||
|
|
||
|
PARAMETER G(LIQUID,ER;0) 298.15
|
||
|
10892.966+106.457118*T-28.3846744*T*LN(T)+0.995792E-3*T**2-0.952557E-6*T**3
|
||
|
+9581*T**(-1); 500.00 Y
|
||
|
17912.678+0.355564*T-12.0761776*T*LN(T)-14.414687E-3*T**2+1.316517E-6*T**3
|
||
|
-528122*T**(-1); 1802.00 Y
|
||
|
747.131+187.623024*T-38.702*T*LN(T); 3200.00 N !
|
||
|
|
||
|
$ New data - Susanne Norgren, J P E 2000, 21(2), 148-156
|
||
|
PARAMETER G(BCC_A2,ER:VA;0) 298.15
|
||
|
-3889.136+114.204611*T-28.3846744*T*LN(T)+0.995792E-3*T**2-0.952557E-6*T**3
|
||
|
+9581*T**(-1); 1802.00 Y
|
||
|
-441088.206+2230.607763*T-298.1351305*T*LN(T)+65.950553E-3*T**2
|
||
|
-3.041405E-6*T**3+123973199*T**(-1); 3200.00 N !
|
||
|
$ -------------------------------------
|
||
|
|
||
|
$ Eu
|
||
|
$ -------------------------------------
|
||
|
PARAMETER G(BCC_A2,EU:VA;0) 298.15
|
||
|
-9864.965+135.836737*T-32.8418896*T*LN(T)+9.31735E-3*T**2-4.006564E-6*T**3
|
||
|
+102717*T**(-1); 1095.00 Y
|
||
|
-287423.476+2174.733036*T-309.3571009*T*LN(T)+114.530917E-3*T**2
|
||
|
-8.809866E-6*T**3+48455305*T**(-1); 1900.00 N !
|
||
|
|
||
|
PARAMETER G(LIQUID,EU;0) 298.15
|
||
|
-1482.46+128.661522*T-32.8418896*T*LN(T)+9.31735E-3*T**2-4.006564E-6*T**3
|
||
|
+102717*T**(-1); 400.00 Y
|
||
|
10972.726-103.688201*T+4.3501554*T*LN(T)-36.811218E-3*T**2+5.452934E-6*T**3
|
||
|
-646908*T**(-1); 1095.00 Y
|
||
|
-6890.641+175.517247*T-38.11624*T*LN(T); 1900.00 N !
|
||
|
$ -------------------------------------
|
||
|
|
||
|
$ Fe
|
||
|
$ -------------------------------------
|
||
|
PARAMETER G(BCC_A2,FE:VA;0) 298.15
|
||
|
1225.7+124.134*T-23.5143*T*LN(T)-4.39752E-3*T**2-0.058927E-6*T**3+77359*T**(-1);
|
||
|
1811.00 Y
|
||
|
-25383.581+299.31255*T-46*T*LN(T)+2296.03E28*T**(-9); 6000.00 N !
|
||
|
PARAMETER TC(BCC_A2,FE:VA;0) 298.15 1043.00; 6000.00 N !
|
||
|
PARAMETER BM(BCC_A2,FE:VA;0) 298.15 2.22; 6000.00 N !
|
||
|
|
||
|
$ Slight changes to data for high temperature range
|
||
|
PARAMETER G(FCC_A1,FE:VA;0) 298.15
|
||
|
-236.7+132.416*T-24.6643*T*LN(T)-3.75752E-3*T**2-0.058927E-6*T**3+77359*T**(-1);
|
||
|
1811.00 Y
|
||
|
-27097.3963+300.252559*T-46*T*LN(T)+2788.54E28*T**(-9); 6000.00 N !
|
||
|
PARAMETER TC(FCC_A1,FE:VA;0) 298.15 -201.00; 6000.00 N !
|
||
|
PARAMETER BM(FCC_A1,FE:VA;0) 298.15 -2.10; 6000.00 N !
|
||
|
|
||
|
PARAMETER G(LIQUID,FE;0) 298.15
|
||
|
13265.87+117.57557*T-23.5143*T*LN(T)-4.39752E-3*T**2-0.058927E-6*T**3
|
||
|
+77359*T**(-1)-367.516E-23*T**7; 1811.00 Y
|
||
|
-10838.83+291.302*T-46*T*LN(T); 6000.00 N !
|
||
|
|
||
|
PARAMETER G(CBCC_A12,FE:VA;0) 298.15
|
||
|
5970.7+124.134*T-23.5143*T*LN(T)-4.39752E-3*T**2-0.058927E-6*T**3+77359*T**(-1);
|
||
|
1811.00 Y
|
||
|
-20638.581+299.31255*T-46*T*LN(T)+2296.03E28*T**(-9); 6000.00 N !
|
||
|
|
||
|
PARAMETER G(CUB_A13,FE:VA;0) 298.15
|
||
|
4970.7+124.134*T-23.5143*T*LN(T)-4.39752E-3*T**2-0.058927E-6*T**3+77359*T**(-1);
|
||
|
1811.00 Y
|
||
|
-21638.581+299.31255*T-46*T*LN(T)+2296.03E28*T**(-9); 6000.00 N !
|
||
|
|
||
|
$ Small changes to data for high temperature range
|
||
|
PARAMETER G(HCP_A3,FE:VA;0) 298.15
|
||
|
-2480.08+136.725*T-24.6643*T*LN(T)-3.75752E-3*T**2-0.058927E-6*T**3
|
||
|
+77359*T**(-1); 1811.00 Y
|
||
|
-29340.776+304.561559*T-46*T*LN(T)+2788.54E28*T**(-9); 6000.00 N !
|
||
|
|
||
|
PARAMETER G(ORTHORHOMBIC_A20,FE;0) 298.15
|
||
|
6225.7+124.134*T-23.5143*T*LN(T)-4.39752E-3*T**2-0.058927E-6*T**3+77359*T**(-1);
|
||
|
1811.00 Y
|
||
|
-20383.581+299.31255*T-46*T*LN(T)+2296.03E28*T**(-9); 6000.00 N !
|
||
|
|
||
|
PARAMETER G(TETRAGONAL_U,FE;0) 298.15
|
||
|
6225.7+124.134*T-23.5143*T*LN(T)-4.39752E-3*T**2-0.058927E-6*T**3+77359*T**(-1);
|
||
|
1811.00 Y
|
||
|
-20383.581+299.31255*T-46*T*LN(T)+2296.03E28*T**(-9); 6000.00 N !
|
||
|
$ -------------------------------------
|
||
|
|
||
|
$ Ga
|
||
|
$ -------------------------------------
|
||
|
$ Changed for version 3.00: lower temperature limit now 200 K
|
||
|
PARAMETER G(ORTHORHOMBIC_GA,GA;0) 200.00
|
||
|
-21312.331+585.263691*T-108.2287832*T*LN(T)+227.155636E-3*T**2
|
||
|
-118.575257E-6*T**3+439954*T**(-1); 302.91 Y
|
||
|
-7055.643+132.73019*T-26.0692906*T*LN(T)+0.1506E-3*T**2-0.040173E-6*T**3
|
||
|
-118332*T**(-1)+164.547E21*T**(-9); 4000.00 N !
|
||
|
|
||
|
$ Changed for version 3.00: lower temperature limit now 200 K
|
||
|
PARAMETER G(LIQUID,GA;0) 200.00
|
||
|
-15821.033+567.189696*T-108.2287832*T*LN(T)+227.155636E-3*T**2
|
||
|
-118.575257E-6*T**3+439954*T**(-1)-70.171E-18*T**7; 302.91 Y
|
||
|
-1389.188+114.049043*T-26.0692906*T*LN(T)+0.1506E-3*T**2-0.040173E-6*T**3
|
||
|
-118332*T**(-1); 4000.00 N !
|
||
|
|
||
|
$ Changed for version 3.00: lower temperature limit now 200 K
|
||
|
PARAMETER G(HCP_A3,GA:VA;0) 200.00
|
||
|
-16812.331+575.763691*T-108.2287832*T*LN(T)+227.155636E-3*T**2
|
||
|
-118.575257E-6*T**3+439954*T**(-1); 302.91 Y
|
||
|
-2555.643+123.23019*T-26.0692906*T*LN(T)+0.1506E-3*T**2-0.040173E-6*T**3
|
||
|
-118332*T**(-1)+164.547E21*T**(-9); 4000.00 N !
|
||
|
|
||
|
$ Changed for version 3.00: lower temperature limit now 200 K
|
||
|
PARAMETER G(FCC_A1,GA:VA;0) 200.00
|
||
|
-17512.331+575.063691*T-108.2287832*T*LN(T)+227.155636E-3*T**2
|
||
|
-118.575257E-6*T**3+439954*T**(-1); 302.91 Y
|
||
|
-3255.643+122.53019*T-26.0692906*T*LN(T)+0.1506E-3*T**2-0.040173E-6*T**3
|
||
|
-118332*T**(-1)+164.547E21*T**(-9); 4000.00 N !
|
||
|
|
||
|
$ Changed for version 3.00: lower temperature limit now 200 K
|
||
|
PARAMETER G(BCC_A2,GA:VA;0) 200.00
|
||
|
-16812.331+573.563691*T-108.2287832*T*LN(T)+227.155636E-3*T**2
|
||
|
-118.575257E-6*T**3+439954*T**(-1); 302.91 Y
|
||
|
-2555.643+121.03019*T-26.0692906*T*LN(T)+0.1506E-3*T**2-0.040173E-6*T**3
|
||
|
-118332*T**(-1)+164.547E21*T**(-9); 4000.00 N !
|
||
|
|
||
|
$ Changed for version 3.00: lower temperature limit now 200 K
|
||
|
PARAMETER G(TETRAGONAL_A6,GA;0) 200.00
|
||
|
-17812.331+575.263691*T-108.2287832*T*LN(T)+227.155636E-3*T**2
|
||
|
-118.575257E-6*T**3+439954*T**(-1); 302.91 Y
|
||
|
-3555.643+122.73019*T-26.0692906*T*LN(T)+0.1506E-3*T**2-0.040173E-6*T**3
|
||
|
-118332*T**(-1)+164.547E21*T**(-9); 4000.00 N !
|
||
|
|
||
|
$ Changed for version 3.00: lower temperature limit now 200 K
|
||
|
PARAMETER G(BCT_A5,GA;0) 200.00
|
||
|
-17466.331+575.463691*T-108.2287832*T*LN(T)+227.155636E-3*T**2
|
||
|
-118.575257E-6*T**3+439954*T**(-1); 302.91 Y
|
||
|
-3209.643+122.93019*T-26.0692906*T*LN(T)+0.1506E-3*T**2-0.040173E-6*T**3
|
||
|
-118332*T**(-1)+164.547E21*T**(-9); 4000.00 N !
|
||
|
$ -------------------------------------
|
||
|
|
||
|
$ Gd
|
||
|
$ -------------------------------------
|
||
|
$ Data from Huasen Shen, Weijing Zhang, Guoquan Liu, Run Wang and Zhenmin Du
|
||
|
$ Report F-95-02, May 1995, University of Science and Technology, Beijing
|
||
|
PARAMETER G(HCP_A3,GD:VA;0) 200 -6834.58550+97.131010*T-24.7214131*T*LN(T)
|
||
|
-2.85240521E-3*T**2-3.14674076E-7*T**3-8665.73348*T**(-1); 1000 Y
|
||
|
-6483.25362+95.6919924*T-24.6598297*T*LN(T)-1.85225011E-3*T**2
|
||
|
-6.61211607E-7*T**3; 1508.15 Y
|
||
|
-123124.992+699.125537*T-101.800197*T*LN(T)+1.50644246E-2*T**2
|
||
|
-6.39165948E-7*T**3+29356890.3*T**(-1); 3600 N !
|
||
|
PARAMETER TC(HCP_A3,GD:VA;0) 200 293.4; 3600 N !
|
||
|
PARAMETER BMAGN(HCP_A3,GD:VA;0) 200 3.0; 3600 N !
|
||
|
|
||
|
$ Data from Huasen Shen, Weijing Zhang, Guoquan Liu, Run Wang and Zhenmin Du
|
||
|
$ Report F-95-02, May 1995, University of Science and Technology, Beijing
|
||
|
PARAMETER G(BCC_A2,GD:VA;0) 100 -3600.77684+95.01916415*T-24.7214131*T*LN(T)
|
||
|
-2.85240521E-3*T**2-3.14674076E-7*T**3-8665.73348*T**(-1); 1000 Y
|
||
|
152792.743-1349.58873*T+180.097094*T*LN(T)-0.119550229*T**2
|
||
|
+1.17915728E-5*T**3-22038836*T**(-1); 1508.15 Y
|
||
|
-15783.7618+202.222057*T-38.9604250*T*LN(T); 1586.15 Y
|
||
|
-19850.5562+224.817909*T-41.9043330*T*LN(T)+8.58222759E-4*T**2
|
||
|
-3.77570269E-8*T**3+995428.573*T**(-1); 3600 N !
|
||
|
|
||
|
$ Data from Huasen Shen, Weijing Zhang, Guoquan Liu, Run Wang and Zhenmin Du
|
||
|
$ Report F-95-02, May 1995, University of Science and Technology, Beijing
|
||
|
PARAMETER G(LIQUID,GD;0) 100 6225.4407+88.80921026*T-24.7214131*T*LN(T)
|
||
|
-2.85240521E-3*T**2-3.14674076E-7*T**3-8665.73348*T**(-1); 1000 Y
|
||
|
146262.037-1208.70685*T+159.352082*T*LN(T)-0.108247135*T**2
|
||
|
+1.06945505E-5*T**3-19678357*T**(-1); 1508.15 Y
|
||
|
-5397.31400+192.336215*T-38.5075000*T*LN(T); 3600 N !
|
||
|
|
||
|
$ Data from M Zinkevich, N Mattern and H J Seiffert
|
||
|
$ J P E 2000, 21(4), 385-394
|
||
|
PARAMETER G(FCC_A1,GD:VA;0) 200 -6334.58550+97.131010*T-24.7214131*T*LN(T)
|
||
|
-2.85240521E-3*T**2-3.14674076E-7*T**3-8665.73348*T**(-1); 1000 Y
|
||
|
-5983.25362+95.6919924*T-24.6598297*T*LN(T)-1.85225011E-3*T**2
|
||
|
-6.61211607E-7*T**3; 1508.15 Y
|
||
|
-122624.992+699.125537*T-101.800197*T*LN(T)+1.50644246E-2*T**2
|
||
|
-6.39165948E-7*T**3+29356890.3*T**(-1); 3600 N !
|
||
|
$ -------------------------------------
|
||
|
|
||
|
$ Ge
|
||
|
$ -------------------------------------
|
||
|
PARAMETER G(DIAMOND_A4,GE;0) 298.15
|
||
|
-9486.153+165.635573*T-29.5337682*T*LN(T)+5.568297E-3*T**2-1.513694E-6*T**3
|
||
|
+163298*T**(-1); 900.00 Y
|
||
|
-5689.239+102.86087*T-19.8536239*T*LN(T)-3.672527E-3*T**2; 1211.40 Y
|
||
|
-9548.204+156.708024*T-27.6144*T*LN(T)-859.809E26*T**(-9); 3200.00 N !
|
||
|
|
||
|
PARAMETER G(LIQUID,GE;0) 298.15
|
||
|
27655.337+134.94853*T-29.5337682*T*LN(T)+5.568297E-3*T**2-1.513694E-6*T**3
|
||
|
+163298*T**(-1)+856.632E-23*T**7; 900.00 Y
|
||
|
31452.25+72.173826*T-19.8536239*T*LN(T)-3.672527E-3*T**2+856.632E-23*T**7;
|
||
|
1211.40 Y
|
||
|
27243.473+126.324186*T-27.6144*T*LN(T); 3200.00 N !
|
||
|
|
||
|
PARAMETER G(FCC_A1,GE:VA;0) 298.15
|
||
|
26513.847+143.335573*T-29.5337682*T*LN(T)+5.568297E-3*T**2-1.513694E-6*T**3
|
||
|
+163298*T**(-1); 900.00 Y
|
||
|
30310.761+80.56087*T-19.8536239*T*LN(T)-3.672527E-3*T**2; 1211.40 Y
|
||
|
26451.796+134.408024*T-27.6144*T*LN(T)-859.809E26*T**(-9); 3200.00 N !
|
||
|
|
||
|
PARAMETER G(BCC_A2,GE:VA;0) 298.15
|
||
|
24613.847+142.135573*T-29.5337682*T*LN(T)+5.568297E-3*T**2-1.513694E-6*T**3
|
||
|
+163298*T**(-1); 900.00 Y
|
||
|
28410.761+79.36087*T-19.8536239*T*LN(T)-3.672527E-3*T**2; 1211.40 Y
|
||
|
24551.796+133.208024*T-27.6144*T*LN(T)-859.809E26*T**(-9); 3200.00 N !
|
||
|
|
||
|
PARAMETER G(HCP_A3,GE:VA;0) 298.15
|
||
|
25513.847+144.135573*T-29.5337682*T*LN(T)+5.568297E-3*T**2-1.513694E-6*T**3
|
||
|
+163298*T**(-1); 900.00 Y
|
||
|
29310.761+81.36087*T-19.8536239*T*LN(T)-3.672527E-3*T**2; 1211.40 Y
|
||
|
25451.796+135.208024*T-27.6144*T*LN(T)-859.809E26*T**(-9); 3200.00 N !
|
||
|
|
||
|
$ Source of data: Unpublished work by Alan Dinsdale
|
||
|
PARAMETER G(BCT_A5,GE;0) 298.15
|
||
|
19313.847+149.135573*T-29.5337682*T*LN(T)+5.568297E-3*T**2-1.513694E-6*T**3
|
||
|
+163298*T**(-1); 900.00 Y
|
||
|
23110.761+86.36087*T-19.8536239*T*LN(T)-3.672527E-3*T**2; 1211.40 Y
|
||
|
19251.796+140.208024*T-27.6144*T*LN(T)-859.809E26*T**(-9); 3000.00 N !
|
||
|
|
||
|
$ Source of data: Unpublished work by Alan Dinsdale
|
||
|
PARAMETER G(RHOMBOHEDRAL_A7,GE;0) 298.15
|
||
|
20313.847+149.135573*T-29.5337682*T*LN(T)+5.568297E-3*T**2-1.513694E-6*T**3
|
||
|
+163298*T**(-1); 900.00 Y
|
||
|
24110.761+86.36087*T-19.8536239*T*LN(T)-3.672527E-3*T**2; 1211.40 Y
|
||
|
20251.796+140.208024*T-27.6144*T*LN(T)-859.809E26*T**(-9); 3000.00 N !
|
||
|
$ -------------------------------------
|
||
|
|
||
|
$ Hf
|
||
|
$ -------------------------------------
|
||
|
PARAMETER G(HCP_A3,HF:VA;0) 298.15
|
||
|
-6987.297+110.744026*T-22.7075*T*LN(T)-4.146145E-3*T**2-0.000477E-6*T**3
|
||
|
-22590*T**(-1); 2506.00 Y
|
||
|
-1446776.329+6193.609991*T-787.5363829*T*LN(T)+173.5215E-3*T**2
|
||
|
-7.575759E-6*T**3+501742495*T**(-1); 3000.00 N !
|
||
|
|
||
|
PARAMETER G(BCC_A2,HF:VA;0) 298.15
|
||
|
5370.703+103.836026*T-22.8995*T*LN(T)-4.206605E-3*T**2+0.871923E-6*T**3
|
||
|
-22590*T**(-1)-0.1446E-9*T**4; 2506.00 Y
|
||
|
1912456.771-8624.20573*T+1087.6141247*T*LN(T)-286.857065E-3*T**2
|
||
|
+13.427829E-6*T**3-610085091*T**(-1); 3000.00 N !
|
||
|
|
||
|
PARAMETER G(LIQUID,HF;0) 298.15
|
||
|
20414.959+99.790933*T-22.7075*T*LN(T)-4.146145E-3*T**2-0.000477E-6*T**3
|
||
|
-22590*T**(-1); 1000.00 Y
|
||
|
49731.499-149.91739*T+12.116812*T*LN(T)-21.262021E-3*T**2+1.376466E-6*T**3
|
||
|
-4449699*T**(-1); 2506.00 Y
|
||
|
-4247.217+265.470523*T-44*T*LN(T); 3000.00 N !
|
||
|
|
||
|
PARAMETER G(FCC_A1,HF:VA;0) 298.15
|
||
|
3012.703+108.544026*T-22.7075*T*LN(T)-4.146145E-3*T**2-0.000477E-6*T**3
|
||
|
-22590*T**(-1); 2506.00 Y
|
||
|
-1436776.329+6191.409991*T-787.5363829*T*LN(T)+173.5215E-3*T**2
|
||
|
-7.575759E-6*T**3+501742495*T**(-1); 3000.00 N !
|
||
|
$ -------------------------------------
|
||
|
|
||
|
$ Hg
|
||
|
$ -------------------------------------
|
||
|
PARAMETER G(LIQUID,HG;0) 200.00
|
||
|
82356.855-3348.194658*T+618.1933082*T*LN(T)-2028.2337E-3*T**2
|
||
|
+1183.982129E-6*T**3-2366612*T**(-1); 234.32 Y
|
||
|
-8961.207+135.232291*T-32.257*T*LN(T)+9.7977E-3*T**2-3.20695E-6*T**3
|
||
|
+6670*T**(-1); 400.00 Y
|
||
|
-7970.627+112.33345*T-28.414*T*LN(T)+3.18535E-3*T**2-1.077802E-6*T**3
|
||
|
-41095*T**(-1); 700.00 Y
|
||
|
-7161.338+90.797305*T-24.87*T*LN(T)-1.66775E-3*T**2+0.008737E-6*T**3
|
||
|
-27495*T**(-1); 2000.00 N !
|
||
|
|
||
|
PARAMETER G(RHOMBO_A10,HG;0) 200.00
|
||
|
-10668.401+123.274598*T-28.847*T*LN(T)+16.99705E-3*T**2-24.555667E-6*T**3
|
||
|
+13330*T**(-1); 234.32 Y
|
||
|
-11425.394+135.928158*T-30.2091*T*LN(T)+1.07555E-3*T**2-0.228298E-6*T**3
|
||
|
+35545*T**(-1); 2000.00 N !
|
||
|
|
||
|
$ Source of data: Assessment of data the Cd-Hg system
|
||
|
$ Jang, Silk, Watson, Bryant, Chart and Argent, CALPHAD, 1995, 19(3),
|
||
|
$ 415. "The thermodynamics and phase diagrams of the Cd-Hg and Cd-Hg-Te
|
||
|
$ systems"
|
||
|
PARAMETER G(TETRAGONAL_A6,HG;0) 200 -10459.721+125.04019*T-28.847*T*LN(T)
|
||
|
+16.99705E-3*T**2-24.555667E-6*T**3+13330*T**(-1); 234.32 Y
|
||
|
-11216.714+137.69375*T-30.2091*T*LN(T)+1.07555E-3*T**2-0.228298E-6*T**3
|
||
|
+35545*T**(-1); 2000 N !
