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www.thermocalc.com ǀ [email protected] Thermodynamic and Mobility Databases Overview 2016

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www.thermocalc.com ǀ [email protected]

Thermodynamic and Mobility Databases Overview

2016

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Database Overview

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Thermodynamic and Mobility Databases Thermo-Calc Software offers a wide spectrum of high-quality thermodynamic and mobility databases for use with Thermo-Calc, the add-on Diffusion Module (DICTRA) and/or Precipitation Module (TC-PRISMA), as well as SDKs for various applications. The databases supplied by Thermo-Calc Software have all been produced by critical assessments and evaluations based on experimental data.

Contents Steels and Fe-Alloys .............................................................................................................................. 4

TCFE8: TCS Steel and Fe-Alloys Database ................................................................................................................ 4

Nickel-based Alloys............................................................................................................................... 4

TCNI8: TCS Ni-based Superalloys Database ............................................................................................................. 4

Aluminium-based Alloys ....................................................................................................................... 4

TCAL4: TCS Al-based Alloys Database ..................................................................................................................... 4

Copper-based Alloys ............................................................................................................................. 5

TCCU1: TCS Cu-based Alloys Database .................................................................................................................... 5

Magnesium-based Alloys ...................................................................................................................... 5

TCMG4: TCS Mg-based Alloys Database ................................................................................................................. 5

Silicon-based Alloys .............................................................................................................................. 5

TCSI1: TCS Si-based Alloys Database ....................................................................................................................... 5

Solder Alloys ......................................................................................................................................... 6

TCSLD3: TCS Solder Alloy Solutions Database ......................................................................................................... 6

High Entropy Alloys .............................................................................................................................. 6

TCHEA1: TCS High Entropy Alloy Database ............................................................................................................. 6

General Alloys ...................................................................................................................................... 6

SSOL6: SGTE Solutions Database ............................................................................................................................. 6

Compounds .......................................................................................................................................... 7

SSUB5: SGTE Substances Database ......................................................................................................................... 7

Specific Materials ................................................................................................................................. 7

TCCC1: Cemented Carbides Database ..................................................................................................................... 7

SEMC2: TCS Semiconductors Database ................................................................................................................... 7

STBC2: SGTE Thermal Barrier Coating Database ..................................................................................................... 8

TCSC1: TCS Super Conductor Database ................................................................................................................... 8

TCFC1: TCS Solid Oxide Fuel Cell Database .............................................................................................................. 8

Metallurgical & Materials Processing & Environmental Applications .................................................... 9

TCMP2: TCS Materials Processing Database ........................................................................................................... 9

TCES1: TCS Sintering/Incineration/Combustion Database ...................................................................................... 9

Slag, Molten Salts, Oxides and Ionic Solutions ...................................................................................... 9

SLAG4: TCS Fe-containing Slag Database ................................................................................................................ 9

TCOX6: TCS Metal Oxide Solutions Database ........................................................................................................ 10

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SALT1: SGTE Molten Salts Database...................................................................................................................... 10

Aqueous Solutions .............................................................................................................................. 10

TCAQ2: TCS Aqueous Solution Database ............................................................................................................... 10

AQS2: TCS Aqueous Solution Database ................................................................................................................. 11

Nuclear Materials ............................................................................................................................... 11

MEPH11: IRSN Nuclear Fuels Database ................................................................................................................. 11

NUCL10: IRSN Nuclear Alloys-Oxides Database .................................................................................................... 11

NUMT2: TCS/AEAT Pure Radionuclides Database ................................................................................................. 12

NUOX4: TCS/AEAT Nuclear Oxides Database ........................................................................................................ 12

Minerals ............................................................................................................................................. 12

GCE2: TCS Geochemical/Environmental Database ............................................................................................... 12

Thermotech Ltd. Databases ................................................................................................................ 13

TTAL8: Thermotech Al-based Alloys Database ...................................................................................................... 13

TTMG5: Thermotech Mg-based Alloys Database .................................................................................................. 13

TTNI8: Thermotech Ni-based Superalloys Database ............................................................................................. 13

TTTI3: Thermotech Ti-based Alloys Database ....................................................................................................... 14

TTTIAL1: Thermotech TiAl-based Alloys Database ................................................................................................ 14

TTZR1: Thermotech Zr-based Alloys Database ...................................................................................................... 14

Mobility Databases for Steels and Fe Alloys ....................................................................................... 15

MOBFE3: TCS Steels/Fe-Alloys Mobility Database ................................................................................................ 15