|
||
|
|
||
|
$ Source of data: Assessment of data the Cd-Hg system
|
||
|
$ Jang, Silk, Watson, Bryant, Chart and Argent, CALPHAD, 1995, 19(3),
|
||
|
$ 415. "The thermodynamics and phase diagrams of the Cd-Hg and Cd-Hg-Te
|
||
|
$ systems"
|
||
|
PARAMETER G(HCP_A3,HG:VA;0) 200 -10468.401+123.974598*T-28.847*T*LN(T)
|
||
|
+16.99705E-3*T**2-24.555667E-6*T**3+13330*T**(-1); 234.32 Y
|
||
|
-11225.394+136.628158*T-30.2091*T*LN(T)+1.07555E-3*T**2-0.228298E-6*T**3
|
||
|
+35545*T**(-1); 2000 N !
|
||
|
|
||
|
|
||
|
$ -------------------------------------
|
||
|
|
||
|
$ Ho
|
||
|
$ -------------------------------------
|
||
|
PARAMETER G(HCP_A3,HO:VA;0) 298.15
|
||
|
-7612.429+86.593171*T-23.4879*T*LN(T)-8.27315E-3*T**2+2.375467E-6*T**3;
|
||
|
600.00 Y
|
||
|
-10917.688+182.475691*T-39.6932*T*LN(T)+18.20065E-3*T**2-4.829733E-6*T**3;
|
||
|
900.00 Y
|
||
|
46646.188-421.474473*T+48.0595*T*LN(T)-42.4634E-3*T**2+3.233133E-6*T**3
|
||
|
-7185900*T**(-1); 1200.00 Y
|
||
|
27786.061-156.162846*T+8.28608*T*LN(T)-10.82725E-3*T**2-1.112352E-6*T**3
|
||
|
-6183850*T**(-1); 1703.00 Y
|
||
|
-825364.662+4248.379056*T-558.9506818*T*LN(T)+139.111904E-3*T**2
|
||
|
-6.824652E-6*T**3+219952973*T**(-1); 3000.00 N !
|
||
|
|
||
|
$ New data derived from Susanne Norgren, JPE 2000, 21(2), 148-156
|
||
|
PARAMETER G(BCC_A2,HO:VA;0) 298.15
|
||
|
-3773.06+84.546902*T-23.4879*T*LN(T)-8.27315E-3*T**2+2.375467E-6*T**3; 600.00 Y
|
||
|
-7078.318+180.429422*T-39.6932*T*LN(T)+18.20065E-3*T**2-4.829733E-6*T**3;
|
||
|
900.00 Y
|
||
|
50485.557-423.520743*T+48.0595*T*LN(T)-42.4634E-3*T**2+3.233133E-6*T**3
|
||
|
-7185900*T**(-1); 1000.00 Y
|
||
|
185620.196-1635.726622*T+218.9372486*T*LN(T)-135.16576E-3*T**2
|
||
|
+12.168911E-6*T**3-26729747*T**(-1); 1703.00 Y
|
||
|
-28759.761+272.961035*T-48.116*T*LN(T); 1745.00 Y
|
||
|
-152646.008+939.778244*T-134.7930638*T*LN(T)+25.544089E-3*T**2
|
||
|
-1.287517E-6*T**3+32050889*T**(-1); 3000.00 N !
|
||
|
$-3881.2+84.532855*T-23.4879*T*LN(T)-8.27315E-3*T**2+2.375467E-6*T**3; 600.00 Y
|
||
|
$-7186.458+180.415375*T-39.6932*T*LN(T)+18.20065E-3*T**2-4.829733E-6*T**3;
|
||
|
$ 900.00 Y
|
||
|
$ 50377.417-423.53479*T+48.0595*T*LN(T)-42.4634E-3*T**2+3.233133E-6*T**3
|
||
|
$-7185900*T**(-1); 1000.00 Y
|
||
|
$ 185512.056-1635.740669*T+218.9372486*T*LN(T)-135.16576E-3*T**2
|
||
|
$+12.168911E-6*T**3-26729747*T**(-1); 1703.00 Y
|
||
|
$-28867.901+272.946988*T-48.116*T*LN(T); 1745.00 Y
|
||
|
$ -152754.148+939.764197*T-134.7930638*T*LN(T)+25.544089E-3*T**2
|
||
|
$-1.287517E-6*T**3+32050889*T**(-1); 3000.00 N !
|
||
|
|
||
|
$ New data derived from Susanne Norgren, JPE 2000, 21(2), 148-156
|
||
|
PARAMETER G(LIQUID,HO;0) 298.15
|
||
|
9770.9926+76.600977*T-23.4879*T*LN(T)-8.27315E-3*T**2+2.375467E-6*T**3;
|
||
|
600.00 Y
|
||
|
6465.7336+172.483497*T-39.6932*T*LN(T)+18.20065E-3*T**2-4.829733E-6*T**3;
|
||
|
900.00 Y
|
||
|
64029.2496-431.466667*T+48.0595*T*LN(T)-42.4634E-3*T**2+3.233133E-6*T**3
|
||
|
-7185900*T**(-1); 1000.00 Y
|
||
|
124827.5326-994.683024*T+127.9577778*T*LN(T)-88.196514E-3*T**2+8.008222E-6*T**3
|
||
|
-15727191*T**(-1); 1703.00 Y
|
||
|
-9688.5314+230.793918*T-43.932*T*LN(T); 3000.00 N !
|
||
|
$PARAMETER G(LIQUID,HO;0) 298.15
|
||
|
$9649.743+76.600977*T-23.4879*T*LN(T)-8.27315E-3*T**2+2.375467E-6*T**3;
|
||
|
$ 600.00 Y
|
||
|
$6344.484+172.483497*T-39.6932*T*LN(T)+18.20065E-3*T**2-4.829733E-6*T**3;
|
||
|
$ 900.00 Y
|
||
|
$ 63908.36-431.466667*T+48.0595*T*LN(T)-42.4634E-3*T**2+3.233133E-6*T**3
|
||
|
$-7185900*T**(-1); 1000.00 Y
|
||
|
$ 124706.283-994.683024*T+127.9577778*T*LN(T)-88.196514E-3*T**2+8.008222E-6*T**3
|
||
|
$-15727191*T**(-1); 1703.00 Y
|
||
|
$-9809.781+230.793918*T-43.932*T*LN(T); 3000.00 N !
|
||
|
$ -------------------------------------
|
||
|
|
||
|
$ In
|
||
|
$ -------------------------------------
|
||
|
PARAMETER G(TETRAGONAL_A6,IN;0) 298.15
|
||
|
-6978.89+92.338115*T-21.8386*T*LN(T)-5.72566E-3*T**2-2.120321E-6*T**3
|
||
|
-22906*T**(-1); 429.75 Y
|
||
|
-7033.516+124.476588*T-27.4562*T*LN(T)+0.54607E-3*T**2-0.08367E-6*T**3
|
||
|
-211708*T**(-1)+353.116E20*T**(-9); 3800.00 N !
|
||
|
|
||
|
PARAMETER G(LIQUID,IN;0) 298.15
|
||
|
-3696.798+84.701255*T-21.8386*T*LN(T)-5.72566E-3*T**2-2.120321E-6*T**3
|
||
|
-22906*T**(-1)-559.058E-22*T**7; 429.75 Y
|
||
|
-3749.81+116.835784*T-27.4562*T*LN(T)+0.54607E-3*T**2-0.08367E-6*T**3
|
||
|
-211708*T**(-1); 3800.00 N !
|
||
|
|
||
|
PARAMETER G(HCP_A3,IN:VA;0) 298.15
|
||
|
-6445.89+91.651315*T-21.8386*T*LN(T)-5.72566E-3*T**2-2.120321E-6*T**3
|
||
|
-22906*T**(-1); 429.75 Y
|
||
|
-6500.516+123.789788*T-27.4562*T*LN(T)+0.54607E-3*T**2-0.08367E-6*T**3
|
||
|
-211708*T**(-1)+353.116E20*T**(-9); 3800.00 N !
|
||
|
|
||
|
PARAMETER G(HCP_ZN,IN:VA;0) 298.15
|
||
|
-6445.89+91.651315*T-21.8386*T*LN(T)-5.72566E-3*T**2-2.120321E-6*T**3
|
||
|
-22906*T**(-1); 429.75 Y
|
||
|
-6500.516+123.789788*T-27.4562*T*LN(T)+0.54607E-3*T**2-0.08367E-6*T**3
|
||
|
-211708*T**(-1)+353.116E20*T**(-9); 3800.00 N !
|
||
|
|
||
|
$ Data from Boa and Ansara; Thermochimica Acta 1998, 314, 79-86
|
||
|
PARAMETER G(FCC_A1,IN:VA;0) 298.15
|
||
|
-6816.829+92.338115*T-21.8386*T*LN(T)-5.72566E-3*T**2-2.120321E-6*T**3
|
||
|
-22906*T**(-1); 429.75 Y
|
||
|
-6871.455+124.476588*T-27.4562*T*LN(T)+0.54607E-3*T**2-0.08367E-6*T**3
|
||
|
-211708*T**(-1)+353.116E20*T**(-9); 3800.00 N !
|
||
|
|
||
|
PARAMETER G(BCC_A2,IN:VA;0) 298.15
|
||
|
-6178.89+91.538115*T-21.8386*T*LN(T)-5.72566E-3*T**2-2.120321E-6*T**3
|
||
|
-22906*T**(-1); 429.75 Y
|
||
|
-6233.516+123.676588*T-27.4562*T*LN(T)+0.54607E-3*T**2-0.08367E-6*T**3
|
||
|
-211708*T**(-1)+353.116E20*T**(-9); 3800.00 N !
|
||
|
|
||
|
$ Data from Boa and Ansara; Thermochimica Acta 1998, 314, 79-86
|
||
|
PARAMETER G(TET_ALPHA1,IN;0) 298.15
|
||
|
-6978.89+92.648115*T-21.8386*T*LN(T)-5.72566E-3*T**2-2.120321E-6*T**3
|
||
|
-22906*T**(-1); 429.75 Y
|
||
|
-7033.516+124.786588*T-27.4562*T*LN(T)+0.54607E-3*T**2-0.08367E-6*T**3
|
||
|
-211708*T**(-1)+353.116E20*T**(-9); 3800.00 N !
|
||
|
|
||
|
$ Source of data: Unpublished assessment of the In-Sn system by
|
||
|
$ Himo Ansara
|
||
|
PARAMETER G(BCT_A5,IN;0) 298.15
|
||
|
-1938.02+88.998425*T-21.8386*T*LN(T)-5.72566E-3*T**2-2.120321E-6*T**3
|
||
|
-22906*T**(-1); 429.75 Y
|
||
|
-1992.646+121.136898*T-27.4562*T*LN(T)+0.54607E-3*T**2-0.08367E-6*T**3
|
||
|
-211708*T**(-1)+353.116E20*T**(-9); 3000.00 N !
|
||
|
|
||
|
$ Data from Boa and Ansara; Thermochimica Acta 1998, 314, 79-86
|
||
|
PARAMETER G(RHOMBOHEDRAL_A7,IN;0) 298.15
|
||
|
-2794.89+92.338115*T-21.8386*T*LN(T)-5.72566E-3*T**2-2.120321E-6*T**3
|
||
|
-22906*T**(-1); 429.75 Y
|
||
|
-2849.516+124.476588*T-27.4562*T*LN(T)+0.54607E-3*T**2-0.08367E-6*T**3
|
||
|
-211708*T**(-1)+353.116E20*T**(-9); 3000.00 N !
|
||
|
|
||
|
$ -------------------------------------
|
||
|
|
||
|
$ Ir
|
||
|
$ -------------------------------------
|
||
|
PARAMETER G(FCC_A1,IR:VA;0) 298.15
|
||
|
-6936.288+118.780119*T-22.7944*T*LN(T)-3.091976E-3*T**2-20083*T**(-1);
|
||
|
1215.00 Y
|
||
|
-8123.73+140.066697*T-26.085*T*LN(T)-0.47969E-6*T**3; 2719.00 Y
|
||
|
290529.037-1258.352965*T+152.4988737*T*LN(T)-47.176402E-3*T**2
|
||
|
+1.844977E-6*T**3-92987250*T**(-1); 4000.00 N !
|
||
|
|
||
|
PARAMETER G(LIQUID,IR;0) 298.15
|
||
|
16518.956+112.46806*T-22.7944*T*LN(T)-3.091976E-3*T**2-20083*T**(-1); 1000.00 Y
|
||
|
102217.789-587.632815*T+73.9517579*T*LN(T)-46.38802E-3*T**2+2.761831E-6*T**3
|
||
|
-13382612*T**(-1); 2719.00 Y
|
||
|
-38347.217+411.234043*T-59.418*T*LN(T); 4000.00 N !
|
||
|
|
||
|
PARAMETER G(BCC_A2,IR:VA;0) 298.15
|
||
|
25063.712+111.880119*T-22.7944*T*LN(T)-3.091976E-3*T**2-20083*T**(-1);
|
||
|
1215.00 Y
|
||
|
23876.27+133.166697*T-26.085*T*LN(T)-0.47969E-6*T**3; 2719.00 Y
|
||
|
322529.037-1265.252965*T+152.4988737*T*LN(T)-47.176402E-3*T**2
|
||
|
+1.844977E-6*T**3-92987250*T**(-1); 4000.00 N !
|
||
|
|
||
|
PARAMETER G(HCP_A3,IR:VA;0) 298.15
|
||
|
-2936.288+118.180119*T-22.7944*T*LN(T)-3.091976E-3*T**2-20083*T**(-1);
|
||
|
1215.00 Y
|
||
|
-4123.73+139.466697*T-26.085*T*LN(T)-0.47969E-6*T**3; 2719.00 Y
|
||
|
294529.037-1258.952965*T+152.4988737*T*LN(T)-47.176402E-3*T**2
|
||
|
+1.844977E-6*T**3-92987250*T**(-1); 4000.00 N !
|
||
|
$ -------------------------------------
|
||
|
|
||
|
$ K
|
||
|
PARAMETER G(BCC_A2,K:VA;0) 200.00
|
||
|
-16112.929+389.624197*T-77.0571464*T*LN(T)+146.211135E-3*T**2
|
||
|
-84.949147E-6*T**3+243385*T**(-1); 336.53 Y
|
||
|
-11122.441+192.586544*T-39.2885968*T*LN(T)+12.167386E-3*T**2-2.64387E-6*T**3
|
||
|
+43251*T**(-1)+119.223E20*T**(-9); 2200.00 N !
|
||
|
|
||
|
PARAMETER G(LIQUID,K;0) 200.00
|
||
|
-13794.833+382.737338*T-77.0571464*T*LN(T)+146.211135E-3*T**2
|
||
|
-84.949147E-6*T**3+243385*T**(-1)-94.4E-20*T**7; 336.53 Y
|
||
|
-8799.422+185.684327*T-39.2885968*T*LN(T)+12.167386E-3*T**2-2.64387E-6*T**3
|
||
|
+43251*T**(-1); 2200.00 N !
|
||
|
|
||
|
PARAMETER G(HCP_A3,K:VA;0) 200.00
|
||
|
-16062.929+391.624197*T-77.0571464*T*LN(T)+146.211135E-3*T**2
|
||
|
-84.949147E-6*T**3+243385*T**(-1); 336.53 Y
|
||
|
-11072.441+194.586544*T-39.2885968*T*LN(T)+12.167386E-3*T**2-2.64387E-6*T**3
|
||
|
+43251*T**(-1)+119.223E20*T**(-9); 2200.00 N !
|
||
|
|
||
|
PARAMETER G(FCC_A1,K:VA;0) 200.00
|
||
|
-16062.929+390.924197*T-77.0571464*T*LN(T)+146.211135E-3*T**2
|
||
|
-84.949147E-6*T**3+243385*T**(-1); 336.53 Y
|
||
|
-11072.441+193.886544*T-39.2885968*T*LN(T)+12.167386E-3*T**2-2.64387E-6*T**3
|
||
|
+43251*T**(-1)+119.223E20*T**(-9); 2200.00 N !
|
||
|
$ -------------------------------------
|
||
|
|
||
|
$ La
|
||
|
$ -------------------------------------
|
||
|
PARAMETER G(DHCP,LA;0) 298.15
|
||
|
-7968.403+120.284604*T-26.34*T*LN(T)-1.295165E-3*T**2; 550.00 Y
|
||
|
-3381.413+59.06113*T-17.1659411*T*LN(T)-8.371705E-3*T**2+0.68932E-6*T**3
|
||
|
-399448*T**(-1); 2000.00 Y
|
||
|
-15608.882+181.390071*T-34.3088*T*LN(T); 4000.00 N !
|
||
|
|
||
|
PARAMETER G(FCC_A1,LA:VA;0) 298.15
|
||
|
-6109.797+89.878761*T-21.7919*T*LN(T)-4.045175E-3*T**2-0.525865E-6*T**3;
|
||
|
1134.00 Y
|
||
|
-124598.976+955.878375*T-139.3467411*T*LN(T)+42.032405E-3*T**2
|
||
|
-3.066199E-6*T**3+20994153*T**(-1); 2000.00 Y
|
||
|
-12599.386+178.54399*T-34.3088*T*LN(T); 4000.00 N !
|
||
|
|
||
|
PARAMETER G(BCC_A2,LA:VA;0) 298.15
|
||
|
-3952.161+88.072353*T-21.7919*T*LN(T)-4.045175E-3*T**2-0.525865E-6*T**3;
|
||
|
800.00 Y
|
||
|
321682.673-3565.082518*T+513.4407077*T*LN(T)-387.295093E-3*T**2
|
||
|
+49.547989E-6*T**3-36581228*T**(-1); 1134.00 Y
|
||
|
-16377.894+218.492988*T-39.5388*T*LN(T); 1193.00 Y
|
||
|
-136609.91+1123.343974*T-163.4130738*T*LN(T)+53.968535E-3*T**2
|
||
|
-4.056395E-6*T**3+21167204*T**(-1); 2000.00 Y
|
||
|
-8205.988+174.836315*T-34.3088*T*LN(T); 4000.00 N !
|
||
|
|
||
|
PARAMETER G(LIQUID,LA;0) 298.15
|
||
|
5332.653+18.23012*T-11.0188191*T*LN(T)-20.171603E-3*T**2+2.93775E-6*T**3
|
||
|
-133541*T**(-1); 1134.00 Y
|
||
|
-3942.004+171.018431*T-34.3088*T*LN(T); 4000.00 N !
|
||
|
$ -------------------------------------
|
||
|
|
||
|
$ Li
|
||
|
$ -------------------------------------
|
||
|
PARAMETER G(BCC_A2,LI:VA;0) 200.00
|
||
|
-10583.817+217.637482*T-38.940488*T*LN(T)+35.466931E-3*T**2-19.869816E-6*T**3
|
||
|
+159994*T**(-1); 453.60 Y
|
||
|
-559579.123+10547.879893*T-1702.8886493*T*LN(T)+2258.329444E-3*T**2
|
||
|
-571.066077E-6*T**3+33885874*T**(-1); 500.00 Y
|
||
|
-9062.994+179.278285*T-31.2283718*T*LN(T)+2.633221E-3*T**2-0.438058E-6*T**3
|
||
|
-102387*T**(-1); 3000.00 N !
|
||
|
|
||
|
PARAMETER G(LIQUID,LI;0) 200.00
|
||
|
-7883.612+211.841861*T-38.940488*T*LN(T)+35.466931E-3*T**2-19.869816E-6*T**3
|
||
|
+159994*T**(-1); 250.00 Y
|
||
|
12015.027-362.187078*T+61.6104424*T*LN(T)-182.426463E-3*T**2+63.955671E-6*T**3
|
||
|
-559968*T**(-1); 453.60 Y
|
||
|
-6057.31+172.652183*T-31.2283718*T*LN(T)+2.633221E-3*T**2-0.438058E-6*T**3
|
||
|
-102387*T**(-1); 3000.00 N !
|
||
|
|
||
|
PARAMETER G(FCC_A1,LI:VA;0) 200.00
|
||
|
-10691.817+218.937482*T-38.940488*T*LN(T)+35.466931E-3*T**2-19.869816E-6*T**3
|
||
|
+159994*T**(-1); 453.60 Y
|
||
|
-559687.123+10549.179893*T-1702.8886493*T*LN(T)+2258.329444E-3*T**2
|
||
|
-571.066077E-6*T**3+33885874*T**(-1); 500.00 Y
|
||
|
-9170.994+180.578285*T-31.2283718*T*LN(T)+2.633221E-3*T**2-0.438058E-6*T**3
|
||
|
-102387*T**(-1); 3000.00 N !
|
||
|
|
||
|
PARAMETER G(HCP_A3,LI:VA;0) 200.00
|
||
|
-10737.817+219.637482*T-38.940488*T*LN(T)+35.466931E-3*T**2-19.869816E-6*T**3
|
||
|
+159994*T**(-1); 453.60 Y
|
||
|
-559733.123+10549.879893*T-1702.8886493*T*LN(T)+2258.329444E-3*T**2
|
||
|
-571.066077E-6*T**3+33885874*T**(-1); 500.00 Y
|
||
|
-9216.994+181.278285*T-31.2283718*T*LN(T)+2.633221E-3*T**2-0.438058E-6*T**3
|
||
|
-102387*T**(-1); 3000.00 N !
|
||
|
$ -------------------------------------
|
||
|
|
||
|
$ Lu
|
||
|
$ -------------------------------------
|
||
|
PARAMETER G(HCP_A3,LU:VA;0) 298.15
|
||
|
-8788.329+146.536283*T-29.812*T*LN(T)+5.19165E-3*T**2-1.790717E-6*T**3
|
||
|
+39723*T**(-1); 700.00 Y
|
||
|
-9043.057+142.327643*T-29.0095*T*LN(T)+3.71416E-3*T**2-1.50147E-6*T**3
|
||
|
+141549*T**(-1); 1700.00 Y
|
||
|
6940.092-46.91844*T-1.83986*T*LN(T)-11.9001E-3*T**2; 1936.00 Y
|
||
|
-404023.691+1829.379425*T-239.019502*T*LN(T)+41.800748E-3*T**2
|
||
|
-1.661174E-6*T**3+124825465*T**(-1); 3700.00 N !
|
||
|
|
||
|
PARAMETER G(LIQUID,LU;0) 298.15
|
||
|
3983.791+141.5374*T-29.812*T*LN(T)+5.19165E-3*T**2-1.790717E-6*T**3
|
||
|
+39723*T**(-1); 600.00 Y
|
||
|
30389.863-198.378793*T+20.9392663*T*LN(T)-34.238743E-3*T**2+2.890636E-6*T**3
|
||
|
-2398650*T**(-1); 1936.00 Y
|
||
|
-18994.687+292.091104*T-47.9068*T*LN(T); 3700.00 N !
|
||
|
$ -------------------------------------
|
||
|
|
||
|
$ Mg
|
||
|
$ -------------------------------------
|
||
|
PARAMETER G(HCP_A3,MG:VA;0) 298.15
|
||
|
-8367.34+143.675547*T-26.1849782*T*LN(T)+0.4858E-3*T**2-1.393669E-6*T**3
|
||
|
+78950*T**(-1); 923.00 Y
|
||
|
-14130.185+204.716215*T-34.3088*T*LN(T)+1038.192E25*T**(-9); 3000.00 N !
|
||
|
|
||
|
PARAMETER G(HCP_ZN,MG:VA;0) 298.15
|
||
|
-8267.34+143.675547*T-26.1849782*T*LN(T)+0.4858E-3*T**2-1.393669E-6*T**3
|
||
|
+78950*T**(-1); 923.00 Y
|
||
|
-14030.185+204.716215*T-34.3088*T*LN(T)+1038.192E25*T**(-9); 3000.00 N !
|
||
|
|
||
|
PARAMETER G(LIQUID,MG;0) 298.15
|
||
|
-165.097+134.838617*T-26.1849782*T*LN(T)+0.4858E-3*T**2-1.393669E-6*T**3
|
||
|
+78950*T**(-1)-80.176E-21*T**7; 923.00 Y
|
||
|
-5439.869+195.324057*T-34.3088*T*LN(T); 3000.00 N !
|
||
|
|
||
|
PARAMETER G(FCC_A1,MG:VA;0) 298.15
|
||
|
-5767.34+142.775547*T-26.1849782*T*LN(T)+0.4858E-3*T**2-1.393669E-6*T**3
|
||
|
+78950*T**(-1); 923.00 Y
|
||
|
-11530.185+203.816215*T-34.3088*T*LN(T)+1038.192E25*T**(-9); 3000.00 N !
|
||
|
|
||
|
PARAMETER G(BCC_A2,MG:VA;0) 298.15
|
||
|
-5267.34+141.575547*T-26.1849782*T*LN(T)+0.4858E-3*T**2-1.393669E-6*T**3
|
||
|
+78950*T**(-1); 923.00 Y
|
||
|
-11030.185+202.616215*T-34.3088*T*LN(T)+1038.192E25*T**(-9); 3000.00 N !
|
||
|
|
||
|
PARAMETER G(CBCC_A12,MG:VA;0) 298.15
|
||
|
-3764.94+140.664547*T-26.1849782*T*LN(T)+0.4858E-3*T**2-1.393669E-6*T**3
|
||
|
+78950*T**(-1); 923.00 Y
|
||
|
-9527.785+201.705215*T-34.3088*T*LN(T)+1038.192E25*T**(-9); 3000.00 N !
|
||
|
|
||
|
PARAMETER G(CUB_A13,MG:VA;0) 298.15
|
||
|
-3367.34+140.675547*T-26.1849782*T*LN(T)+0.4858E-3*T**2-1.393669E-6*T**3
|
||
|
+78950*T**(-1); 923.00 Y
|
||
|
-9130.185+201.716215*T-34.3088*T*LN(T)+1038.192E25*T**(-9); 3000.00 N !
|
||
|
|
||
|
$ -------------------------------------
|
||
|
|
||
|
$ Mn
|
||
|
$ Incorporation of Volumetric information from Caian Qiu and Sybrand van der
|
||
|
$ Zwaag, J. Phys. Chem. Solids, 1998, 59(2), 167-174
|
||
|
$ HCP volumetric data assumed to be the same as those for FCC
|
||
|
$ -------------------------------------
|
||
|
PARAMETER G(CBCC_A12,MN:VA;0) 298.15
|
||
|
-8115.28+130.059*T-23.4582*T*LN(T)-7.34768E-3*T**2+69827*T**(-1); 1519.00 Y
|
||
|
-28733.41+312.2648*T-48*T*LN(T)+1656.847E27*T**(-9); 2000.00 N !
|
||
|
PARAMETER TC(CBCC_A12,MN:VA;0) 298.15 -285.00; 2000.00 N !
|
||
|
PARAMETER BM(CBCC_A12,MN:VA;0) 298.15 -0.66; 2000.00 N !
|
||
|
$PARAMETER V0(CBCC_A12,MN:VA;0) 298.15 7.258892E-06; 2000 N !
|
||
|
$PARAMETER ALPHA(CBCC_A12,MN:VA;0) 298.15 28.13687E-06+11.82448E-8*T;
|
||
|
$ 2000 N !
|
||
|
$PARAMETER KAPPA(CBCC_A12,MN:VA;0) 298.15 5.24E-12+1.99523E-15*T;
|
||
|
$ 2000 N !
|
||
|
$PARAMETER N(CBCC_A12,MN:VA;0) 298.15 5.0; 2000 N !
|
||
|
|
||
|
PARAMETER G(CUB_A13,MN:VA;0) 298.15
|
||
|
-5800.4+135.995*T-24.8785*T*LN(T)-5.83359E-3*T**2+70269*T**(-1); 1519.00 Y
|
||
|
-28290.76+311.2933*T-48*T*LN(T)+396.757E28*T**(-9); 2000.00 N !
|
||
|
$PARAMETER V0(CUB_A13,MN:VA;0) 298.15 7.367796E-06; 2000 N !
|
||
|
$PARAMETER ALPHA(CUB_A13,MN:VA;0) 298.15 93.65662E-06+31.47284E-9*T;
|
||
|
$ 2000 N !
|
||
|
$PARAMETER KAPPA(CUB_A13,MN:VA;0) 298.15 5.24E-12+1.99523E-15*T;
|
||
|
$ 2000 N !
|
||
|
$PARAMETER N(CUB_A13,MN:VA;0) 298.15 5.0; 2000 N !
|
||
|
|
||
|
PARAMETER G(FCC_A1,MN:VA;0) 298.15
|
||
|
-3439.3+131.884*T-24.5177*T*LN(T)-6E-3*T**2+69600*T**(-1); 1519.00 Y
|
||
|
-26070.1+309.6664*T-48*T*LN(T)+386.196E28*T**(-9); 2000.00 N !
|
||
|
PARAMETER TC(FCC_A1,MN:VA;0) 298.15 -1620.00; 2000.00 N !
|
||
|
PARAMETER BM(FCC_A1,MN:VA;0) 298.15 -1.86; 2000.00 N !
|
||
|
$PARAMETER V0(FCC_A1,MN:VA;0) 298.15 7.201547E-06; 2000 N !
|
||
|
$PARAMETER ALPHA(FCC_A1,MN:VA;0) 298.15 128.1572E-06+1.199968E-8*T;
|
||
|
$ 2000 N !
|
||
|
$PARAMETER KAPPA(FCC_A1,MN:VA;0) 298.15 5.24E-12+1.99523E-15*T;
|
||
|
$ 2000 N !
|
||
|
$PARAMETER N(FCC_A1,MN:VA;0) 298.15 5.0; 2000 N !
|
||
|
|
||
|
PARAMETER G(BCC_A2,MN:VA;0) 298.15
|
||
|
-3235.3+127.85*T-23.7*T*LN(T)-7.44271E-3*T**2+60000*T**(-1); 1519.00 Y
|
||
|
-23188.83+307.7043*T-48*T*LN(T)+1265.152E27*T**(-9); 2000.00 N !
|
||
|
PARAMETER TC(BCC_A2,MN:VA;0) 298.15 -580.00; 2000.00 N !
|
||
|
PARAMETER BM(BCC_A2,MN:VA;0) 298.15 -0.27; 2000.00 N !
|
||
|
$PARAMETER V0(BCC_A2,MN:VA;0) 298.15 7.313314E-06; 2000 N !
|
||
|
$PARAMETER ALPHA(BCC_A2,MN:VA;0) 298.15 131.5987E-06;
|
||
|
$ 2000 N !
|
||
|
$PARAMETER KAPPA(BCC_A2,MN:VA;0) 298.15 5.24E-12+1.99523E-15*T;
|
||
|
$ 2000 N !
|
||
|
$PARAMETER N(BCC_A2,MN:VA;0) 298.15 5.0; 2000 N !
|
||
|
|
||
|
PARAMETER G(LIQUID,MN;0) 298.15
|
||
|
9744.63+117.4382*T-23.4582*T*LN(T)-7.34768E-3*T**2+69827*T**(-1)
|
||
|
-441.929E-23*T**7; 1519.00 Y
|
||
|
-9993.9+299.036*T-48*T*LN(T); 2000.00 N !
|
||
|
$PARAMETER V0(LIQUID,MN;0) 298.15 8.176651E-06; 2000 N !
|
||
|
$PARAMETER ALPHA(LIQUID,MN;0) 298.15 87.10223E-06;
|
||
|
$ 2000 N !
|
||
|
$PARAMETER KAPPA(LIQUID,MN;0) 298.15 5.24E-12+1.99523E-15*T;
|
||
|
$ 2000 N !
|
||
|
$PARAMETER N(LIQUID,MN;0) 298.15 5.0; 2000 N !
|
||
|
|
||
|
PARAMETER G(HCP_A3,MN:VA;0) 298.15
|
||
|
-4439.3+133.007*T-24.5177*T*LN(T)-6E-3*T**2+69600*T**(-1); 1519.00 Y
|
||
|
-27070.1+310.7894*T-48*T*LN(T)+386.196E28*T**(-9); 2000.00 N !
|
||
|
PARAMETER TC(HCP_A3,MN:VA;0) 298.15 -1620.00; 2000.00 N !
|
||
|
PARAMETER BM(HCP_A3,MN:VA;0) 298.15 -1.86; 2000.00 N !
|
||
|
$PARAMETER V0(HCP_A3,MN:VA;0) 298.15 7.201547E-06; 2000 N !
|
||
|
$PARAMETER ALPHA(HCP_A3,MN:VA;0) 298.15 128.1572E-06+1.199968E-8*T;
|
||
|
$ 2000 N !
|
||
|
$PARAMETER KAPPA(HCP_A3,MN:VA;0) 298.15 5.24E-12+1.99523E-15*T;
|
||
|
$ 2000 N !
|
||
|
$PARAMETER N(HCP_A3,MN:VA;0) 298.15 5.0; 2000 N !
|
||
|
|
||
|
$ -------------------------------------
|
||
|
|
||
|
$ Mo
|
||
|
$ -------------------------------------
|
||
|
PARAMETER G(BCC_A2,MO:VA;0) 298.15
|
||
|
-7746.302+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
|
||
|
-30556.41+283.559746*T-42.63829*T*LN(T)-4849.315E30*T**(-9); 5000.00 N !
|
||
|
|
||
|
PARAMETER G(LIQUID,MO;0) 298.15
|
||
|
34085.045+117.224788*T-23.56414*T*LN(T)-3.443396E-3*T**2+0.566283E-6*T**3
|
||
|
+65812*T**(-1)-0.130927E-9*T**4+424.519E-24*T**7; 2896.00 Y
|
||
|
3538.963+271.6697*T-42.63829*T*LN(T); 5000.00 N !
|
||
|
|
||
|
PARAMETER G(FCC_A1,MO:VA;0) 298.15
|
||
|
7453.698+132.5497*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
|
||
|
-15356.41+284.189746*T-42.63829*T*LN(T)-4849.315E30*T**(-9); 5000.00 N !
|
||
|
|
||
|
PARAMETER G(HCP_A3,MO:VA;0) 298.15
|
||
|
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 !
|
||
|
$ -------------------------------------
|
||
|
|
||
|
$ N
|
||
|
$ -------------------------------------
|
||
|
$ DATA FOR 1/2N2<GAS>
|
||
|
FUNCTION GHSERNN 298.15
|
||
|
-3750.675-9.45425*T-12.7819*T*LN(T)-1.76686E-3*T**2+0.002681E-6*T**3
|
||
|
-32374*T**(-1); 950.00 Y
|
||
|
-7358.85+17.2003*T-16.3699*T*LN(T)-0.65107E-3*T**2+0.030097E-6*T**3
|
||
|
+563070*T**(-1); 3350.00 Y
|
||
|
-16392.8+50.26*T-20.4695*T*LN(T)+0.239754E-3*T**2-0.008333E-6*T**3
|
||
|
+4596375*T**(-1); 6000.00 N !
|
||
|
|
||
|
PARAMETER G(GAS,N2;0) 298.15 2*GHSERNN; 6000 N !
|
||
|
|
||
|
PARAMETER G(LIQUID,N;0) 298.15
|
||
|
26199.325+49.56575*T-12.7819*T*LN(T)-1.76686E-3*T**2+0.002681E-6*T**3
|
||
|
-32374*T**(-1); 950.00 Y
|
||
|
22591.15+76.2203*T-16.3699*T*LN(T)-0.65107E-3*T**2+0.030097E-6*T**3
|
||
|
+563070*T**(-1); 3350.00 Y
|
||
|
13557.2+109.28*T-20.4695*T*LN(T)+0.239754E-3*T**2-0.008333E-6*T**3
|
||
|
+4596375*T**(-1); 6000.00 N !
|
||
|
$ -------------------------------------
|
||
|
|
||
|
$ Na
|
||
|
$ -------------------------------------
|
||
|
PARAMETER G(BCC_A2,NA:VA;0) 200.00
|
||
|
-11989.434+260.548732*T-51.0393608*T*LN(T)+72.306633E-3*T**2
|
||
|
-43.638283E-6*T**3+132154*T**(-1); 370.87 Y
|
||
|
-11009.884+199.619999*T-38.1198801*T*LN(T)+9.745854E-3*T**2-1.70664E-6*T**3
|
||
|
+34342*T**(-1)+165.071E21*T**(-9); 2300.00 N !
|
||
|
|
||
|
PARAMETER G(LIQUID,NA;0) 200.00
|
||
|
-9408.414+253.596552*T-51.0393608*T*LN(T)+72.306633E-3*T**2-43.638283E-6*T**3
|
||
|
+132154*T**(-1)-276.132E-20*T**7; 370.87 Y
|
||
|
-8400.44+192.587343*T-38.1198801*T*LN(T)+9.745854E-3*T**2-1.70664E-6*T**3
|
||
|
+34342*T**(-1); 2300.00 N !
|
||
|
|
||
|
PARAMETER G(HCP_A3,NA:VA;0) 200.00
|
||
|
-12093.434+262.548732*T-51.0393608*T*LN(T)+72.306633E-3*T**2
|
||
|
-43.638283E-6*T**3+132154*T**(-1); 370.87 Y
|
||
|
-11113.884+201.619999*T-38.1198801*T*LN(T)+9.745854E-3*T**2-1.70664E-6*T**3
|
||
|
+34342*T**(-1)+165.071E21*T**(-9); 2300.00 N !
|
||
|
|
||
|
PARAMETER G(FCC_A1,NA:VA;0) 200.00
|
||
|
-12039.434+261.848732*T-51.0393608*T*LN(T)+72.306633E-3*T**2
|
||
|
-43.638283E-6*T**3+132154*T**(-1); 370.87 Y
|
||
|
-11059.884+200.919999*T-38.1198801*T*LN(T)+9.745854E-3*T**2-1.70664E-6*T**3
|
||
|
+34342*T**(-1)+165.071E21*T**(-9); 2300.00 N !
|
||
|
$ -------------------------------------
|
||
|
|
||
|
$ Nb
|
||
|
$ -------------------------------------
|
||
|
PARAMETER G(BCC_A2,NB:VA;0) 298.15
|
||
|
-8519.353+142.045475*T-26.4711*T*LN(T)+0.203475E-3*T**2-0.35012E-6*T**3
|
||
|
+93399*T**(-1); 2750.00 Y
|
||
|
-37669.3+271.720843*T-41.77*T*LN(T)+1528.238E29*T**(-9); 6000.00 N !
|
||
|
|
||
|
PARAMETER G(LIQUID,NB;0) 298.15
|
||
|
21262.202+131.229057*T-26.4711*T*LN(T)+0.203475E-3*T**2-0.35012E-6*T**3
|
||
|
+93399*T**(-1)-306.098E-25*T**7; 2750.00 Y
|
||
|
-7499.398+260.756148*T-41.77*T*LN(T); 6000.00 N !
|
||
|
|
||
|
PARAMETER G(FCC_A1,NB:VA;0) 298.15
|
||
|
4980.647+143.745475*T-26.4711*T*LN(T)+0.203475E-3*T**2-0.35012E-6*T**3
|
||
|
+93399*T**(-1); 2750.00 Y
|
||
|
-24169.3+273.420843*T-41.77*T*LN(T)+1528.238E29*T**(-9); 6000.00 N !
|
||
|
|
||
|
PARAMETER G(HCP_A3,NB:VA;0) 298.15
|
||
|
1480.647+144.445475*T-26.4711*T*LN(T)+0.203475E-3*T**2-0.35012E-6*T**3
|
||
|
+93399*T**(-1); 2750.00 Y
|
||
|
-27669.3+274.120843*T-41.77*T*LN(T)+1528.238E29*T**(-9); 6000.00 N !
|
||
|
$ -------------------------------------
|
||
|
|
||
|
$ Nd
|
||
|
$ -------------------------------------
|
||
|
PARAMETER G(DHCP,ND;0) 298.15
|
||
|
-8402.93+111.10239*T-27.0858*T*LN(T)+0.556125E-3*T**2-2.6923E-6*T**3
|
||
|
+34887*T**(-1); 900.00 Y
|
||
|
-6984.083+83.662617*T-22.7536*T*LN(T)-4.20402E-3*T**2-1.802E-6*T**3; 1128.00 Y
|
||
|
-225610.846+1673.040749*T-238.1828733*T*LN(T)+78.615997E-3*T**2
|
||
|
-6.048207E-6*T**3+38810350*T**(-1); 1799.00 Y
|
||
|
-25742.331+276.257088*T-48.7854*T*LN(T); 1800.00 N !
|
||
|
|
||
|
PARAMETER G(BCC_A2,ND:VA;0) 298.15
|
||
|
-6965.635+110.556109*T-27.0858*T*LN(T)+0.556125E-3*T**2-2.6923E-6*T**3
|
||
|
+34887*T**(-1); 400.00 Y
|
||
|
7312.2-153.033976*T+14.9956777*T*LN(T)-50.479E-3*T**2+7.287217E-6*T**3
|
||
|
-831810*T**(-1); 1128.00 Y
|
||
|
-18030.266+239.677322*T-44.5596*T*LN(T); 1289.00 Y
|
||
|
334513.017-2363.919899*T+311.409193*T*LN(T)-156.030778E-3*T**2
|
||
|
+12.408421E-6*T**3-64319604*T**(-1); 1800.00 N !
|
||
|
|
||
|
PARAMETER G(LIQUID,ND;0) 298.15
|
||
|
-3351.187+109.517314*T-27.0858*T*LN(T)+0.556125E-3*T**2-2.6923E-6*T**3
|
||
|
+34887*T**(-1); 300.00 Y
|
||
|
5350.01-86.593963*T+5.357301*T*LN(T)-46.955463E-3*T**2+6.860782E-6*T**3
|
||
|
-374380*T**(-1); 1128.00 Y
|
||
|
-16335.232+268.625903*T-48.7854*T*LN(T); 1800.00 N !
|
||
|
|
||
|
$ From COST507 database
|
||
|
PARAMETER G(FCC_A1,ND:VA;0) 298.15
|
||
|
-7902.93+111.10239*T-27.0858*T*LN(T)+0.556125E-3*T**2-2.6923E-6*T**3
|
||
|
+34887*T**(-1); 900.00 Y
|
||
|
-6484.083+83.662617*T-22.7536*T*LN(T)-4.20402E-3*T**2-1.802E-6*T**3; 1128.00 Y
|
||
|
-225110.846+1673.04075*T-238.182873*T*LN(T)+78.615997E-3*T**2-6.048207E-6*T**3
|
||
|
+38810350*T**(-1); 1799.00 Y
|
||
|
-25242.331+276.257088*T-48.7854*T*LN(T); 1800.00 N !
|
||
|
|
||
|
$ From Susanne Norgren, Thesis, KTH 2000
|
||
|
PARAMETER G(HCP_A3,ND:VA;0) 298.15
|
||
|
-6902.93+110.6866645*T-27.0858*T*LN(T)+0.556125E-3*T**2-2.6923E-6*T**3
|
||
|
+34887*T**(-1); 900.00 Y
|
||
|
-5484.083+83.2468915*T-22.7536*T*LN(T)-4.20402E-3*T**2-1.802E-6*T**3; 1128.00 Y
|
||
|
-224110.846+1672.625024*T-238.1828733*T*LN(T)+78.615997E-3*T**2
|
||
|
-6.048207E-6*T**3+38810350*T**(-1); 1799.00 Y
|
||
|
-24242.331+275.8413625*T-48.7854*T*LN(T); 1800.00 N !
|
||
|
$ -------------------------------------
|
||
|
|
||
|
$ Ni
|
||
|
$ -------------------------------------
|
||
|
PARAMETER G(FCC_A1,NI:VA;0) 298.15
|
||
|
-5179.159+117.854*T-22.096*T*LN(T)-4.8407E-3*T**2; 1728.00 Y
|
||
|
-27840.655+279.135*T-43.1*T*LN(T)+1127.54E28*T**(-9); 3000.00 N !
|
||
|
PARAMETER TC(FCC_A1,NI:VA;0) 298.15 633.00; 3000.00 N !
|
||
|
PARAMETER BM(FCC_A1,NI:VA;0) 298.15 0.52; 3000.00 N !
|
||
|
|
||
|
PARAMETER G(LIQUID,NI;0) 298.15
|
||
|
11235.527+108.457*T-22.096*T*LN(T)-4.8407E-3*T**2-382.318E-23*T**7; 1728.00 Y
|
||
|
-9549.775+268.598*T-43.1*T*LN(T); 3000.00 N !
|
||
|
|
||
|
PARAMETER G(BCC_A2,NI:VA;0) 298.15
|
||
|
3535.925+114.298*T-22.096*T*LN(T)-4.8407E-3*T**2; 1728.00 Y
|
||
|
-19125.571+275.579*T-43.1*T*LN(T)+1127.54E28*T**(-9); 3000.00 N !
|
||
|
PARAMETER TC(BCC_A2,NI:VA;0) 298.15 575.00; 3000.00 N !
|
||
|
PARAMETER BM(BCC_A2,NI:VA;0) 298.15 0.85; 3000.00 N !
|
||
|
|
||
|
PARAMETER G(HCP_A3,NI:VA;0) 298.15
|
||
|
-4133.159+119.109*T-22.096*T*LN(T)-4.8407E-3*T**2; 1728.00 Y
|
||
|
-26794.655+280.39*T-43.1*T*LN(T)+1127.54E28*T**(-9); 3000.00 N !
|
||
|
|
||
|
PARAMETER G(CUB_A13,NI:VA;0) 298.15
|
||
|
-3087.159+117.854*T-22.096*T*LN(T)-4.8407E-3*T**2; 1728.00 Y
|
||
|
-25748.655+279.135*T-43.1*T*LN(T)+1127.54E28*T**(-9); 3000.00 N !
|
||
|
|
||
|
PARAMETER G(CBCC_A12,NI:VA;0) 298.15
|
||
|
-1623.159+117.854*T-22.096*T*LN(T)-4.8407E-3*T**2; 1728.00 Y
|
||
|
-24284.655+279.135*T-43.1*T*LN(T)+1127.54E28*T**(-9); 3000.00 N !
|
||
|
$ -------------------------------------
|
||
|
|
||
|
$ Np
|
||
|
$ -------------------------------------
|
||
|
PARAMETER G(ORTHO_AC,NP;0) 298.15
|
||
|
241.888-57.531347*T+4.0543*T*LN(T)-41.27725E-3*T**2-402857*T**(-1); 553.00 Y
|
||
|
-57015.112+664.27337*T-102.523*T*LN(T)+28.4592E-3*T**2-2.483917E-6*T**3
|
||
|
+4796910*T**(-1); 1799.00 Y
|
||
|
-12092.736+255.780866*T-45.3964*T*LN(T); 4000.00 N !
|
||
|
|
||
|
PARAMETER G(TETRAG_AD,NP;0) 298.15
|
||
|
-10157.32+183.829213*T-34.11*T*LN(T)-16.1186E-3*T**2+4.98465E-6*T**3
|
||
|
+532825*T**(-1); 555.00 Y
|
||
|
-7873.688+207.01896*T-39.33*T*LN(T); 856.00 Y
|
||
|
19027.98-46.64846*T-3.4265*T*LN(T)-19.21045E-3*T**2+1.52726E-6*T**3
|
||
|
-3564640*T**(-1); 1999.00 Y
|
||
|
-16070.82+256.707037*T-45.3964*T*LN(T); 4000.00 N !
|
||
|
|
||
|
PARAMETER G(BCC_A2,NP:VA;0) 298.15
|
||
|
-3224.664+174.911817*T-35.177*T*LN(T)-2.51865E-3*T**2+0.514743E-6*T**3
|
||
|
+302225*T**(-1); 856.00 Y
|
||
|
-2366.486+180.807719*T-36.401*T*LN(T); 917.00 Y
|
||
|
50882.281-297.324358*T+30.7734*T*LN(T)-34.3483E-3*T**2+2.707217E-6*T**3
|
||
|
-7500100*T**(-1); 1999.00 Y
|
||
|
-14879.686+254.773087*T-45.3964*T*LN(T); 4000.00 N !
|
||
|
|
||
|
PARAMETER G(LIQUID,NP;0) 298.15
|
||
|
-4627.18+160.024959*T-31.229*T*LN(T)-16.3885E-3*T**2+2.941883E-6*T**3
|
||
|
+439915*T**(-1); 917.00 Y
|
||
|
-7415.255+247.671446*T-45.3964*T*LN(T); 4000.00 N !
|
||
|
$ -------------------------------------
|
||
|
|
||
|
$ O
|
||
|
$ -------------------------------------
|
||
|
$ DATA FOR 1/2O2<GAS>
|
||
|
$ Changed for version 3.00: addition of significant figures
|
||
|
FUNCTION GHSEROO 298.15
|
||
|
-3480.87-25.503038*T-11.1355*T*LN(T)-5.098875E-3*T**2+0.661845833E-6*T**3
|
||
|
-38365*T**(-1); 1000.00 Y
|
||
|
-6568.763+12.659879*T-16.8138*T*LN(T)-0.5957975E-3*T**2+0.006781E-6*T**3
|
||
|
+262905*T**(-1); 3300.00 Y
|
||
|
-13986.728+31.259624*T-18.9536*T*LN(T)-0.425243E-3*T**2+0.010721E-6*T**3
|
||
|
+4383200*T**(-1); 6000.00 N !
|
||
|
|
||
|
PARAMETER G(GAS,O2;0) 298.15 2*GHSEROO; 6000 N !
|
||
|
|
||
|
$ Changed for version 3.00: addition of significant figures
|
||
|
PARAMETER G(LIQUID,O;0) 298.15
|
||
|
-6129.77+5.936962*T-11.1355*T*LN(T)-5.098875E-3*T**2+0.661845833E-6*T**3
|
||
|
-38365*T**(-1); 1000.00 Y
|
||
|
-9217.663+44.099879*T-16.8138*T*LN(T)-0.5957975E-3*T**2+0.006781E-6*T**3
|
||
|
+262905*T**(-1); 3300.00 Y
|
||
|
-16635.628+62.699624*T-18.9536*T*LN(T)-0.425243E-3*T**2+0.010721E-6*T**3
|
||
|
+4383200*T**(-1); 6000.00 N !
|
||
|
|
||
|
$ Changed for version 3.00: addition of significant figures
|
||
|
PARAMETER G(BCC_A2,O:VA;0) 298.15
|
||
|
26519.13-25.503038*T-11.1355*T*LN(T)-5.098875E-3*T**2+0.661845833E-6*T**3
|
||
|
-38365*T**(-1); 1000.00 Y
|
||
|
23431.237+12.659879*T-16.8138*T*LN(T)-0.5957975E-3*T**2+0.006781E-6*T**3
|
||
|
+262905*T**(-1); 3300.00 Y
|
||
|
16013.272+31.259624*T-18.9536*T*LN(T)-0.425243E-3*T**2+0.010721E-6*T**3
|
||
|
+4383200*T**(-1); 6000.00 N !
|
||
|
|
||
|
$ Changed for version 3.00: addition of significant figures
|
||
|
PARAMETER G(FCC_A1,O:VA;0) 298.15
|
||
|
26519.13-25.503038*T-11.1355*T*LN(T)-5.098875E-3*T**2+0.661845833E-6*T**3
|
||
|
-38365*T**(-1); 1000.00 Y
|
||
|
23431.237+12.659879*T-16.8138*T*LN(T)-0.5957975E-3*T**2+0.006781E-6*T**3
|
||
|
+262905*T**(-1); 3300.00 Y
|
||
|
16013.272+31.259624*T-18.9536*T*LN(T)-0.425243E-3*T**2+0.010721E-6*T**3
|
||
|
+4383200*T**(-1); 6000.00 N !
|
||
|
$ -------------------------------------
|
||
|
|
||
|
$ Os
|
||
|
$ -------------------------------------
|
||
|
PARAMETER G(HCP_A3,OS:VA;0) 298.15
|
||
|
-7196.978+126.369531*T-23.5710242*T*LN(T)-1.90427E-3*T**2; 3306.00 Y
|
||
|
644910.07-1935.213696*T+224.9980343*T*LN(T)-42.489827E-3*T**2+1.173861E-6*T**3
|
||
|
-312569031*T**(-1); 5500.00 N !
|
||
|
|
||
|
PARAMETER G(LIQUID,OS;0) 298.15
|
||
|
29263.192+117.895788*T-23.5710242*T*LN(T)-1.90427E-3*T**2; 1000.00 Y
|
||
|
68715.318-198.324341*T+19.9382156*T*LN(T)-20.464464E-3*T**2+1.014279E-6*T**3
|
||
|
-6237261*T**(-1); 3306.00 Y
|
||
|
-15903.192+336.874526*T-50*T*LN(T); 5500.00 N !
|
||
|
|
||
|
PARAMETER G(FCC_A1,OS:VA;0) 298.15
|
||
|
5803.022+123.869531*T-23.5710242*T*LN(T)-1.90427E-3*T**2; 3306.00 Y
|
||
|
657910.07-1937.713696*T+224.9980343*T*LN(T)-42.489827E-3*T**2+1.173861E-6*T**3
|
||
|
-312569031*T**(-1); 5500.00 N !
|
||
|
|
||
|
$ BCC parameter changed 22/5/2000 to make mpt of bcc about 2000 K
|
||
|
$ PARAMETER G(BCC_A2,OS:VA;0) 298.15 GHSEROS+27500-4.4*T; 5500 N !
|
||
|
PARAMETER G(BCC_A2,OS:VA;0) 298.15
|
||
|
20303.022+121.969531*T-23.5710242*T*LN(T)-1.90427E-3*T**2; 3306.00 Y
|
||
|
672410.07-1939.613696*T+224.9980343*T*LN(T)-42.489827E-3*T**2+1.173861E-6*T**3
|
||
|
-312569031*T**(-1); 5500.00 N !
|
||
|
|
||
|
$ -------------------------------------
|
||
|
|
||
|
$ P
|
||
|
$ -------------------------------------
|
||
|
PARAMETER G(WHITE_P,P;0) 250.00
|
||
|
-43821.799+1026.693886*T-178.426*T*LN(T)+290.708E-3*T**2-104.022667E-6*T**3
|
||
|
+1632695*T**(-1); 317.30 Y
|
||
|
-9587.448+152.341487*T-28.7335301*T*LN(T)+1.715669E-3*T**2-0.22829E-6*T**3
|
||
|
+172966*T**(-1); 1000.00 Y
|
||
|
-8093.075+135.876831*T-26.326*T*LN(T); 3000.00 N !
|
||
|
|
||
|
PARAMETER G(LIQUID,P;0) 250.00
|
||
|
-26316.111+434.930931*T-70.7440584*T*LN(T)-2.898936E-3*T**2+39.049371E-6*T**3
|
||
|
+1141147*T**(-1); 317.30 Y
|
||
|
-7232.449+133.291873*T-26.326*T*LN(T); 3000.00 N !
|
||
|
|
||
|
PARAMETER G(RED_P,P;0) 250.00
|
||
|
-25976.559+148.672002*T-25.55*T*LN(T)+3.4121E-3*T**2-2.418867E-6*T**3
|
||
|
+160095*T**(-1); 500.00 Y
|
||
|
-21723.721+77.671737*T-14.368*T*LN(T)-9.57685E-3*T**2+0.393917E-6*T**3
|
||
|
-141375*T**(-1); 852.35 Y
|
||
|
-119408.413+1026.02962*T-149.4495562*T*LN(T)+67.272364E-3*T**2
|
||
|
-6.651929E-6*T**3+12495943*T**(-1); 1500.00 Y
|
||
|
-24524.119+153.839181*T-26.326*T*LN(T); 3000.00 N !
|
||
|
|
||
|
PARAMETER G(BCC_A2,P:VA;0) 250.00
|
||
|
18792.241+135.412002*T-25.55*T*LN(T)+3.4121E-3*T**2-2.418867E-6*T**3
|
||
|
+160095*T**(-1); 500.00 Y
|
||
|
23045.079+64.411737*T-14.368*T*LN(T)-9.57685E-3*T**2+0.393917E-6*T**3
|
||
|
-141375*T**(-1); 852.35 Y
|
||
|
-74639.613+1012.76962*T-149.4495562*T*LN(T)+67.272364E-3*T**2
|
||
|
-6.651929E-6*T**3+12495943*T**(-1); 1500.00 Y
|
||
|
20244.681+140.579181*T-26.326*T*LN(T); 3000.00 N !
|
||
|
|
||
|
PARAMETER G(FCC_A1,P:VA;0) 250.00
|
||
|
10842.441+135.534002*T-25.55*T*LN(T)+3.4121E-3*T**2-2.418867E-6*T**3
|
||
|
+160095*T**(-1); 500.00 Y
|
||
|
15095.279+64.533737*T-14.368*T*LN(T)-9.57685E-3*T**2+0.393917E-6*T**3
|
||
|
-141375*T**(-1); 852.35 Y
|
||
|
-82589.413+1012.89162*T-149.4495562*T*LN(T)+67.272364E-3*T**2
|
||
|
-6.651929E-6*T**3+12495943*T**(-1); 1500.00 Y
|
||
|
12294.881+140.701181*T-26.326*T*LN(T); 3000.00 N !
|
||
|
|
||
|
PARAMETER G(RHOMBOHEDRAL_A7,P;0) 250.00
|
||
|
-44009.799+1026.819156*T-178.426*T*LN(T)+290.708E-3*T**2-104.022667E-6*T**3
|
||
|
+1632695*T**(-1); 317.30 Y
|
||
|
-9775.448+152.466757*T-28.7335301*T*LN(T)+1.715669E-3*T**2-0.22829E-6*T**3
|
||
|
+172966*T**(-1); 1000.00 Y
|
||
|
-8281.075+136.002101*T-26.326*T*LN(T); 3000.00 N !
|
||
|
|
||
|
$ -------------------------------------
|
||
|
|
||
|
$ Pa
|
||
|
$ -------------------------------------
|
||
|
PARAMETER G(BCT_AA,PA;0) 298.15
|
||
|
-7681.561+111.973215*T-23.9116*T*LN(T)-6.21325E-3*T**2; 1443.00 Y
|
||
|
27955.763-177.320253*T+16.305*T*LN(T)-26.3416E-3*T**2+1.884933E-6*T**3
|
||
|
-5908900*T**(-1); 2176.00 Y
|
||
|
-29949.683+288.308639*T-47.2792*T*LN(T); 4000.00 N !
|
||
|
|
||
|
PARAMETER G(BCC_A2,PA:VA;0) 298.15
|
||
|
781.847+71.957409*T-18.203*T*LN(T)-13.22095E-3*T**2+1.337387E-6*T**3
|
||
|
-101600*T**(-1); 1443.00 Y
|
||
|
-10955.948+220.478519*T-39.748*T*LN(T); 1845.00 Y
|
||
|
284495.194-1397.150521*T+171.108*T*LN(T)-63.7105E-3*T**2+3.343867E-6*T**3
|
||
|
-74992000*T**(-1); 2710.00 Y
|
||
|
-27885.171+286.096187*T-47.2792*T*LN(T); 4000.00 N !
|
||
|
|
||
|
PARAMETER G(LIQUID,PA;0) 298.15
|
||
|
8499.539+102.429215*T-23.9116*T*LN(T)-6.21325E-3*T**2; 1088.00 Y
|
||
|
48013.96-278.789916*T+30.336*T*LN(T)-37.2478E-3*T**2+3.075017E-6*T**3
|
||
|
-5064250*T**(-1); 1845.00 Y
|
||
|
-12508.174+277.955437*T-47.2792*T*LN(T); 4000.00 N !
|
||
|
$ -------------------------------------
|
||
|
|
||
|
$ Pb
|
||
|
$ -------------------------------------
|
||
|
PARAMETER G(FCC_A1,PB:VA;0) 298.15
|
||
|
-7650.085+101.700244*T-24.5242231*T*LN(T)-3.65895E-3*T**2-0.24395E-6*T**3;
|
||
|
600.61 Y
|
||
|
-10531.095+154.243182*T-32.4913959*T*LN(T)+1.54613E-3*T**2+805.448E23*T**(-9);
|
||
|
1200.00 Y
|
||
|
4157.616+53.139072*T-18.9640637*T*LN(T)-2.882943E-3*T**2+0.098144E-6*T**3
|
||
|
-2696755*T**(-1)+805.448E23*T**(-9); 2100.00 N !
|
||
|
|
||
|
PARAMETER G(LIQUID,PB;0) 298.15
|
||
|
-2977.961+93.949561*T-24.5242231*T*LN(T)-3.65895E-3*T**2-0.24395E-6*T**3
|
||
|
-60.19E-20*T**7; 600.61 Y
|
||
|
-5677.958+146.176046*T-32.4913959*T*LN(T)+1.54613E-3*T**2; 1200.00 Y
|
||
|
9010.753+45.071937*T-18.9640637*T*LN(T)-2.882943E-3*T**2+0.098144E-6*T**3
|
||
|
-2696755*T**(-1); 2100.00 N !
|
||
|
|
||
|
PARAMETER G(BCT_A5,PB;0) 298.15
|
||
|
-7161.085+105.220244*T-24.5242231*T*LN(T)-3.65895E-3*T**2-0.24395E-6*T**3;
|
||
|
600.61 Y
|
||
|
-10042.095+157.763182*T-32.4913959*T*LN(T)+1.54613E-3*T**2+805.448E23*T**(-9);
|
||
|
1200.00 Y
|
||
|
4646.616+56.659072*T-18.9640637*T*LN(T)-2.882943E-3*T**2+0.098144E-6*T**3
|
||
|
-2696755*T**(-1)+805.448E23*T**(-9); 2100.00 N !
|
||
|
|
||
|
PARAMETER G(HCP_A3,PB:VA;0) 298.15
|
||
|
-7350.085+102.700244*T-24.5242231*T*LN(T)-3.65895E-3*T**2-0.24395E-6*T**3;
|
||
|
600.61 Y
|
||
|
-10231.095+155.243182*T-32.4913959*T*LN(T)+1.54613E-3*T**2+805.448E23*T**(-9);
|
||
|
1200.00 Y
|
||
|
4457.616+54.139072*T-18.9640637*T*LN(T)-2.882943E-3*T**2+0.098144E-6*T**3
|
||
|
-2696755*T**(-1)+805.448E23*T**(-9); 2100.00 N !
|
||
|
|
||
|
PARAMETER G(BCC_A2,PB:VA;0) 298.15
|
||
|
-5250.085+100.600244*T-24.5242231*T*LN(T)-3.65895E-3*T**2-0.24395E-6*T**3;
|
||
|
600.61 Y
|
||
|
-8131.095+153.143182*T-32.4913959*T*LN(T)+1.54613E-3*T**2+805.448E23*T**(-9);
|
||
|
1200.00 Y
|
||
|
6557.616+52.039072*T-18.9640637*T*LN(T)-2.882943E-3*T**2+0.098144E-6*T**3
|
||
|
-2696755*T**(-1)+805.448E23*T**(-9); 2100.00 N !
|
||
|
|
||
|
$ Data from Boa and Ansara; Thermochimica Acta 1998, 314, 79-86
|
||
|
PARAMETER G(TET_ALPHA1,PB;0) 298.15
|
||
|
-5746.785+99.640044*T-24.5242231*T*LN(T)-3.65895E-3*T**2-0.24395E-6*T**3;
|
||
|
600.61 Y
|
||
|
-8627.795+152.182982*T-32.4913959*T*LN(T)+1.54613E-3*T**2+805.448E23*T**(-9);
|
||
|
1200.00 Y
|
||
|
6060.916+51.078872*T-18.9640637*T*LN(T)-2.882943E-3*T**2+0.098144E-6*T**3
|
||
|
-2696755*T**(-1)+805.448E23*T**(-9); 2100.00 N !
|
||
|
|
||
|
$ Data from Boa and Ansara; Thermochimica Acta 1998, 314, 79-86
|
||
|
PARAMETER G(RHOMBOHEDRAL_A7,PB;0) 298.15
|
||
|
-7350.085+102.700244*T-24.5242231*T*LN(T)-3.65895E-3*T**2-0.24395E-6*T**3;
|
||
|
600.61 Y
|
||
|
-10231.095+155.243182*T-32.4913959*T*LN(T)+1.54613E-3*T**2+805.448E23*T**(-9);
|
||
|
1200.00 Y
|
||
|
4457.616+54.139072*T-18.9640637*T*LN(T)-2.882943E-3*T**2+0.098144E-6*T**3
|
||
|
-2696755*T**(-1)+805.448E23*T**(-9); 2100.00 N !
|
||
|
|
||
|
$ Data from Boa and Ansara; Thermochimica Acta 1998, 314, 79-86
|
||
|
PARAMETER G(TETRAGONAL_A6,PB;0) 298.15
|
||
|
-3156.85+101.700244*T-24.5242231*T*LN(T)-3.65895E-3*T**2-0.24395E-6*T**3;
|
||
|
600.61 Y
|
||
|
-6037.86+154.243182*T-32.4913959*T*LN(T)+1.54613E-3*T**2+805.448E23*T**(-9);
|
||
|
1200.00 Y
|
||
|
8650.851+53.139072*T-18.9640637*T*LN(T)-2.882943E-3*T**2+0.098144E-6*T**3
|
||
|
-2696755*T**(-1)+805.448E23*T**(-9); 2100.00 N !
|
||
|
$ -------------------------------------
|
||
|
|
||
|
$ Pd
|
||
|
$ -------------------------------------
|
||
|
PARAMETER G(FCC_A1,PD:VA;0) 298.15
|
||
|
-10204.027+176.076315*T-32.211*T*LN(T)+7.120975E-3*T**2-1.919875E-6*T**3
|
||
|
+168687*T**(-1); 900.00 Y
|
||
|
917.062+49.659892*T-13.5708*T*LN(T)-7.17522E-3*T**2+0.191115E-6*T**3
|
||
|
-1112465*T**(-1); 1828.00 Y
|
||
|
-67161.018+370.102147*T-54.2067086*T*LN(T)+2.091396E-3*T**2-0.062811E-6*T**3
|
||
|
+18683526*T**(-1); 4000.00 N !
|
||
|
|
||
|
PARAMETER G(LIQUID,PD;0) 298.15
|
||
|
1302.731+170.964153*T-32.211*T*LN(T)+7.120975E-3*T**2-1.919875E-6*T**3
|
||
|
+168687*T**(-1); 600.00 Y
|
||
|
23405.778-116.918419*T+10.8922031*T*LN(T)-27.266568E-3*T**2+2.430675E-6*T**3
|
||
|
-1853674*T**(-1); 1828.00 Y
|
||
|
-12373.637+251.416903*T-41.17*T*LN(T); 4000.00 N !
|
||
|
|
||
|
PARAMETER G(BCC_A2,PD:VA;0) 298.15
|
||
|
295.973+174.276315*T-32.211*T*LN(T)+7.120975E-3*T**2-1.919875E-6*T**3
|
||
|
+168687*T**(-1); 900.00 Y
|
||
|
11417.062+47.859892*T-13.5708*T*LN(T)-7.17522E-3*T**2+0.191115E-6*T**3
|
||
|
-1112465*T**(-1); 1828.00 Y
|
||
|
-56661.018+368.302147*T-54.2067086*T*LN(T)+2.091396E-3*T**2-0.062811E-6*T**3
|
||
|
+18683526*T**(-1); 4000.00 N !
|
||
|
|
||
|
PARAMETER G(HCP_A3,PD:VA;0) 298.15
|
||
|
-8204.027+176.176315*T-32.211*T*LN(T)+7.120975E-3*T**2-1.919875E-6*T**3
|
||
|
+168687*T**(-1); 900.00 Y
|
||
|
2917.062+49.759892*T-13.5708*T*LN(T)-7.17522E-3*T**2+0.191115E-6*T**3
|
||
|
-1112465*T**(-1); 1828.00 Y
|
||
|
-65161.018+370.202147*T-54.2067086*T*LN(T)+2.091396E-3*T**2-0.062811E-6*T**3
|
||
|
+18683526*T**(-1); 4000.00 N !
|
||
|
$ -------------------------------------
|
||
|
|
||
|
$ Pr
|
||
|
$ -------------------------------------
|
||
|
PARAMETER G(DHCP,PR;0) 298.15
|
||
|
-18803.379+356.587384*T-68.9176*T*LN(T)+72.929E-3*T**2-25.184333E-6*T**3
|
||
|
+507385*T**(-1); 500.00 Y
|
||
|
-7246.848+82.427384*T-22.8909*T*LN(T)-4.97126E-3*T**2-1.22951E-6*T**3;
|
||
|
800.00 Y
|
||
|
95411.023-1073.551114*T+146.764*T*LN(T)-128.8205E-3*T**2+15.592233E-6*T**3
|
||
|
-11588800*T**(-1); 1068.00 Y
|
||
|
-481663.131+4234.333112*T-606.1203107*T*LN(T)+305.181506E-3*T**2
|
||
|
-30.994702E-6*T**3+70926840*T**(-1); 1204.00 Y
|
||
|
-20014.678+227.685155*T-42.9697*T*LN(T); 3800.00 N !
|
||
|
|
||
|
PARAMETER G(BCC_A2,PR:VA;0) 298.15
|
||
|
-2863.651+28.274853*T-13.7470527*T*LN(T)-22.84377E-3*T**2+3.542468E-6*T**3
|
||
|
-87486*T**(-1); 1068.00 Y
|
||
|
-11985.919+188.657121*T-38.451*T*LN(T); 1204.00 Y
|
||
|
953.224+100.826281*T-26.6824313*T*LN(T)-4.106833E-3*T**2+0.176214E-6*T**3
|
||
|
-2473024*T**(-1); 3800.00 N !
|
||
|
|
||
|
PARAMETER G(LIQUID,PR;0) 298.15
|
||
|
3848.961-29.099465*T-4.7344931*T*LN(T)-35.119723E-3*T**2+5.427467E-6*T**3
|
||
|
-207406*T**(-1); 1068.00 Y
|
||
|
-10539.574+219.508805*T-42.9697*T*LN(T); 3800.00 N !
|
||
|
$ -------------------------------------
|
||
|
|
||
|
$ Pt
|
||
|
$ -------------------------------------
|
||
|
PARAMETER G(FCC_A1,PT:VA;0) 298.15
|
||
|
-7595.631+124.388275*T-24.5526*T*LN(T)-2.48297E-3*T**2-0.020138E-6*T**3
|
||
|
+7974*T**(-1); 1300.00 Y
|
||
|
-9253.174+161.529615*T-30.2527*T*LN(T)+2.321665E-3*T**2-0.656946E-6*T**3
|
||
|
-272106*T**(-1); 2041.50 Y
|
||
|
-222048.216+1019.358919*T-136.192996*T*LN(T)+20.454938E-3*T**2
|
||
|
-0.759259E-6*T**3+71539020*T**(-1); 4000.00 N !
|
||
|
|
||
|
PARAMETER G(LIQUID,PT;0) 298.15
|
||
|
12518.385+115.113092*T-24.5526*T*LN(T)-2.48297E-3*T**2-0.020138E-6*T**3
|
||
|
+7974*T**(-1); 600.00 Y
|
||
|
19023.491+32.94182*T-12.3403769*T*LN(T)-11.551507E-3*T**2+0.931516E-6*T**3
|
||
|
-601426*T**(-1); 2041.50 Y
|
||
|
1404.468+205.858962*T-36.5*T*LN(T); 4000.00 N !
|
||
|
|
||
|
PARAMETER G(BCC_A2,PT:VA;0) 298.15
|
||
|
7404.369+121.988275*T-24.5526*T*LN(T)-2.48297E-3*T**2-0.020138E-6*T**3
|
||
|
+7974*T**(-1); 1300.00 Y
|
||
|
5746.826+159.129615*T-30.2527*T*LN(T)+2.321665E-3*T**2-0.656946E-6*T**3
|
||
|
-272106*T**(-1); 2041.50 Y
|
||
|
-207048.216+1016.958919*T-136.192996*T*LN(T)+20.454938E-3*T**2
|
||
|
-0.759259E-6*T**3+71539020*T**(-1); 4000.00 N !
|
||
|
|
||
|
PARAMETER G(HCP_A3,PT:VA;0) 298.15
|
||
|
-5095.631+124.488275*T-24.5526*T*LN(T)-2.48297E-3*T**2-0.020138E-6*T**3
|
||
|
+7974*T**(-1); 1300.00 Y
|
||
|
-6753.174+161.629615*T-30.2527*T*LN(T)+2.321665E-3*T**2-0.656946E-6*T**3
|
||
|
-272106*T**(-1); 2041.50 Y
|
||
|
-219548.216+1019.458919*T-136.192996*T*LN(T)+20.454938E-3*T**2
|
||
|
-0.759259E-6*T**3+71539020*T**(-1); 4000.00 N !
|
||
|
$ -------------------------------------
|
||
|
|
||
|
$ Pu
|
||
|
$ -------------------------------------
|
||
|
PARAMETER G(ALPHA_PU,PU;0) 298.15
|
||
|
-7396.309+80.301382*T-18.1258*T*LN(T)-22.41E-3*T**2; 400.00 Y
|
||
|
-16605.962+236.786603*T-42.4187*T*LN(T)-1.34493E-3*T**2+0.263443E-6*T**3
|
||
|
+579325*T**(-1); 944.00 Y
|
||
|
-14462.156+232.961553*T-42.248*T*LN(T); 3000.00 N !
|
||
|
|
||
|
PARAMETER G(BCC_A2,PU:VA;0) 298.15
|
||
|
-1358.984+116.603882*T-27.094*T*LN(T)-9.105E-3*T**2+2.061667E-6*T**3
|
||
|
+20863*T**(-1); 745.00 Y
|
||
|
-2890.817+156.878957*T-33.72*T*LN(T); 956.00 Y
|
||
|
29313.619-132.788248*T+6.921*T*LN(T)-20.23305E-3*T**2+1.426922E-6*T**3
|
||
|
-4469245*T**(-1); 2071.00 Y
|
||
|
-15400.585+227.421855*T-42.248*T*LN(T); 3000.00 N !
|
||
|
|
||
|
PARAMETER G(BETA_PU,PU;0) 298.15
|
||
|
-4873.654+123.249151*T-27.416*T*LN(T)-6.53E-3*T**2; 679.50 Y
|
||
|
2435.094+43.566585*T-15.7351*T*LN(T)-15.4772E-3*T**2+1.524942E-6*T**3
|
||
|
-864940*T**(-1); 1464.00 Y
|
||
|
-13959.062+228.221615*T-42.248*T*LN(T); 3000.00 N !
|
||
|
|
||
|
PARAMETER G(FCC_A1,PU:VA;0) 298.15
|
||
|
-3920.781+127.586536*T-28.4781*T*LN(T)-5.4035E-3*T**2; 990.00 Y
|
||
|
3528.208+41.52572*T-15.7351*T*LN(T)-15.4772E-3*T**2+1.524942E-6*T**3
|
||
|
-864940*T**(-1); 1464.00 Y
|
||
|
-12865.948+226.18075*T-42.248*T*LN(T); 3000.00 N !
|
||
|
|
||
|
PARAMETER G(GAMMA_PU,PU;0) 298.15
|
||
|
-16766.303+419.402655*T-77.5802*T*LN(T)+81.6415E-3*T**2-28.103833E-6*T**3
|
||
|
+574825*T**(-1); 487.90 Y
|
||
|
-2942.77+88.325069*T-22.0233*T*LN(T)-11.4795E-3*T**2; 593.90 Y
|
||
|
-9336.967+160.314641*T-32.3405*T*LN(T)-7.0383E-3*T**2+0.692887E-6*T**3
|
||
|
+630600*T**(-1); 1179.00 Y
|
||
|
-12435.75+226.131617*T-42.248*T*LN(T); 3000.00 N !
|
||
|
|
||
|
PARAMETER G(LIQUID,PU;0) 298.15
|
||
|
-788.209+67.788082*T-18.1258*T*LN(T)-22.41E-3*T**2; 400.00 Y
|
||
|
-9997.862+224.273303*T-42.4187*T*LN(T)-1.34493E-3*T**2+0.263443E-6*T**3
|
||
|
+579325*T**(-1); 944.00 Y
|
||
|
-7854.056+220.448253*T-42.248*T*LN(T); 3000.00 N !
|
||
|
|
||
|
PARAMETER G(TETRAGONAL_A6,PU;0) 298.15
|
||
|
-496.178+54.586547*T-16.43*T*LN(T)-24.006E-3*T**2+5.166667E-6*T**3
|
||
|
-158470*T**(-1); 736.00 Y
|
||
|
-6122.307+173.35008*T-35.56*T*LN(T); 757.00 Y
|
||
|
3982.078+63.890352*T-19.756*T*LN(T)-9.37295E-3*T**2+0.659882E-6*T**3
|
||
|
-1112565*T**(-1); 2157.00 Y
|
||
|
-15200.539+228.05641*T-42.248*T*LN(T); 3000.00 N !
|
||
|
$ -------------------------------------
|
||
|
|
||
|
$ Rb
|
||
|
$ -------------------------------------
|
||
|
PARAMETER G(BCC_A2,RB:VA;0) 200.00
|
||
|
-21669.733+583.580988*T-115.2825888*T*LN(T)+262.77612E-3*T**2
|
||
|
-152.236932E-6*T**3+385754*T**(-1); 312.46 Y
|
||
|
-7823.397+117.050578*T-29.1775424*T*LN(T)+0.412369E-3*T**2-0.46822E-6*T**3
|
||
|
-126310*T**(-1)-555.029E20*T**(-9); 900.00 Y
|
||
|
-39488.142+450.974149*T-77.7006456*T*LN(T)+33.795632E-3*T**2-4.829082E-6*T**3
|
||
|
+3778006*T**(-1)-555.029E20*T**(-9); 1600.00 Y
|
||
|
-159742.511+1287.789466*T-191.2627736*T*LN(T)+81.61687E-3*T**2
|
||
|
-8.61653E-6*T**3+27738456*T**(-1)-555.029E20*T**(-9); 2100.00 N !
|
||
|
|
||
|
PARAMETER G(LIQUID,RB;0) 200.00
|
||
|
-19452.181+576.470502*T-115.2825888*T*LN(T)+262.77612E-3*T**2
|
||
|
-152.236932E-6*T**3+385754*T**(-1)+144.078E-19*T**7; 312.46 Y
|
||
|
-5650.532+110.090262*T-29.1775424*T*LN(T)+0.412369E-3*T**2-0.46822E-6*T**3
|
||
|
-126310*T**(-1); 900.00 Y
|
||
|
-37315.276+444.013833*T-77.7006456*T*LN(T)+33.795632E-3*T**2-4.829082E-6*T**3
|
||
|
+3778006*T**(-1); 1600.00 Y
|
||
|
-157569.646+1280.829151*T-191.2627736*T*LN(T)+81.61687E-3*T**2
|
||
|
-8.61653E-6*T**3+27738456*T**(-1); 2100.00 N !
|
||
|
|
||
|
PARAMETER G(HCP_A3,RB:VA;0) 200.00
|
||
|
-21469.733+585.580988*T-115.2825888*T*LN(T)+262.77612E-3*T**2
|
||
|
-152.236932E-6*T**3+385754*T**(-1); 312.46 Y
|
||
|
-7623.397+119.050578*T-29.1775424*T*LN(T)+0.412369E-3*T**2-0.46822E-6*T**3
|
||
|
-126310*T**(-1)-555.029E20*T**(-9); 900.00 Y
|
||
|
-39288.142+452.974149*T-77.7006456*T*LN(T)+33.795632E-3*T**2-4.829082E-6*T**3
|
||
|
+3778006*T**(-1)-555.029E20*T**(-9); 1600.00 Y
|
||
|
-159542.511+1289.789466*T-191.2627736*T*LN(T)+81.61687E-3*T**2
|
||
|
-8.61653E-6*T**3+27738456*T**(-1)-555.029E20*T**(-9); 2100.00 N !
|
||
|
|
||
|
PARAMETER G(FCC_A1,RB:VA;0) 200.00
|
||
|
-21469.733+584.880988*T-115.2825888*T*LN(T)+262.77612E-3*T**2
|
||
|
-152.236932E-6*T**3+385754*T**(-1); 312.46 Y
|
||
|
-7623.397+118.350578*T-29.1775424*T*LN(T)+0.412369E-3*T**2-0.46822E-6*T**3
|
||
|
-126310*T**(-1)-555.029E20*T**(-9); 900.00 Y
|
||
|
-39288.142+452.274149*T-77.7006456*T*LN(T)+33.795632E-3*T**2-4.829082E-6*T**3
|
||
|
+3778006*T**(-1)-555.029E20*T**(-9); 1600.00 Y
|
||
|
-159542.511+1289.089466*T-191.2627736*T*LN(T)+81.61687E-3*T**2
|
||
|
-8.61653E-6*T**3+27738456*T**(-1)-555.029E20*T**(-9); 2100.00 N !
|
||
|
$ -------------------------------------
|
||
|
|
||
|
$ Re
|
||
|
$ -------------------------------------
|
||
|
$ Data from John Arblaster, To be published, CALPHAD, 1996, 20(3)
|
||
|
PARAMETER G(HCP_A3,RE:VA;0) 298.15 -7695.279+128.421589*T-24.348*T*LN(T)
|
||
|
-2.53505E-3*T**2+0.192818E-6*T**3+32915*T**(-1); 1200 Y
|
||
|
-15775.998+194.667426*T-33.586*T*LN(T)+2.24565E-3*T**2-0.281835E-6*T**3
|
||
|
+1376270*T**(-1); 2400 Y
|
||
|
-70882.739+462.110749*T-67.956*T*LN(T)+11.84945E-3*T**2-0.788955E-6*T**3
|
||
|
+18075200*T**(-1); 3458 Y
|
||
|
346325.888-1211.371859*T+140.8316548*T*LN(T)-33.764567E-3*T**2
|
||
|
+1.053726E-6*T**3-134548866*T**(-1); 5000 Y
|
||
|
-78564.296+346.997842*T-49.519*T*LN(T); 6000 N !
|
||
|
|
||
|
$ Data from John Arblaster, To be published, CALPHAD, 1996, 20(3)
|
||
|
PARAMETER G(LIQUID,RE;0) 298.15 16125.604+122.076209*T-24.348*T*LN(T)
|
||
|
-2.53505E-3*T**2+0.192818E-6*T**3+32915*T**(-1); 1200 Y
|
||
|
8044.885+188.322047*T-33.586*T*LN(T)+2.24565E-3*T**2-0.281835E-6*T**3
|
||
|
+1376270*T**(-1); 2000 Y
|
||
|
568842.665-2527.838455*T+314.1788975*T*LN(T)-89.39817E-3*T**2
|
||
|
+3.92854E-6*T**3-163100987*T**(-1); 3458 Y
|
||
|
-39044.888+335.723691*T-49.519*T*LN(T); 6000 N !
|
||
|
|
||
|
PARAMETER G(BCC_A2,RE:VA;0) 298.15 9304.721+124.721589*T-24.348*T*LN(T)
|
||
|
-2.53505E-3*T**2+0.192818E-6*T**3+32915*T**(-1); 1200 Y
|
||
|
1224.002+190.967426*T-33.586*T*LN(T)+2.24565E-3*T**2-0.281835E-6*T**3
|
||
|
+1376270*T**(-1); 2400 Y
|
||
|
-53882.739+458.410749*T-67.956*T*LN(T)+11.84945E-3*T**2-0.788955E-6*T**3
|
||
|
+18075200*T**(-1); 3458 Y
|
||
|
363325.888-1215.071859*T+140.8316548*T*LN(T)-33.764567E-3*T**2
|
||
|
+1.053726E-6*T**3-134548866*T**(-1); 5000 Y
|
||
|
-61564.296+343.297842*T-49.519*T*LN(T); 6000 N !
|
||
|
|
||
|
PARAMETER G(FCC_A1,RE:VA;0) 298.15
|
||
|
3304.721+126.921589*T-24.348*T*LN(T)-2.53505E-3*T**2+0.192818E-6*T**3
|
||
|
+32915*T**(-1); 1200.00 Y
|
||
|
-4775.998+193.167426*T-33.586*T*LN(T)+2.24565E-3*T**2-0.281835E-6*T**3
|
||
|
+1376270*T**(-1); 2400.00 Y
|
||
|
-59882.739+460.610749*T-67.956*T*LN(T)+11.84945E-3*T**2-0.788955E-6*T**3
|
||
|
+18075200*T**(-1); 3458.00 Y
|
||
|
357325.888-1212.871859*T+140.8316548*T*LN(T)-33.764567E-3*T**2+1.053726E-6*T**3
|
||
|
-134548866*T**(-1); 5000.00 Y
|
||
|
-67564.296+345.497842*T-49.519*T*LN(T); 6000.00 N !
|
||
|
$ -------------------------------------
|
||
|
|
||
|
$ Rh
|
||
|
$ -------------------------------------
|
||
|
PARAMETER G(FCC_A1,RH:VA;0) 298.15
|
||
|
-7848.828+132.020923*T-24.0178336*T*LN(T)-3.424186E-3*T**2-0.168032E-6*T**3
|
||
|
+55846*T**(-1); 1200.00 Y
|
||
|
-28367.852+305.771019*T-48.3766632*T*LN(T)+9.66345E-3*T**2-1.512774E-6*T**3
|
||
|
+3348162*T**(-1); 2237.00 Y
|
||
|
-6237470.481+30151.634226*T-3874.2105805*T*LN(T)+1049.213607E-3*T**2
|
||
|
-53.978814E-6*T**3+1880362184*T**(-1); 2450.00 Y
|
||
|
-44863.489+344.889895*T-50.58456*T*LN(T); 2500.00 N !
|
||
|
|
||
|
PARAMETER G(BCC_A2,RH:VA;0) 298.15
|
||
|
11151.172+127.320923*T-24.0178336*T*LN(T)-3.424186E-3*T**2-0.168032E-6*T**3
|
||
|
+55846*T**(-1); 1200.00 Y
|
||
|
-9367.852+301.071019*T-48.3766632*T*LN(T)+9.66345E-3*T**2-1.512774E-6*T**3
|
||
|
+3348162*T**(-1); 2237.00 Y
|
||
|
-6218470.481+30146.934226*T-3874.2105805*T*LN(T)+1049.213607E-3*T**2
|
||
|
-53.978814E-6*T**3+1880362184*T**(-1); 2450.00 Y
|
||
|
-25863.489+340.189895*T-50.58456*T*LN(T); 2500.00 N !
|
||
|
|
||
|
PARAMETER G(HCP_A3,RH:VA;0) 298.15
|
||
|
-4848.828+131.520923*T-24.0178336*T*LN(T)-3.424186E-3*T**2-0.168032E-6*T**3
|
||
|
+55846*T**(-1); 1200.00 Y
|
||
|
-25367.852+305.271019*T-48.3766632*T*LN(T)+9.66345E-3*T**2-1.512774E-6*T**3
|
||
|
+3348162*T**(-1); 2237.00 Y
|
||
|
-6234470.481+30151.134226*T-3874.2105805*T*LN(T)+1049.213607E-3*T**2
|
||
|
-53.978814E-6*T**3+1880362184*T**(-1); 2450.00 Y
|
||
|
-41863.489+344.389895*T-50.58456*T*LN(T); 2500.00 N !
|
||
|
|
||
|
PARAMETER G(LIQUID,RH;0) 298.15
|
||
|
11244.082+125.099593*T-24.0178336*T*LN(T)-3.424186E-3*T**2-0.168032E-6*T**3
|
||
|
+55846*T**(-1); 700.00 Y
|
||
|
35898.508-147.926418*T+15.6492377*T*LN(T)-28.665357E-3*T**2+2.100572E-6*T**3
|
||
|
-2638940*T**(-1); 2237.00 Y
|
||
|
-18208.54+332.974832*T-50.58456*T*LN(T); 2500.00 N !
|
||
|
$ -------------------------------------
|
||
|
|
||
|
$ Ru
|
||
|
$ -------------------------------------
|
||
|
PARAMETER G(HCP_A3,RU:VA;0) 298.15
|
||
|
-7561.873+127.866233*T-22.9143287*T*LN(T)-4.062566E-3*T**2+0.17641E-6*T**3
|
||
|
+56377*T**(-1); 1500.00 Y
|
||
|
-59448.103+489.516214*T-72.3241219*T*LN(T)+18.726245E-3*T**2-1.952433E-6*T**3
|
||
|
+11063885*T**(-1); 2607.00 Y
|
||
|
-38588773.031+168610.517401*T-21329.7050475*T*LN(T)+5221.638997E-3*T**2
|
||
|
-240.245985E-6*T**3+1308.2992629E7*T**(-1); 2740.00 Y
|
||
|
-55768.304+364.482314*T-51.8816*T*LN(T); 4500.00 N !
|
||
|
|
||
|
$ Parameter revised 22/5/2000 to make mpt of BCC_A2 about 1600 K
|
||
|
$ PARAMETER G(BCC_A2,RU:VA;0) 298.15 GHSERRU+21500-5.05*T; 4500 N !
|
||
|
PARAMETER G(BCC_A2,RU:VA;0) 298.15
|
||
|
13938.127+122.816233*T-22.9143287*T*LN(T)-4.062566E-3*T**2+0.17641E-6*T**3
|
||
|
+56377*T**(-1); 1500.00 Y
|
||
|
-37948.103+484.466214*T-72.3241219*T*LN(T)+18.726245E-3*T**2-1.952433E-6*T**3
|
||
|
+11063885*T**(-1); 2607.00 Y
|
||
|
-38567273.031+168605.467401*T-21329.7050475*T*LN(T)+5221.638997E-3*T**2
|
||
|
-240.245985E-6*T**3+1308.2992629E7*T**(-1); 2740.00 Y
|
||
|
-34268.304+359.432314*T-51.8816*T*LN(T); 4500.00 N !
|
||
|
|
||
|
PARAMETER G(FCC_A1,RU:VA;0) 298.15
|
||
|
4938.127+125.466233*T-22.9143287*T*LN(T)-4.062566E-3*T**2+0.17641E-6*T**3
|
||
|
+56377*T**(-1); 1500.00 Y
|
||
|
-46948.103+487.116214*T-72.3241219*T*LN(T)+18.726245E-3*T**2-1.952433E-6*T**3
|
||
|
+11063885*T**(-1); 2607.00 Y
|
||
|
-38576273.031+168608.117401*T-21329.7050475*T*LN(T)+5221.638997E-3*T**2
|
||
|
-240.245985E-6*T**3+1308.2992629E7*T**(-1); 2740.00 Y
|
||
|
-43268.304+362.082314*T-51.8816*T*LN(T); 4500.00 N !
|
||
|
|
||
|
PARAMETER G(LIQUID,RU;0) 298.15
|
||
|
19918.743+119.467485*T-22.9143287*T*LN(T)-4.062566E-3*T**2+0.17641E-6*T**3
|
||
|
+56377*T**(-1); 800.00 Y
|
||
|
50827.232-179.818561*T+19.539341*T*LN(T)-26.524167E-3*T**2+1.667839E-6*T**3
|
||
|
-3861125*T**(-1); 2607.00 Y
|
||
|
-17161.807+349.673561*T-51.8816*T*LN(T); 4500.00 N !
|
||
|
$ -------------------------------------
|
||
|
|
||
|
$ S
|
||
|
$ -------------------------------------
|
||
|
$ Phase name changed for version 3.00 of database to ORTHORHOMBIC_S
|
||
|
PARAMETER G(ORTHORHOMBIC_S,S;0) 298.15 -5198.294+53.913855*T-10.726*T*LN(T)
|
||
|
-27.3801E-3*T**2+8.179537E-6*T**3; 368.3 Y
|
||
|
-6475.706+94.182332*T-17.8693298*T*LN(T)-10.936877E-3*T**2+1.406467E-6*T**3
|
||
|
+36871*T**(-1); 1300 Y
|
||
|
-12485.546+188.304687*T-32*T*LN(T); 1301 N !
|
||
|
|
||
|
PARAMETER G(MONOCLINIC,S;0) 298.15 -5725.422+89.544275*T-17.413*T*LN(T)
|
||
|
-9.93935E-3*T**2-0.070062E-6*T**3+1250*T**(-1); 388.36 Y
|
||
|
-7455.008+114.782945*T-21.1531404*T*LN(T)-8.566163E-3*T**2+1.112484E-6*T**3
|
||
|
+122167*T**(-1); 1300 Y
|
||
|
-11779.415+186.699065*T-32*T*LN(T); 1301 N !
|
||
|
|
||
|
PARAMETER G(LIQUID,S;0) 298.15 -4196.575+85.63027*T-17.413*T*LN(T)
|
||
|
-9.93935E-3*T**2-0.070062E-6*T**3+1250*T**(-1); 335 Y
|
||
|
1790361.982-44195.451432*T+7511.6194258*T*LN(T)-13985.517511E-3*T**2
|
||
|
+4838.738601E-6*T**3-79880891*T**(-1); 388.36 Y
|
||
|
-876313.954+23366.872986*T-4028.756*T*LN(T)+7954.595E-3*T**2
|
||
|
-2908.513333E-6*T**3+33980035*T**(-1); 432.25 Y
|
||
|
454088.687-7814.670231*T+1237.001*T*LN(T)-1560.7295E-3*T**2+359.883667E-6*T**3
|
||
|
-31765395*T**(-1); 500 Y
|
||
|
18554.561-144.895285*T+16.535*T*LN(T)-45.4119E-3*T**2+8.327402E-6*T**3
|
||
|
-2705030*T**(-1); 700 Y
|
||
|
21243.126-113.298877*T+9.944*T*LN(T)-28.8384E-3*T**2+3.791365E-6*T**3
|
||
|
-3507570*T**(-1); 900 Y
|
||
|
16117.849-32.79523*T-2.425*T*LN(T)-17.12545E-3*T**2+1.84974E-6*T**3
|
||
|
-3215170*T**(-1); 1300 Y
|
||
|
-6461.814+175.590536*T-32*T*LN(T); 1301 N !
|
||
|
|
||
|
$ Recommended by Bosse Sundman
|
||
|
PARAMETER G(BCC_A2,S:VA;0) 298.15 99801.706+53.913855*T-10.726*T*LN(T)
|
||
|
-27.3801E-3*T**2+8.179537E-6*T**3; 368.3 Y
|
||
|
98524.294+94.182332*T-17.8693298*T*LN(T)-10.936877E-3*T**2+1.406467E-6*T**3
|
||
|
+36871*T**(-1); 1300 Y
|
||
|
92514.454+188.304687*T-32*T*LN(T); 1301 N !
|
||
|
|
||
|
$ Recommended by Bosse Sundman
|
||
|
PARAMETER G(FCC_A1,S:VA;0) 298.15 99801.706+53.913855*T-10.726*T*LN(T)
|
||
|
-27.3801E-3*T**2+8.179537E-6*T**3; 368.3 Y
|
||
|
98524.294+94.182332*T-17.8693298*T*LN(T)-10.936877E-3*T**2+1.406467E-6*T**3
|
||
|
+36871*T**(-1); 1300 Y
|
||
|
92514.454+188.304687*T-32*T*LN(T); 1301 N !
|
||
|
$ -------------------------------------
|
||
|
|
||
|
$ Sb
|
||
|
$ -------------------------------------
|
||
|
PARAMETER G(RHOMBOHEDRAL_A7,SB;0) 298.15
|
||
|
-9242.858+156.154689*T-30.5130752*T*LN(T)+7.748768E-3*T**2-3.003415E-6*T**3
|
||
|
+100625*T**(-1); 903.78 Y
|
||
|
-11738.83+169.485872*T-31.38*T*LN(T)+1616.849E24*T**(-9); 2000.00 N !
|
||
|
|
||
|
PARAMETER G(LIQUID,SB;0) 298.15
|
||
|
10579.47+134.231525*T-30.5130752*T*LN(T)+7.748768E-3*T**2-3.003415E-6*T**3
|
||
|
+100625*T**(-1)-174.847E-22*T**7; 903.78 Y
|
||
|
8175.359+147.455986*T-31.38*T*LN(T); 2000.00 N !
|
||
|
|
||
|
$ Revised data for Sb bct_a5 from A T Dinsdale for version 3.00 of database
|
||
|
PARAMETER G(BCT_A5,SB;0) 298.15
|
||
|
3757.142+148.154689*T-30.5130752*T*LN(T)+7.748768E-3*T**2-3.003415E-6*T**3
|
||
|
+100625*T**(-1); 903.78 Y
|
||
|
1261.17+161.485872*T-31.38*T*LN(T)+1616.849E24*T**(-9); 2000.00 N !
|
||
|
|
||
|
PARAMETER G(FCC_A1,SB:VA;0) 298.15
|
||
|
10631.142+142.454689*T-30.5130752*T*LN(T)+7.748768E-3*T**2-3.003415E-6*T**3
|
||
|
+100625*T**(-1); 903.78 Y
|
||
|
8135.17+155.785872*T-31.38*T*LN(T)+1616.849E24*T**(-9); 2000.00 N !
|
||
|
|
||
|
PARAMETER G(BCC_A2,SB:VA;0) 298.15
|
||
|
10631.142+141.054689*T-30.5130752*T*LN(T)+7.748768E-3*T**2-3.003415E-6*T**3
|
||
|
+100625*T**(-1); 903.78 Y
|
||
|
8135.17+154.385872*T-31.38*T*LN(T)+1616.849E24*T**(-9); 2000.00 N !
|
||
|
|
||
|
PARAMETER G(HCP_A3,SB:VA;0) 298.15
|
||
|
10631.142+143.154689*T-30.5130752*T*LN(T)+7.748768E-3*T**2-3.003415E-6*T**3
|
||
|
+100625*T**(-1); 903.78 Y
|
||
|
8135.17+156.485872*T-31.38*T*LN(T)+1616.849E24*T**(-9); 2000.00 N !
|
||
|
$ -------------------------------------
|
||
|
|
||
|
$ Sc
|
||
|
$ -------------------------------------
|
||
|
PARAMETER G(HCP_A3,SC:VA;0) 298.15
|
||
|
-8689.547+153.48097*T-28.1882*T*LN(T)+3.21892E-3*T**2-1.64531E-6*T**3
|
||
|
+72177*T**(-1); 800.00 Y
|
||
|
-7511.295+132.759582*T-24.9132*T*LN(T)-0.573295E-3*T**2-0.859345E-6*T**3;
|
||
|
1608.00 Y
|
||
|
261143.04-1817.922454*T+241.4410508*T*LN(T)-117.529396E-3*T**2+8.7398E-6*T**3
|
||
|
-50607159*T**(-1); 2000.00 Y
|
||
|
-30515.246+286.474338*T-44.2249*T*LN(T); 3200.00 N !
|
||
|
|
||
|
PARAMETER G(BCC_A2,SC:VA;0) 298.15
|
||
|
-6709.819+152.456835*T-28.1882*T*LN(T)+3.21892E-3*T**2-1.64531E-6*T**3
|
||
|
+72177*T**(-1); 800.00 Y
|
||
|
-5531.567+131.735447*T-24.9132*T*LN(T)-0.573295E-3*T**2-0.859345E-6*T**3;
|
||
|
1000.00 Y
|
||
|
230161.408-2004.054685*T+276.7666402*T*LN(T)-167.120107E-3*T**2
|
||
|
+15.637371E-6*T**3-33783257*T**(-1); 1608.00 Y
|
||
|
-25928.011+283.642312*T-44.2249*T*LN(T); 3200.00 N !
|
||
|
|
||
|
PARAMETER G(LIQUID,SC;0) 298.15
|
||
|
6478.66+45.427539*T-10.7967803*T*LN(T)-20.636524E-3*T**2+2.13106E-6*T**3
|
||
|
-158106*T**(-1); 1608.00 Y
|
||
|
-11832.111+275.871695*T-44.2249*T*LN(T); 3200.00 N !
|
||
|
|
||
|
$ Cacciamani G; Riani P; Borzone G; Parodi N; Saccone A; Ferro R;
|
||
|
$ Pisch A; Schmid-Fetzer R;
|
||
|
$ Intermetallics, 7 (1), 101-108 (1999).
|
||
|
$ "Thermodynamic measurements and assessment of the al-sc system"
|
||
|
PARAMETER G(FCC_A1,SC:VA;0) 298.15
|
||
|
-3689.547+153.48097*T-28.1882*T*LN(T)+3.21892E-3*T**2-1.64531E-6*T**3
|
||
|
+72177*T**(-1); 800.00 Y
|
||
|
-2511.295+132.759582*T-24.9132*T*LN(T)-0.573295E-3*T**2-0.859345E-6*T**3;
|
||
|
1608.00 Y
|
||
|
266143.04-1817.922454*T+241.4410508*T*LN(T)-117.529396E-3*T**2+8.7398E-6*T**3
|
||
|
-50607159*T**(-1); 2000.00 Y
|
||
|
-25515.246+286.474338*T-44.2249*T*LN(T); 3200.00 N !
|
||
|
|
||
|
$ From Susanne Norgren, Thesis, KTH 2000
|
||
|
PARAMETER G(DHCP,SC;0) 298.15
|
||
|
-7489.547+153.8966955*T-28.1882*T*LN(T)+3.21892E-3*T**2-1.64531E-6*T**3
|
||
|
+72177*T**(-1); 800.00 Y
|
||
|
-6311.295+133.1753075*T-24.9132*T*LN(T)-0.573295E-3*T**2-0.859345E-6*T**3;
|
||
|
1608.00 Y
|
||
|
262343.04-1817.506729*T+241.4410508*T*LN(T)-117.529396E-3*T**2+8.7398E-6*T**3
|
||
|
-50607159*T**(-1); 2000.00 Y
|
||
|
-29315.246+286.8900635*T-44.2249*T*LN(T); 3200.00 N !
|
||
|
$ -------------------------------------
|
||
|
|
||
|
$ Se
|
||
|
$ -------------------------------------
|
||
|
PARAMETER G(HEXAGONAL_A8,SE;0) 298.15
|
||
|
-9376.371+174.205877*T-33.6527*T*LN(T)+24.24314E-3*T**2-15.318461E-6*T**3
|
||
|
+102249*T**(-1); 494.00 Y
|
||
|
-37546.134+507.111538*T-81.2006585*T*LN(T)+37.144892E-3*T**2-5.611026E-6*T**3
|
||
|
+2614263*T**(-1); 800.00 Y
|
||
|
-12193.47+197.770166*T-35.1456*T*LN(T); 1000.00 N !
|
||
|
|
||
|
PARAMETER G(LIQUID,SE;0) 298.15
|
||
|
50533.347-1178.288242*T+194.1074389*T*LN(T)-390.268991E-3*T**2
|
||
|
+119.219297E-6*T**3-2224398*T**(-1); 494.00 Y
|
||
|
-5228.304+183.72559*T-35.1456*T*LN(T); 1000.00 N !
|
||
|
$ -------------------------------------
|
||
|
|
||
|
$ Si
|
||
|
$ -------------------------------------
|
||
|
PARAMETER G(DIAMOND_A4,SI;0) 298.15
|
||
|
-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+167.281367*T-27.196*T*LN(T)-420.369E28*T**(-9); 3600.00 N !
|
||
|
|
||
|
PARAMETER G(LIQUID,SI;0) 298.15
|
||
|
42533.751+107.13742*T-22.8317533*T*LN(T)-1.912904E-3*T**2-0.003552E-6*T**3
|
||
|
+176667*T**(-1)+209.307E-23*T**7; 1687.00 Y
|
||
|
40370.523+137.722298*T-27.196*T*LN(T); 3600.00 N !
|
||
|
|
||
|
PARAMETER G(BCC_A2,SI:VA;0) 298.15
|
||
|
38837.391+114.736859*T-22.8317533*T*LN(T)-1.912904E-3*T**2-0.003552E-6*T**3
|
||
|
+176667*T**(-1); 1687.00 Y
|
||
|
37542.358+144.781367*T-27.196*T*LN(T)-420.369E28*T**(-9); 3600.00 N !
|
||
|
|
||
|
PARAMETER G(FCC_A1,SI:VA;0) 298.15
|
||
|
42837.391+115.436859*T-22.8317533*T*LN(T)-1.912904E-3*T**2-0.003552E-6*T**3
|
||
|
+176667*T**(-1); 1687.00 Y
|
||
|
41542.358+145.481367*T-27.196*T*LN(T)-420.369E28*T**(-9); 3600.00 N !
|
||
|
|
||
|
PARAMETER G(CBCC_A12,SI:VA;0) 298.15
|
||
|
42045.391+116.859859*T-22.8317533*T*LN(T)-1.912904E-3*T**2-0.003552E-6*T**3
|
||
|
+176667*T**(-1); 1687.00 Y
|
||
|
40750.358+146.904367*T-27.196*T*LN(T)-420.369E28*T**(-9); 3600.00 N !
|
||
|
|
||
|
PARAMETER G(CUB_A13,SI:VA;0) 298.15
|
||
|
39116.391+116.859859*T-22.8317533*T*LN(T)-1.912904E-3*T**2-0.003552E-6*T**3
|
||
|
+176667*T**(-1); 1687.00 Y
|
||
|
37821.358+146.904367*T-27.196*T*LN(T)-420.369E28*T**(-9); 3600.00 N !
|
||
|
|
||
|
PARAMETER G(HCP_A3,SI:VA;0) 298.15
|
||
|
41037.391+116.436859*T-22.8317533*T*LN(T)-1.912904E-3*T**2-0.003552E-6*T**3
|
||
|
+176667*T**(-1); 1687.00 Y
|
||
|
39742.358+146.481367*T-27.196*T*LN(T)-420.369E28*T**(-9); 3600.00 N !
|
||
|
|
||
|
PARAMETER G(HCP_ZN,SI:VA;0) 298.15
|
||
|
41038.391+116.436859*T-22.8317533*T*LN(T)-1.912904E-3*T**2-0.003552E-6*T**3
|
||
|
+176667*T**(-1); 1687.00 Y
|
||
|
39743.358+146.481367*T-27.196*T*LN(T)-420.369E28*T**(-9); 3600.00 N !
|
||
|
$ -------------------------------------
|
||
|
|
||
|
$ Sm
|
||
|
$ -------------------------------------
|
||
|
PARAMETER G(RHOMB_C19,SM;0) 298.15
|
||
|
-3872.013-32.10748*T-1.6485*T*LN(T)-50.254E-3*T**2+10.10345E-6*T**3
|
||
|
-82168*T**(-1); 700.00 Y
|
||
|
-50078.215+627.869894*T-102.665*T*LN(T)+47.4522E-3*T**2-7.538383E-6*T**3
|
||
|
+3861770*T**(-1); 1190.00 Y
|
||
|
289719.819-2744.509764*T+381.4198202*T*LN(T)-254.986338E-3*T**2
|
||
|
+27.512152E-6*T**3-40102102*T**(-1); 1345.00 Y
|
||
|
-23056.079+282.194375*T-50.208*T*LN(T); 2100.00 N !
|
||
|
|
||
|
$ Xuping Su, Weijing Zhang and Zhenmin Du
|
||
|
$ J. Alloys and Compounds 1998, 278, 182-4
|
||
|
PARAMETER G(HCP_A3,SM:VA;0) 298.15
|
||
|
-3802.0356-32.176971*T-1.6485*T*LN(T)-50.254E-3*T**2+10.10345E-6*T**3
|
||
|
-82168*T**(-1); 700.00 Y
|
||
|
-50008.2376+627.800403*T-102.665*T*LN(T)+47.4522E-3*T**2-7.538383E-6*T**3
|
||
|
+3861770*T**(-1); 1190.00 Y
|
||
|
289789.7964-2744.579255*T+381.4198202*T*LN(T)-254.986338E-3*T**2
|
||
|
+27.512152E-6*T**3-40102102*T**(-1); 1345.00 Y
|
||
|
-22986.1016+282.124884*T-50.208*T*LN(T); 2100.00 N !
|
||
|
|
||
|
PARAMETER G(BCC_A2,SM:VA;0) 298.15
|
||
|
-4368.72+55.972523*T-16.9298494*T*LN(T)-25.446016E-3*T**2+3.579527E-6*T**3
|
||
|
+94209*T**(-1); 1190.00 Y
|
||
|
-15957.862+253.121044*T-46.9445*T*LN(T); 1345.00 Y
|
||
|
111191.653-624.680805*T+71.6856914*T*LN(T)-47.314968E-3*T**2+3.329865E-6*T**3
|
||
|
-24870276*T**(-1); 2100.00 N !
|
||
|
|
||
|
PARAMETER G(LIQUID,SM;0) 298.15
|
||
|
3468.783+20.117456*T-11.6968284*T*LN(T)-32.418177E-3*T**2+4.544272E-6*T**3
|
||
|
+23528*T**(-1); 1190.00 Y
|
||
|
-11728.229+273.487076*T-50.208*T*LN(T); 2100.00 N !
|
||
|
$ -------------------------------------
|
||
|
|
||
|
$ Sn
|
||
|
$ -------------------------------------
|
||
|
PARAMETER G(BCT_A5,SN;0) 100.00
|
||
|
-7958.517+122.765451*T-25.858*T*LN(T)+0.51185E-3*T**2-3.192767E-6*T**3
|
||
|
+18440*T**(-1); 250.00 Y
|
||
|
-5855.135+65.443315*T-15.961*T*LN(T)-18.8702E-3*T**2+3.121167E-6*T**3
|
||
|
-61960*T**(-1); 505.08 Y
|
||
|
2524.724+4.005269*T-8.2590486*T*LN(T)-16.814429E-3*T**2+2.623131E-6*T**3
|
||
|
-1081244*T**(-1)-123.07E23*T**(-9); 800.00 Y
|
||
|
-8256.959+138.99688*T-28.4512*T*LN(T)-123.07E23*T**(-9); 3000.00 N !
|
||
|
|
||
|
PARAMETER G(DIAMOND_A4,SN;0) 100.00
|
||
|
-9579.608+114.007785*T-22.972*T*LN(T)-8.13975E-3*T**2+2.7288E-6*T**3
|
||
|
+25615*T**(-1); 298.15 Y
|
||
|
-9063.001+104.84654*T-21.5750771*T*LN(T)-8.575282E-3*T**2+1.784447E-6*T**3
|
||
|
-2544*T**(-1); 800.00 Y
|
||
|
-10909.351+147.396535*T-28.4512*T*LN(T); 3000.00 N !
|
||
|
|
||
|
PARAMETER G(LIQUID,SN;0) 100.00
|
||
|
-855.425+108.677684*T-25.858*T*LN(T)+0.51185E-3*T**2-3.192767E-6*T**3
|
||
|
+18440*T**(-1)+147.031E-20*T**7; 250.00 Y
|
||
|
1247.957+51.355548*T-15.961*T*LN(T)-18.8702E-3*T**2+3.121167E-6*T**3
|
||
|
-61960*T**(-1)+147.031E-20*T**7; 505.08 Y
|
||
|
9496.31-9.809114*T-8.2590486*T*LN(T)-16.814429E-3*T**2+2.623131E-6*T**3
|
||
|
-1081244*T**(-1); 800.00 Y
|
||
|
-1285.372+125.182498*T-28.4512*T*LN(T); 3000.00 N !
|
||
|
|
||
|
$ Data from Fecht et al. Metall. Trans. A, 1989, 20A, 795-803
|
||
|
$ Data changed in version 3.00 of database
|
||
|
PARAMETER G(FCC_A1,SN:VA;0) 298.15
|
||
|
-345.135+56.983315*T-15.961*T*LN(T)-18.8702E-3*T**2+3.121167E-6*T**3
|
||
|
-61960*T**(-1); 505.08 Y
|
||
|
8034.724-4.454731*T-8.2590486*T*LN(T)-16.814429E-3*T**2+2.623131E-6*T**3
|
||
|
-1081244*T**(-1)-123.07E23*T**(-9); 800.00 Y
|
||
|
-2746.959+130.53688*T-28.4512*T*LN(T)-123.07E23*T**(-9); 3000.00 N !
|
||
|
|
||
|
$ Source of data: Unpublished work - Himo Ansara
|
||
|
PARAMETER G(HCP_A3,SN:VA;0) 298.15
|
||
|
-1955.135+57.797315*T-15.961*T*LN(T)-18.8702E-3*T**2+3.121167E-6*T**3
|
||
|
-61960*T**(-1); 505.08 Y
|
||
|
6424.724-3.640731*T-8.2590486*T*LN(T)-16.814429E-3*T**2+2.623131E-6*T**3
|
||
|
-1081244*T**(-1)-123.07E23*T**(-9); 800.00 Y
|
||
|
-4356.959+131.35088*T-28.4512*T*LN(T)-123.07E23*T**(-9); 3000.00 N !
|
||
|
|
||
|
PARAMETER G(HCP_ZN,SN:VA;0) 298.15
|
||
|
-1950.135+57.797315*T-15.961*T*LN(T)-18.8702E-3*T**2+3.121167E-6*T**3
|
||
|
-61960*T**(-1); 505.08 Y
|
||
|
6429.724-3.640731*T-8.2590486*T*LN(T)-16.814429E-3*T**2+2.623131E-6*T**3
|
||
|
-1081244*T**(-1)-123.07E23*T**(-9); 800.00 Y
|
||
|
-4351.959+131.35088*T-28.4512*T*LN(T)-123.07E23*T**(-9); 3000.00 N !
|
||
|
|
||
|
PARAMETER G(RHOMBOHEDRAL_A7,SN;0) 100.00
|
||
|
-5923.517+122.765451*T-25.858*T*LN(T)+0.51185E-3*T**2-3.192767E-6*T**3
|
||
|
+18440*T**(-1); 250.00 Y
|
||
|
-3820.135+65.443315*T-15.961*T*LN(T)-18.8702E-3*T**2+3.121167E-6*T**3
|
||
|
-61960*T**(-1); 505.08 Y
|
||
|
4559.724+4.005269*T-8.2590486*T*LN(T)-16.814429E-3*T**2+2.623131E-6*T**3
|
||
|
-1081244*T**(-1)-123.07E23*T**(-9); 800.00 Y
|
||
|
-6221.959+138.99688*T-28.4512*T*LN(T)-123.07E23*T**(-9); 3000.00 N !
|
||
|
|
||
|
PARAMETER G(BCC_A2,SN:VA;0) 100.00
|
||
|
-3558.517+116.765451*T-25.858*T*LN(T)+0.51185E-3*T**2-3.192767E-6*T**3
|
||
|
+18440*T**(-1); 250.00 Y
|
||
|
-1455.135+59.443315*T-15.961*T*LN(T)-18.8702E-3*T**2+3.121167E-6*T**3
|
||
|
-61960*T**(-1); 505.08 Y
|
||
|
6924.724-1.994731*T-8.2590486*T*LN(T)-16.814429E-3*T**2+2.623131E-6*T**3
|
||
|
-1081244*T**(-1)-123.07E23*T**(-9); 800.00 Y
|
||
|
-3856.959+132.99688*T-28.4512*T*LN(T)-123.07E23*T**(-9); 3000.00 N !
|
||
|
|
||
|
$ Source of data: Unpublished assessment of the In-Sn system
|
||
|
$ Himo Ansara
|
||
|
PARAMETER G(TETRAGONAL_A6,SN;0) 298.15
|
||
|
-468.135+57.181195*T-15.961*T*LN(T)-18.8702E-3*T**2+3.121167E-6*T**3
|
||
|
-61960*T**(-1); 505.08 Y
|
||
|
7911.724-4.256851*T-8.2590486*T*LN(T)-16.814429E-3*T**2+2.623131E-6*T**3
|
||
|
-1081244*T**(-1)-123.07E23*T**(-9); 800.00 Y
|
||
|
-2869.959+130.73476*T-28.4512*T*LN(T)-123.07E23*T**(-9); 3000.00 N !
|
||
|
|
||
|
$ Source of data: J Miettinen, CALPHAD to be published
|
||
|
PARAMETER G(CBCC_A12,SN:VA;0) 100.00
|
||
|
-5958.517+122.765451*T-25.858*T*LN(T)+0.51185E-3*T**2-3.192767E-6*T**3
|
||
|
+18440*T**(-1); 250.00 Y
|
||
|
-3855.135+65.443315*T-15.961*T*LN(T)-18.8702E-3*T**2+3.121167E-6*T**3
|
||
|
-61960*T**(-1); 505.08 Y
|
||
|
4524.724+4.005269*T-8.2590486*T*LN(T)-16.814429E-3*T**2+2.623131E-6*T**3
|
||
|
-1081244*T**(-1)-123.07E23*T**(-9); 800.00 Y
|
||
|
-6256.959+138.99688*T-28.4512*T*LN(T)-123.07E23*T**(-9); 3000.00 N !
|
||
|
|
||
|
$ Source of data: J Miettinen, CALPHAD to be published
|
||
|
PARAMETER G(CUB_A13,SN:VA;0) 100.00
|
||
|
-5958.517+122.765451*T-25.858*T*LN(T)+0.51185E-3*T**2-3.192767E-6*T**3
|
||
|
+18440*T**(-1); 250.00 Y
|
||
|
-3855.135+65.443315*T-15.961*T*LN(T)-18.8702E-3*T**2+3.121167E-6*T**3
|
||
|
-61960*T**(-1); 505.08 Y
|
||
|
4524.724+4.005269*T-8.2590486*T*LN(T)-16.814429E-3*T**2+2.623131E-6*T**3
|
||
|
-1081244*T**(-1)-123.07E23*T**(-9); 800.00 Y
|
||
|
-6256.959+138.99688*T-28.4512*T*LN(T)-123.07E23*T**(-9); 3000.00 N !
|
||
|
$ -------------------------------------
|
||
|
|
||
|
$ Sr
|
||
|
$ -------------------------------------
|
||
|
PARAMETER G(FCC_A1,SR:VA;0) 298.15
|
||
|
-7532.367+107.183879*T-23.905*T*LN(T)-4.61225E-3*T**2-0.167477E-6*T**3
|
||
|
-2055*T**(-1); 820.00 Y
|
||
|
-13380.102+153.196104*T-30.0905432*T*LN(T)-3.251266E-3*T**2+0.184189E-6*T**3
|
||
|
+850134*T**(-1); 3000.00 N !
|
||
|
|
||
|
PARAMETER G(BCC_A2,SR:VA;0) 298.15
|
||
|
-6779.234+116.583654*T-25.6708365*T*LN(T)-3.126762E-3*T**2+0.22965E-6*T**3
|
||
|
+27649*T**(-1); 820.00 Y
|
||
|
-6970.594+122.067301*T-26.57*T*LN(T)-1.9493E-3*T**2-0.017895E-6*T**3
|
||
|
+16495*T**(-1); 1050.00 Y
|
||
|
8168.357+0.423037*T-9.7788593*T*LN(T)-9.539908E-3*T**2+0.520221E-6*T**3
|
||
|
-2414794*T**(-1); 3000.00 N !
|
||
|
|
||
|
PARAMETER G(LIQUID,SR;0) 298.15
|
||
|
2194.997-10.118994*T-5.0668978*T*LN(T)-31.840595E-3*T**2+4.981237E-6*T**3
|
||
|
-265559*T**(-1); 1050.00 Y
|
||
|
-10855.29+213.406219*T-39.463*T*LN(T); 3000.00 N !
|
||
|
|
||
|
PARAMETER G(HCP_A3,SR:VA;0) 298.15
|
||
|
-7282.367+107.883879*T-23.905*T*LN(T)-4.61225E-3*T**2-0.167477E-6*T**3
|
||
|
-2055*T**(-1); 820.00 Y
|
||
|
-13130.102+153.896104*T-30.0905432*T*LN(T)-3.251266E-3*T**2+0.184189E-6*T**3
|
||
|
+850134*T**(-1); 3000.00 N !
|
||
|
$ -------------------------------------
|
||
|
|
||
|
$ Ta
|
||
|
$ -------------------------------------
|
||
|
PARAMETER G(BCC_A2,TA:VA;0) 298.15
|
||
|
-7285.889+119.139857*T-23.7592624*T*LN(T)-2.623033E-3*T**2+0.170109E-6*T**3
|
||
|
-3293*T**(-1); 1300.00 Y
|
||
|
-22389.955+243.88676*T-41.137088*T*LN(T)+6.167572E-3*T**2-0.655136E-6*T**3
|
||
|
+2429586*T**(-1); 2500.00 Y
|
||
|
229382.886-722.59722*T+78.5244752*T*LN(T)-17.983376E-3*T**2+0.195033E-6*T**3
|
||
|
-93813648*T**(-1); 3290.00 Y
|
||
|
-1042384.014+2985.491246*T-362.1591318*T*LN(T)+43.117795E-3*T**2
|
||
|
-1.055148E-6*T**3+554714342*T**(-1); 6000.00 N !
|
||
|
|
||
|
PARAMETER G(LIQUID,TA;0) 298.15
|
||
|
21875.086+111.561128*T-23.7592624*T*LN(T)-2.623033E-3*T**2+0.170109E-6*T**3
|
||
|
-3293*T**(-1); 1000.00 Y
|
||
|
43884.339-61.981795*T+0.0279523*T*LN(T)-12.330066E-3*T**2+0.614599E-6*T**3
|
||
|
-3523338*T**(-1); 3290.00 Y
|
||
|
-6314.543+258.110873*T-41.84*T*LN(T); 6000.00 N !
|
||
|
|
||
|
PARAMETER G(FCC_A1,TA:VA;0) 298.15
|
||
|
8714.111+120.839857*T-23.7592624*T*LN(T)-2.623033E-3*T**2+0.170109E-6*T**3
|
||
|
-3293*T**(-1); 1300.00 Y
|
||
|
-6389.955+245.58676*T-41.137088*T*LN(T)+6.167572E-3*T**2-0.655136E-6*T**3
|
||
|
+2429586*T**(-1); 2500.00 Y
|
||
|
245382.886-720.89722*T+78.5244752*T*LN(T)-17.983376E-3*T**2+0.195033E-6*T**3
|
||
|
-93813648*T**(-1); 3290.00 Y
|
||
|
-1026384.014+2987.191246*T-362.1591318*T*LN(T)+43.117795E-3*T**2
|
||
|
-1.055148E-6*T**3+554714342*T**(-1); 6000.00 N !
|
||
|
|
||
|
PARAMETER G(HCP_A3,TA:VA;0) 298.15
|
||
|
4714.111+121.539857*T-23.7592624*T*LN(T)-2.623033E-3*T**2+0.170109E-6*T**3
|
||
|
-3293*T**(-1); 1300.00 Y
|
||
|
-10389.955+246.28676*T-41.137088*T*LN(T)+6.167572E-3*T**2-0.655136E-6*T**3
|
||
|
+2429586*T**(-1); 2500.00 Y
|
||
|
241382.886-720.19722*T+78.5244752*T*LN(T)-17.983376E-3*T**2+0.195033E-6*T**3
|
||
|
-93813648*T**(-1); 3290.00 Y
|
||
|
-1030384.014+2987.891246*T-362.1591318*T*LN(T)+43.117795E-3*T**2
|
||
|
-1.055148E-6*T**3+554714342*T**(-1); 6000.00 N !
|
||
|
$ -------------------------------------
|
||
|
|
||
|
$ Tb
|
||
|
$ -------------------------------------
|
||
|
PARAMETER G(HCP_A3,TB:VA;0) 298.15
|
||
|
-20842.158+409.309555*T-77.5006*T*LN(T)+83.2265E-3*T**2-25.672833E-6*T**3
|
||
|
+562430*T**(-1); 600.00 Y
|
||
|
-8772.606+102.61162*T-25.8659*T*LN(T)-2.757005E-3*T**2-0.805838E-6*T**3
|
||
|
+172355*T**(-1); 1200.00 Y
|
||
|
-7944.942+101.7776*T-25.9584*T*LN(T)-1.676335E-3*T**2-1.067632E-6*T**3;
|
||
|
1562.00 Y
|
||
|
-265240.309+1456.042685*T-200.2156949*T*LN(T)+41.615159E-3*T**2
|
||
|
-2.044697E-6*T**3+65043790*T**(-1); 3000.00 N !
|
||
|
|
||
|
PARAMETER G(BCC_A2,TB:VA;0) 298.15
|
||
|
-16674.323+406.656848*T-77.5006*T*LN(T)+83.2265E-3*T**2-25.672833E-6*T**3
|
||
|
+562430*T**(-1); 600.00 Y
|
||
|
-4604.771+99.958913*T-25.8659*T*LN(T)-2.757005E-3*T**2-0.805838E-6*T**3
|
||
|
+172355*T**(-1); 1200.00 Y
|
||
|
633060.245-5157.777795*T+706.5805957*T*LN(T)-373.763517E-3*T**2
|
||
|
+34.100235E-6*T**3-103233571*T**(-1); 1562.00 Y
|
||
|
-23398.029+257.388486*T-46.4842*T*LN(T); 3000.00 N !
|
||
|
|
||
|
PARAMETER G(LIQUID,TB;0) 298.15
|
||
|
3945.831+29.867521*T-14.252646*T*LN(T)-20.466105E-3*T**2+2.17475E-6*T**3
|
||
|
-160724*T**(-1); 1562.00 Y
|
||
|
-13247.649+251.16889*T-46.4842*T*LN(T); 3000.00 N !
|
||
|
$ -------------------------------------
|
||
|
|
||
|
$ Tc
|
||
|
$ -------------------------------------
|
||
|
PARAMETER G(HCP_A3,TC:VA;0) 298.15
|
||
|
-7947.794+132.5101*T-24.3394*T*LN(T)-2.954747E-3*T**2+63855*T**(-1); 2430.00 Y
|
||
|
-47759.99+318.286*T-47*T*LN(T)+663.829E30*T**(-9); 4000.00 N !
|
||
|
|
||
|
PARAMETER G(FCC_A1,TC:VA;0) 298.15
|
||
|
2052.206+131.0101*T-24.3394*T*LN(T)-2.954747E-3*T**2+63855*T**(-1); 2430.00 Y
|
||
|
-37759.99+316.786*T-47*T*LN(T)+663.829E30*T**(-9); 4000.00 N !
|
||
|
|
||
|
PARAMETER G(BCC_A2,TC:VA;0) 298.15
|
||
|
10052.206+128.0101*T-24.3394*T*LN(T)-2.954747E-3*T**2+63855*T**(-1); 2430.00 Y
|
||
|
-29759.99+313.786*T-47*T*LN(T)+663.829E30*T**(-9); 4000.00 N !
|
||
|
|
||
|
PARAMETER G(LIQUID,TC;0) 298.15
|
||
|
22454.34+120.1971*T-24.3394*T*LN(T)-2.954747E-3*T**2+63855*T**(-1)
|
||
|
-962.385E-24*T**7; 2430.00 Y
|
||
|
-12221.9+303.7538*T-47*T*LN(T); 4000.00 N !
|
||
|
$ -------------------------------------
|
||
|
|
||
|
$ Te
|
||
|
$ -------------------------------------
|
||
|
$ Data for Te based on published values by Davydov, Rand and Argent
|
||
|
$ CALPHAD, 1995, 19(3), 375
|
||
|
$ Data changed for version 3.00 of database
|
||
|
PARAMETER G(HEXAGONAL_A8,TE;0) 298.15
|
||
|
-10544.679+183.372894*T-35.6687*T*LN(T)+15.83435E-3*T**2-5.240417E-6*T**3
|
||
|
+155015*T**(-1); 722.66 Y
|
||
|
9160.595-129.265373*T+13.004*T*LN(T)-36.2361E-3*T**2+5.006367E-6*T**3
|
||
|
-1286810*T**(-1); 1150.00 Y
|
||
|
-12781.349+174.901226*T-32.5596*T*LN(T); 1600.00 N !
|
||
|
|
||
|
$ Data for Te based on published values by Davydov, Rand and Argent
|
||
|
$ CALPHAD, 1995, 19(3), 375
|
||
|
$ Data changed for version 3.00 of database
|
||
|
PARAMETER G(LIQUID,TE;0) 298.15
|
||
|
-17554.731+685.8776386*T-126.318*T*LN(T)+221.9435E-3*T**2-94.2075E-6*T**3
|
||
|
+827930*T**(-1); 626.49 Y
|
||
|
-3165763.484+46756.3570347*T-7196.41*T*LN(T)+7097.75E-3*T**2
|
||
|
-1306.928333E-6*T**3+258051000*T**(-1); 722.66 Y
|
||
|
180326.959-1500.5790943*T+202.743*T*LN(T)-142.016E-3*T**2+16.129733E-6*T**3
|
||
|
-24238450*T**(-1); 1150.00 Y
|
||
|
6328.687+148.7082987*T-32.5596*T*LN(T); 1600.00 N !
|
||
|
$ -------------------------------------
|
||
|
|
||
|
$ Th
|
||
|
$ -------------------------------------
|
||
|
PARAMETER G(FCC_A1,TH:VA;0) 298.15
|
||
|
-7732.08+116.273975*T-24.841*T*LN(T)-2.36725E-3*T**2-0.52883E-6*T**3
|
||
|
+13010*T**(-1); 1633.00 Y
|
||
|
-37352.871+236.906118*T-39.107*T*LN(T)-3.58025E-3*T**2+0.236893E-6*T**3
|
||
|
+7981000*T**(-1); 2900.00 Y
|
||
|
-33353.313+283.231045*T-46.024*T*LN(T); 4000.00 N !
|
||
|
|
||
|
PARAMETER G(BCC_A2,TH:VA;0) 298.15
|
||
|
-2321.06+133.531195*T-28.244*T*LN(T)+0.43775E-3*T**2-0.53048E-6*T**3
|
||
|
+91190*T**(-1); 1633.00 Y
|
||
|
-115978.348+800.909049*T-116.453*T*LN(T)+30.98E-3*T**2-2.536883E-6*T**3
|
||
|
+27512600*T**(-1); 2023.00 Y
|
||
|
-33602.796+208.774709*T-35.813*T*LN(T)-3.46655E-3*T**2+0.166067E-6*T**3
|
||
|
+11876950*T**(-1); 3600.00 Y
|
||
|
-34333.615+283.181494*T-46.024*T*LN(T); 4000.00 N !
|
||
|
|
||
|
PARAMETER G(LIQUID,TH;0) 298.15
|
||
|
5031.109+110.886346*T-24.987*T*LN(T)-1.68345E-3*T**2-0.909067E-6*T**3
|
||
|
+10865*T**(-1); 1499.80 Y
|
||
|
-15602.847+127.657716*T-24.03*T*LN(T)-13.6421E-3*T**2+1.210117E-6*T**3
|
||
|
+7111100*T**(-1); 2014.50 Y
|
||
|
-17273.382+275.001274*T-46.024*T*LN(T); 4000.00 N !
|
||
|
$ -------------------------------------
|
||
|
|
||
|
$ Ti
|
||
|
$ -------------------------------------
|
||
|
PARAMETER G(HCP_A3,TI:VA;0) 298.15
|
||
|
-8059.921+133.615208*T-23.9933*T*LN(T)-4.777975E-3*T**2+0.106716E-6*T**3
|
||
|
+72636*T**(-1); 900.00 Y
|
||
|
-7811.815+132.988068*T-23.9887*T*LN(T)-4.2033E-3*T**2-0.090876E-6*T**3
|
||
|
+42680*T**(-1); 1155.00 Y
|
||
|
908.837+66.976538*T-14.9466*T*LN(T)-8.1465E-3*T**2+0.202715E-6*T**3
|
||
|
-1477660*T**(-1); 1941.00 Y
|
||
|
-124526.786+638.806871*T-87.2182461*T*LN(T)+8.204849E-3*T**2-0.304747E-6*T**3
|
||
|
+36699805*T**(-1); 4000.00 N !
|
||
|
|
||
|
PARAMETER G(BCC_A2,TI:VA;0) 298.15
|
||
|
-1272.064+134.71418*T-25.5768*T*LN(T)-0.663845E-3*T**2-0.278803E-6*T**3
|
||
|
+7208*T**(-1); 1155.00 Y
|
||
|
6667.385+105.366379*T-22.3771*T*LN(T)+1.21707E-3*T**2-0.84534E-6*T**3
|
||
|
-2002750*T**(-1); 1941.00 Y
|
||
|
26483.26-182.426471*T+19.0900905*T*LN(T)-22.00832E-3*T**2+1.228863E-6*T**3
|
||
|
+1400501*T**(-1); 4000.00 N !
|
||
|
|
||
|
PARAMETER G(LIQUID,TI;0) 298.15
|
||
|
4134.494+126.63427*T-23.9933*T*LN(T)-4.777975E-3*T**2+0.106716E-6*T**3
|
||
|
+72636*T**(-1); 900.00 Y
|
||
|
4382.601+126.00713*T-23.9887*T*LN(T)-4.2033E-3*T**2-0.090876E-6*T**3
|
||
|
+42680*T**(-1); 1155.00 Y
|
||
|
13103.253+59.9956*T-14.9466*T*LN(T)-8.1465E-3*T**2+0.202715E-6*T**3
|
||
|
-1477660*T**(-1); 1300.00 Y
|
||
|
369519.198-2554.0225*T+342.059267*T*LN(T)-163.409355E-3*T**2+12.457117E-6*T**3
|
||
|
-67034516*T**(-1); 1941.00 Y
|
||
|
-19887.066+298.7367*T-46.29*T*LN(T); 4000.00 N !
|
||
|
|
||
|
PARAMETER G(FCC_A1,TI:VA;0) 298.15
|
||
|
-2059.921+133.515208*T-23.9933*T*LN(T)-4.777975E-3*T**2+0.106716E-6*T**3
|
||
|
+72636*T**(-1); 900.00 Y
|
||
|
-1811.815+132.888068*T-23.9887*T*LN(T)-4.2033E-3*T**2-0.090876E-6*T**3
|
||
|
+42680*T**(-1); 1155.00 Y
|
||
|
6908.837+66.876538*T-14.9466*T*LN(T)-8.1465E-3*T**2+0.202715E-6*T**3
|
||
|
-1477660*T**(-1); 1941.00 Y
|
||
|
-118526.786+638.706871*T-87.2182461*T*LN(T)+8.204849E-3*T**2-0.304747E-6*T**3
|
||
|
+36699805*T**(-1); 4000.00 N !
|
||
|
|
||
|
PARAMETER G(CBCC_A12,TI:VA;0) 298.15
|
||
|
-3457.721+133.615208*T-23.9933*T*LN(T)-4.777975E-3*T**2+0.106716E-6*T**3
|
||
|
+72636*T**(-1); 900.00 Y
|
||
|
-3209.615+132.988068*T-23.9887*T*LN(T)-4.2033E-3*T**2-0.090876E-6*T**3
|
||
|
+42680*T**(-1); 1155.00 Y
|
||
|
5511.037+66.976538*T-14.9466*T*LN(T)-8.1465E-3*T**2+0.202715E-6*T**3
|
||
|
-1477660*T**(-1); 1941.00 Y
|
||
|
-119924.586+638.806871*T-87.2182461*T*LN(T)+8.204849E-3*T**2-0.304747E-6*T**3
|
||
|
+36699805*T**(-1); 4000.00 N !
|
||
|
|
||
|
PARAMETER G(CUB_A13,TI:VA;0) 298.15
|
||
|
-528.721+133.615208*T-23.9933*T*LN(T)-4.777975E-3*T**2+0.106716E-6*T**3
|
||
|
+72636*T**(-1); 900.00 Y
|
||
|
-280.615+132.988068*T-23.9887*T*LN(T)-4.2033E-3*T**2-0.090876E-6*T**3
|
||
|
+42680*T**(-1); 1155.00 Y
|
||
|
8440.037+66.976538*T-14.9466*T*LN(T)-8.1465E-3*T**2+0.202715E-6*T**3
|
||
|
-1477660*T**(-1); 1941.00 Y
|
||
|
-116995.586+638.806871*T-87.2182461*T*LN(T)+8.204849E-3*T**2-0.304747E-6*T**3
|
||
|
+36699805*T**(-1); 4000.00 N !
|
||
|
|
||
|
PARAMETER G(DIAMOND_A4,TI;0) 298.15
|
||
|
16940.079+133.615208*T-23.9933*T*LN(T)-4.777975E-3*T**2+0.106716E-6*T**3
|
||
|
+72636*T**(-1); 900.00 Y
|
||
|
17188.185+132.988068*T-23.9887*T*LN(T)-4.2033E-3*T**2-0.090876E-6*T**3
|
||
|
+42680*T**(-1); 1155.00 Y
|
||
|
25908.837+66.976538*T-14.9466*T*LN(T)-8.1465E-3*T**2+0.202715E-6*T**3
|
||
|
-1477660*T**(-1); 1941.00 Y
|
||
|
-99526.786+638.806871*T-87.2182461*T*LN(T)+8.204849E-3*T**2-0.304747E-6*T**3
|
||
|
+36699805*T**(-1); 4000.00 N !
|
||
|
|
||
|
$ Data from COST507 database
|
||
|
PARAMETER G(BCT_A5,TI;0) 298.15
|
||
|
-3457.721+133.615208*T-23.9933*T*LN(T)-4.777975E-3*T**2+0.106716E-6*T**3
|
||
|
+72636*T**(-1); 900.00 Y
|
||
|
-3209.615+132.988068*T-23.9887*T*LN(T)-4.2033E-3*T**2-0.090876E-6*T**3
|
||
|
+42680*T**(-1); 1155.00 Y
|
||
|
5511.037+66.976538*T-14.9466*T*LN(T)-8.1465E-3*T**2+0.202715E-6*T**3
|
||
|
-1477660*T**(-1); 1941.00 Y
|
||
|
-119924.586+638.806871*T-87.2182461*T*LN(T)+8.204849E-3*T**2-0.304747E-6*T**3
|
||
|
+36699805*T**(-1); 3000.00 N !
|
||
|
|
||
|
$ -------------------------------------
|
||
|
|
||
|
$ Tl
|
||
|
$ -------------------------------------
|
||
|
PARAMETER G(HCP_A3,TL:VA;0) 200.00
|
||
|
-8104.038+107.140405*T-25.2274*T*LN(T)-3.3063E-3*T**2-0.121807E-6*T**3
|
||
|
+42058*T**(-1); 577.00 Y
|
||
|
-15406.859+196.771926*T-38.4130658*T*LN(T)+5.228106E-3*T**2-0.519136E-6*T**3
|
||
|
+729665*T**(-1); 1800.00 N !
|
||
|
|
||
|
PARAMETER G(BCC_A2,TL:VA;0) 200.00
|
||
|
-9194.493+150.019517*T-33.0508*T*LN(T)+17.2318E-3*T**2-10.115933E-6*T**3
|
||
|
+82153*T**(-1); 577.00 Y
|
||
|
-41836.403+482.633817*T-79.2926704*T*LN(T)+26.042993E-3*T**2-2.359101E-6*T**3
|
||
|
+3507810*T**(-1); 1800.00 N !
|
||
|
|
||
|
PARAMETER G(LIQUID,TL;0) 200.00
|
||
|
-946.623+0.755649*T-7.44455*T*LN(T)-44.350292E-3*T**2+14.248046E-6*T**3
|
||
|
-54228*T**(-1); 577.00 Y
|
||
|
-614.74+98.472609*T-25.8437*T*LN(T)-0.83662E-3*T**2+0.000009E-6*T**3
|
||
|
-612570*T**(-1); 1800.00 N !
|
||
|
|
||
|
PARAMETER G(FCC_A1,TL:VA;0) 200.00
|
||
|
-7794.038+107.140405*T-25.2274*T*LN(T)-3.3063E-3*T**2-0.121807E-6*T**3
|
||
|
+42058*T**(-1); 577.00 Y
|
||
|
-15096.859+196.771926*T-38.4130658*T*LN(T)+5.228106E-3*T**2-0.519136E-6*T**3
|
||
|
+729665*T**(-1); 1800.00 N !
|
||
|
$ -------------------------------------
|
||
|
|
||
|
$ Tm
|
||
|
$ -------------------------------------
|
||
|
PARAMETER G(HCP_A3,TM:VA;0) 298.15
|
||
|
-10016.715+151.037648*T-34.3664974*T*LN(T)+12.110965E-3*T**2-3.831156E-6*T**3
|
||
|
+95982*T**(-1); 700.00 Y
|
||
|
-14701.965+147.957496*T-32.1951269*T*LN(T)+0.444753E-3*T**2-0.396694E-6*T**3
|
||
|
+1091664*T**(-1); 1600.00 Y
|
||
|
-8669.227+97.98144*T-25.1816969*T*LN(T)-3.384563E-3*T**2; 1818.00 Y
|
||
|
727125.608-4147.400632*T+534.082763*T*LN(T)-190.93039E-3*T**2
|
||
|
+11.689185E-6*T**3-180382220*T**(-1); 2300.00 N !
|
||
|
|
||
|
PARAMETER G(LIQUID,TM;0) 298.15
|
||
|
3182.534+144.479977*T-34.3664974*T*LN(T)+12.110965E-3*T**2-3.831156E-6*T**3
|
||
|
+95982*T**(-1); 600.00 Y
|
||
|
22640.028-126.738485*T+6.8744933*T*LN(T)-25.487085E-3*T**2+2.288172E-6*T**3
|
||
|
-1585412*T**(-1); 1818.00 Y
|
||
|
-10090.305+214.184413*T-41.37976*T*LN(T); 2300.00 N !
|
||
|
|
||
|
$ U
|
||
|
PARAMETER G(ORTHORHOMBIC_A20,U;0) 298.15
|
||
|
-8407.734+130.955151*T-26.9182*T*LN(T)+1.25156E-3*T**2-4.42605E-6*T**3
|
||
|
+38568*T**(-1); 955.00 Y
|
||
|
-22521.8+292.121093*T-48.66*T*LN(T); 3000.00 N !
|
||
|
|
||
|
PARAMETER G(TETRAGONAL_U,U;0) 298.15
|
||
|
-5156.136+106.976316*T-22.841*T*LN(T)-10.84475E-3*T**2+0.027889E-6*T**3
|
||
|
+81944*T**(-1); 941.50 Y
|
||
|
-14327.309+244.16802*T-42.9278*T*LN(T); 3000.00 N !
|
||
|
|
||
|
PARAMETER G(BCC_A2,U:VA;0) 298.15
|
||
|
-752.767+131.5381*T-27.5152*T*LN(T)-8.35595E-3*T**2+0.967907E-6*T**3
|
||
|
+204611*T**(-1); 1049.00 Y
|
||
|
-4698.365+202.685635*T-38.2836*T*LN(T); 3000.00 N !
|
||
|
|
||
|
PARAMETER G(LIQUID,U;0) 298.15
|
||
|
3947.766+120.631251*T-26.9182*T*LN(T)+1.25156E-3*T**2-4.42605E-6*T**3
|
||
|
+38568*T**(-1); 955.00 Y
|
||
|
-10166.3+281.797193*T-48.66*T*LN(T); 3000.00 N !
|
||
|
|
||
|
PARAMETER G(FCC_A1,U:VA;0) 298.15
|
||
|
-3407.734+130.955151*T-26.9182*T*LN(T)+1.25156E-3*T**2-4.42605E-6*T**3
|
||
|
+38568*T**(-1); 955.00 Y
|
||
|
-17521.8+292.121093*T-48.66*T*LN(T); 3000.00 N !
|
||
|
|
||
|
PARAMETER G(HCP_A3,U:VA;0) 298.15 +4247.233+131.5301*T
|
||
|
-27.5152*T*LN(T)-.00835595*T**2+9.67907E-07*T**3+204611*T**(-1);
|
||
|
1049.00 Y
|
||
|
+301.635+202.677635*T-38.2836*T*LN(T); 2500.00 N !
|
||
|
$ -------------------------------------
|
||
|
|
||
|
$ V
|
||
|
$ -------------------------------------
|
||
|
PARAMETER G(BCC_A2,V:VA;0) 298.15
|
||
|
-7930.43+133.346053*T-24.134*T*LN(T)-3.098E-3*T**2+0.12175E-6*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)+644.389E29*T**(-9); 4000.00 N !
|
||
|
|
||
|
PARAMETER G(LIQUID,V;0) 298.15
|
||
|
12833.687+123.890501*T-24.134*T*LN(T)-3.098E-3*T**2+0.12175E-6*T**3
|
||
|
+69460*T**(-1)-519.136E-24*T**7; 790.00 Y
|
||
|
12796.275+133.835541*T-25.9*T*LN(T)+0.0625E-3*T**2-0.68E-6*T**3
|
||
|
-519.136E-24*T**7; 2183.00 Y
|
||
|
-19617.51+311.055983*T-47.43*T*LN(T); 4000.00 N !
|
||
|
|
||
|
PARAMETER G(FCC_A1,V:VA;0) 298.15
|
||
|
-430.43+135.046053*T-24.134*T*LN(T)-3.098E-3*T**2+0.12175E-6*T**3+69460*T**(-1);
|
||
|
790.00 Y
|
||
|
-467.842+144.991093*T-25.9*T*LN(T)+0.0625E-3*T**2-0.68E-6*T**3; 2183.00 Y
|
||
|
-34189.864+322.840783*T-47.43*T*LN(T)+644.389E29*T**(-9); 4000.00 N !
|
||
|
|
||
|
PARAMETER G(HCP_A3,V:VA;0) 298.15
|
||
|
-3930.43+135.746053*T-24.134*T*LN(T)-3.098E-3*T**2+0.12175E-6*T**3
|
||
|
+69460*T**(-1); 790.00 Y
|
||
|
-3967.842+145.691093*T-25.9*T*LN(T)+0.0625E-3*T**2-0.68E-6*T**3; 2183.00 Y
|
||
|
-37689.864+323.540783*T-47.43*T*LN(T)+644.389E29*T**(-9); 4000.00 N !
|
||
|
|
||
|
PARAMETER G(CBCC_A12,V:VA;0) 298.15
|
||
|
1069.57+133.346053*T-24.134*T*LN(T)-3.098E-3*T**2+0.12175E-6*T**3+69460*T**(-1);
|
||
|
790.00 Y
|
||
|
1032.158+143.291093*T-25.9*T*LN(T)+0.0625E-3*T**2-0.68E-6*T**3; 2183.00 Y
|
||
|
-32689.864+321.140783*T-47.43*T*LN(T)+644.389E29*T**(-9); 4000.00 N !
|
||
|
|
||
|
PARAMETER G(CUB_A13,V:VA;0) 298.15
|
||
|
2069.57+133.346053*T-24.134*T*LN(T)-3.098E-3*T**2+0.12175E-6*T**3+69460*T**(-1);
|
||
|
790.00 Y
|
||
|
2032.158+143.291093*T-25.9*T*LN(T)+0.0625E-3*T**2-0.68E-6*T**3; 2183.00 Y
|
||
|
-31689.864+321.140783*T-47.43*T*LN(T)+644.389E29*T**(-9); 4000.00 N !
|
||
|
$ -------------------------------------
|
||
|
|
||
|
$ W
|
||
|
$ -------------------------------------
|
||
|
PARAMETER G(BCC_A2,W:VA;0) 298.15
|
||
|
-7646.311+130.4*T-24.1*T*LN(T)-1.936E-3*T**2+0.207E-6*T**3+44500*T**(-1)
|
||
|
-0.0533E-9*T**4; 3695.00 Y
|
||
|
-82868.801+389.362335*T-54*T*LN(T)+1528.621E30*T**(-9); 6000.00 N !
|
||
|
|
||
|
PARAMETER G(LIQUID,W;0) 298.15
|
||
|
44514.273+116.29001*T-24.1*T*LN(T)-1.936E-3*T**2+0.207E-6*T**3+44500*T**(-1)
|
||
|
-0.0533E-9*T**4-2713.468E-27*T**7; 3695.00 Y
|
||
|
-30436.051+375.175*T-54*T*LN(T); 6000.00 N !
|
||
|
|
||
|
PARAMETER G(FCC_A1,W:VA;0) 298.15
|
||
|
11653.689+131.03*T-24.1*T*LN(T)-1.936E-3*T**2+0.207E-6*T**3+44500*T**(-1)
|
||
|
-0.0533E-9*T**4; 3695.00 Y
|
||
|
-63568.801+389.992335*T-54*T*LN(T)+1528.621E30*T**(-9); 6000.00 N !
|
||
|
|
||
|
PARAMETER G(HCP_A3,W:VA;0) 298.15
|
||
|
7103.689+130.4*T-24.1*T*LN(T)-1.936E-3*T**2+0.207E-6*T**3+44500*T**(-1)
|
||
|
-0.0533E-9*T**4; 3695.00 Y
|
||
|
-68118.801+389.362335*T-54*T*LN(T)+1528.621E30*T**(-9); 6000.00 N !
|
||
|
$ -------------------------------------
|
||
|
|
||
|
$ Y
|
||
|
$ -------------------------------------
|
||
|
$ Data from Huasen Shen, Weijing Zhang, Guoquan Liu, Run Wang and Zhenmin Du
|
||
|
$ Report F-95-03, May 1995, University of Science and Technology, Beijing
|
||
|
PARAMETER G(HCP_A3,Y:VA;0) 100 -8011.09379+128.572856*T-25.6656992*T*LN(T)
|
||
|
-1.75716414E-3*T**2-4.17561786E-7*T**3+26911.509*T**(-1); 1000 Y
|
||
|
-7179.74574+114.497104*T-23.4941827*T*LN(T)-3.8211802E-3*T**2
|
||
|
-8.2534534E-8*T**3; 1795.15 Y
|
||
|
-67480.7761+382.124727*T-56.9527111*T*LN(T)+2.31774379E-3*T**2
|
||
|
-7.22513088E-8*T**3+18077162.6*T**(-1); 3700 N !
|
||
|
|
||
|
$ Data from Huasen Shen, Weijing Zhang, Guoquan Liu, Run Wang and Zhenmin Du
|
||
|
$ Report F-95-03, May 1995, University of Science and Technology, Beijing
|
||
|
PARAMETER G(BCC_A2,Y:VA;0) 100 -833.658863+123.667346*T-25.5832578*T*LN(T)
|
||
|
-2.37175965E-3*T**2+9.10372497E-9*T**3+27340.0687*T**(-1); 1000 Y
|
||
|
-1297.79829+134.528352*T-27.30384768*T*LN(T)-5.41757644E-4*T**2
|
||
|
-3.05012175E-7*T**3; 1795.15 Y
|
||
|
15389.4975+0.981325399*T-8.88296647*T*LN(T)-9.04576576E-3*T**2
|
||
|
+4.02944768E-7*T**3-2542575.96*T**(-1); 3700 N !
|
||
|
|
||
|
$ Data from Huasen Shen, Weijing Zhang, Guoquan Liu, Run Wang and Zhenmin Du
|
||
|
$ Report F-95-03, May 1995, University of Science and Technology, Beijing
|
||
|
PARAMETER G(LIQUID,Y;0) 100 2098.50738+119.418730*T-24.6467508*T*LN(T)
|
||
|
-3.47023463E-3*T**2-8.12981167E-7*T**3+23713.7332*T**(-1); 1000 Y
|
||
|
7386.44846+19.4520171*T-9.06816270*T*LN(T)-1.89533369E-2*T**2
|
||
|
+1.75953270E-6*T**3; 1795.15 Y
|
||
|
-12976.5957+257.400783*T-43.0952000*T*LN(T); 3700 N !
|
||
|
|
||
|
$ Source of data: Assessment of data for the Cu-Y system by Suzana Fries
|
||
|
$ and H L Lukas - private communication
|
||
|
PARAMETER G(FCC_A1,Y:VA;0) 100 -2011.09379+128.572856*T-25.6656992*T*LN(T)
|
||
|
-1.75716414E-3*T**2-4.17561786E-7*T**3+26911.509*T**(-1); 1000 Y
|
||
|
-1179.74574+114.497104*T-23.4941827*T*LN(T)-3.8211802E-3*T**2
|
||
|
-8.2534534E-8*T**3; 1795.15 Y
|
||
|
-61480.7761+382.124727*T-56.9527111*T*LN(T)+2.31774379E-3*T**2
|
||
|
-7.22513088E-8*T**3+18077162.6*T**(-1); 3700 N !
|
||
|
$ -------------------------------------
|
||
|
|
||
|
$ Yb
|
||
|
$ -------------------------------------
|
||
|
PARAMETER G(FCC_A1,YB:VA;0) 298.15
|
||
|
-9370.941+189.327664*T-40.0791*T*LN(T)+42.27115E-3*T**2-22.242E-6*T**3;
|
||
|
553.00 Y
|
||
|
-8192.154+121.065655*T-26.7591*T*LN(T)-2.56065E-3*T**2; 1033.00 Y
|
||
|
16034.89-89.478241*T+2.7623966*T*LN(T)-17.961331E-3*T**2+1.421719E-6*T**3
|
||
|
-3631462*T**(-1); 2000.00 N !
|
||
|
|
||
|
PARAMETER G(BCC_A2,YB:VA;0) 298.15
|
||
|
-965.99-21.293677*T-3.8534432*T*LN(T)-30.009694E-3*T**2+4.743871E-6*T**3
|
||
|
-334650*T**(-1); 1033.00 Y
|
||
|
-13368.113+188.313864*T-36.1079*T*LN(T); 1097.00 Y
|
||
|
-3911.847+113.174165*T-25.7402233*T*LN(T)-4.743348E-3*T**2+0.363044E-6*T**3
|
||
|
-1553668*T**(-1); 2000.00 N !
|
||
|
|
||
|
PARAMETER G(LIQUID,YB;0) 298.15
|
||
|
7030.788-40.615571*T-1.8061816*T*LN(T)-32.50938E-3*T**2+5.136665E-6*T**3
|
||
|
-370554*T**(-1); 1033.00 Y
|
||
|
-6445.835+186.690398*T-36.7774*T*LN(T); 2000.00 N !
|
||
|
$ -------------------------------------
|
||
|
|
||
|
$ Zn
|
||
|
$ -------------------------------------
|
||
|
PARAMETER G(HCP_ZN,ZN:VA;0) 298.15
|
||
|
-7285.787+118.470069*T-23.701314*T*LN(T)-1.712034E-3*T**2-1.264963E-6*T**3;
|
||
|
692.68 Y
|
||
|
-11070.559+172.34566*T-31.38*T*LN(T)+470.514E24*T**(-9); 1700.00 N !
|
||
|
|
||
|
PARAMETER G(HCP_A3,ZN:VA;0) 298.15
|
||
|
-4315.967+116.900389*T-23.701314*T*LN(T)-1.712034E-3*T**2-1.264963E-6*T**3;
|
||
|
692.68 Y
|
||
|
-8100.739+170.77598*T-31.38*T*LN(T)+470.514E24*T**(-9); 1700.00 N !
|
||
|
|
||
|
PARAMETER G(LIQUID,ZN;0) 298.15
|
||
|
-128.574+108.177079*T-23.701314*T*LN(T)-1.712034E-3*T**2-1.264963E-6*T**3
|
||
|
-358.958E-21*T**7; 692.68 Y
|
||
|
-3620.391+161.608594*T-31.38*T*LN(T); 1700.00 N !
|
||
|
|
||
|
PARAMETER G(FCC_A1,ZN:VA;0) 298.15
|
||
|
-4315.967+116.900389*T-23.701314*T*LN(T)-1.712034E-3*T**2-1.264963E-6*T**3;
|
||
|
692.68 Y
|
||
|
-8100.739+170.77598*T-31.38*T*LN(T)+470.514E24*T**(-9); 1700.00 N !
|
||
|
|
||
|
PARAMETER G(BCC_A2,ZN:VA;0) 298.15
|
||
|
-4398.827+115.959669*T-23.701314*T*LN(T)-1.712034E-3*T**2-1.264963E-6*T**3;
|
||
|
692.68 Y
|
||
|
-8183.599+169.83526*T-31.38*T*LN(T)+470.514E24*T**(-9); 1700.00 N !
|
||
|
|
||
|
$ Data from COST507 database
|
||
|
PARAMETER G(BCT_A5,ZN;0) 298.15
|
||
|
-4398.827+115.959669*T-23.701314*T*LN(T)-1.712034E-3*T**2-1.264963E-6*T**3;
|
||
|
692.68 Y
|
||
|
-8183.599+169.83526*T-31.38*T*LN(T)+470.514E24*T**(-9); 1700.00 N !
|
||
|
|
||
|
$ Data from COST507 database
|
||
|
PARAMETER G(DIAMOND_A4,ZN;0) 298.15
|
||
|
-7285.787+148.470069*T-23.701314*T*LN(T)-1.712034E-3*T**2-1.264963E-6*T**3;
|
||
|
692.68 Y
|
||
|
-11070.559+202.34566*T-31.38*T*LN(T)+470.514E24*T**(-9); 1700.00 N !
|
||
|
|
||
|
$ Source of data: Unpublished work by Alan Dinsdale
|
||
|
PARAMETER G(RHOMBOHEDRAL_A7,ZN;0) 298.15
|
||
|
-4985.787+129.970069*T-23.701314*T*LN(T)-1.712034E-3*T**2-1.264963E-6*T**3;
|
||
|
692.68 Y
|
||
|
-8770.559+183.84566*T-31.38*T*LN(T)+470.514E24*T**(-9); 1700.00 N !
|
||
|
|
||
|
$ Souce of data: B J Lee CALPHAD 1996, 20(4), 471-480
|
||
|
PARAMETER G(TETRAGONAL_A6,ZN;0) 298.15
|
||
|
-3101.787+118.470069*T-23.701314*T*LN(T)-1.712034E-3*T**2-1.264963E-6*T**3;
|
||
|
692.68 Y
|
||
|
-6886.559+172.34566*T-31.38*T*LN(T)+470.514E24*T**(-9); 1700.00 N !
|
||
|
|
||
|
$ Source of data: J Miettinen, CALPHAD to be published
|
||
|
PARAMETER G(CUB_A13,ZN:VA;0) 298.15
|
||
|
-5285.787+118.470069*T-23.701314*T*LN(T)-1.712034E-3*T**2-1.264963E-6*T**3;
|
||
|
692.68 Y
|
||
|
-9070.559+172.34566*T-31.38*T*LN(T)+470.514E24*T**(-9); 1700.00 N !
|
||
|
|
||
|
$ Source of data: J Miettinen, CALPHAD to be published
|
||
|
PARAMETER G(CBCC_A12,ZN:VA;0) 298.15
|
||
|
-5285.787+118.470069*T-23.701314*T*LN(T)-1.712034E-3*T**2-1.264963E-6*T**3;
|
||
|
692.68 Y
|
||
|
-9070.559+172.34566*T-31.38*T*LN(T)+470.514E24*T**(-9); 1700.00 N !
|
||
|
|
||
|
$ -------------------------------------
|
||
|
|
||
|
$ Zr
|
||
|
$ -------------------------------------
|
||
|
PARAMETER G(HCP_A3,ZR:VA;0) 130.00
|
||
|
-7827.595+125.64905*T-24.1618*T*LN(T)-4.37791E-3*T**2+34971*T**(-1); 2128.00 Y
|
||
|
-26085.921+262.724183*T-42.144*T*LN(T)-1342.896E28*T**(-9); 6000.00 N !
|
||
|
|
||
|
PARAMETER G(BCC_A2,ZR:VA;0) 298.15
|
||
|
-525.539+124.9457*T-25.607406*T*LN(T)-0.340084E-3*T**2-0.009729E-6*T**3
|
||
|
+25233*T**(-1)-0.076143E-9*T**4; 2128.00 Y
|
||
|
-30705.955+264.284163*T-42.144*T*LN(T)+1276.058E29*T**(-9); 6000.00 N !
|
||
|
|
||
|
PARAMETER G(OMEGA,ZR;0) 298.15
|
||
|
-8878.082+144.432234*T-26.8556*T*LN(T)-2.799446E-3*T**2+38376*T**(-1);
|
||
|
2128.00 Y
|
||
|
-29500.524+265.290858*T-42.144*T*LN(T)+717.445E29*T**(-9); 6000.00 N !
|
||
|
|
||
|
PARAMETER G(LIQUID,ZR;0) 298.15
|
||
|
10320.095+116.568238*T-24.1618*T*LN(T)-4.37791E-3*T**2+34971*T**(-1)
|
||
|
+1627.5E-25*T**7; 2128.00 Y
|
||
|
-8281.26+253.812609*T-42.144*T*LN(T); 6000.00 N !
|
||
|
|
||
|
PARAMETER G(FCC_A1,ZR:VA;0) 298.15
|
||
|
-227.595+124.74905*T-24.1618*T*LN(T)-4.37791E-3*T**2+34971*T**(-1); 2128.00 Y
|
||
|
-18485.921+261.824183*T-42.144*T*LN(T)-1342.896E28*T**(-9); 6000.00 N !
|
||
|
|
||
|
PARAMETER G(CUB_A13,ZR:VA;0) 298.15 -296.395+125.64905*T-24.1618*T*LN(T)
|
||
|
-4.37791E-3*T**2+34971*T**(-1); 2128.00 Y
|
||
|
-18554.721+262.724183*T-42.144*T*LN(T)-1342.896E28*T**(-9); 6000.00 N !
|
||
|
|
||
|
PARAMETER G(CBCC_A12,ZR:VA;0) 298.15 -3225.395+125.64905*T
|
||
|
-24.1618*T*LN(T)-4.37791E-3*T**2+34971*T**(-1); 2128.00 Y
|
||
|
-21483.721+262.724183*T-42.144*T*LN(T)-1342.896E28*T**(-9); 6000.00 N !
|
||
|
|
||
|
PARAMETER G(ORTHORHOMBIC_A20,ZR;0) 298.15 +4474.461+124.9457*T
|
||
|
-25.607406*T*LN(T)-3.40084E-04*T**2-9.729E-09*T**3+25233*T**(-1)
|
||
|
-7.6143E-11*T**4; 2128.00 Y
|
||
|
-25705.955+264.284163*T-42.144*T*LN(T); 2500.00 N !
|
||
|
|
||
|
PARAMETER G(TETRAGONAL_U,ZR;0) 298.15 +4474.461+124.9457*T
|
||
|
-25.607406*T*LN(T)-3.40084E-04*T**2-9.729E-09*T**3+25233*T**(-1)
|
||
|
-7.6143E-11*T**4; 2128.00 Y
|
||
|
-25705.955+264.284163*T-42.144*T*LN(T); 2500.00 N !
|
||
|
$ -------------------------------------
|
||
|
|
||
|
|