MOB2: TCS Alloys Mobility database .................................................................................................................... 15

Mobility Databases for Ni Alloys ......................................................................................................... 16

MOBNI1: TCS Ni-alloys Mobility Database ............................................................................................................ 16

MOBNI4: TCS Ni-alloys Mobility Database ............................................................................................................ 16

Mobility Databases for Al Alloys ......................................................................................................... 17

MOBAL1: TCS Al-alloys Mobility Database ............................................................................................................ 17

MOBAL3: TCS Al-alloys Mobility Database ............................................................................................................ 17

Mobility Database for Mg Alloys ........................................................................................................ 18

MOBMG1: TCS Mg-alloys Mobility Database ........................................................................................................ 18

Mobility Database for Ti Alloys ........................................................................................................... 18

MOBTI1: TCS Ti-alloys Mobility Database ............................................................................................................. 18

Mobility Database for Si Alloys ........................................................................................................... 19

MOBSI1: TCS Si-alloys Mobility Database ............................................................................................................. 19

Mobility Database for Cu Alloys .......................................................................................................... 19

MOBCU1: TCS Cu Alloys Mobility Database .......................................................................................................... 19

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Steels and Fe-Alloys TCFE8: TCS Steel and Fe-Alloys Database

Database name: TCS Steel and Fe-Alloys Database Version: 8.0

Database acronym: TCFE8 Database Segment: Iron and Steel alloys

Elements: 27

Binaries Assessed: 10 Ternaries Assessed: 10 Phases Assessed: 10

Brief description: TCFE8 Steel and Fe-alloys database for Thermo-Calc. TCFE8 can be used also with the Software Development Kits (SDKs) and the add-on Diffusion Module (DICTRA) and/or Precipitation Module (TC-PRISMA). Includes molar volume data for all phases.

Applications: Steel and Fe-alloy design and engineering.

Included Elements:

Ar Al B C Ca Co Cr Cu Fe H Mg Mn Mo N Nb Ni O

P S Si Ta Ti V W Y Zn Zr

Nickel-based Alloys TCNI8: TCS Ni-based Superalloys Database

Database name: TCS Ni-based Superalloys Database Version: 8.0

Database acronym: TCNI8 Database Segment: Nickel-based superalloys

Elements: 27

Brief description: TCNI8 contains all the important Ni-based superalloy phases within a 25-element framework + Ar and H for the gas phase only. The ordered and disordered bcc (A2 and B2) and fcc (A1/γ and L12/γ´) have been modelled with a two sub-lattice model using a single Gibbs energy curve. TCNI8 can be used with Thermo-Calc, the Software Development Kits (SDKs), and the add-on Diffusion Module (DICTRA) and/or Precipitation Module (TC-PRISMA).

Applications: Ni-based superalloys design and engineering.

Included Elements:

Al Ar B C Co Cr Cu Fe H Hf Mn Mo N Nb Ni O Pd

Pt Re Ru Si Ta Ti V W Y Zr

Aluminium-based Alloys TCAL4: TCS Al-based Alloys Database

Database name: TCS Al-based Alloys Database Version: 4.0

Database acronym: TCAL4 Database Segment: Aluminum-based alloys

Elements: 34

Brief description: TCAL4 contains nearly all the stable phases and most important metastable phases (or precipitates) in the assessed systems within a 34-element framework. It can be employed to a wide range of compositions from pure Al to very complex commercial aluminium alloys. TCAL4 can be used with Thermo-Calc and the add-on Diffusion Module (DICTRA) and/or Precipitation Module (TC-PRISMA).

Applications: Al-based alloy design and engineering.

Included Elements:

Ag Al B Be Bi C Ca Cd Ce Co Cr Cu Fe Ga Ge H Hf

In K La Li Mg Mn Na Ni Pb Sc Si Sn Sr Ti V Zn Zr

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Copper-based Alloys TCCU1: TCS Cu-based Alloys Database

Database name: TCS Cu-based Alloys Database Version: 1.0

Database acronym: TCCU1 Database Segment: Copper-based alloys

Elements: 27

Brief description: TCCU1 contains most of the important Cu-based alloy phases within a 27-element framework. It can be used with Thermo-Calc and the add-on Diffusion Module (DICTRA) and/or Precipitation Module (TC-PRISMA) for a wide range of compositions from pure Cu to complex commercial copper alloys.

Applications: Cu-based alloys design and processing.

Included Elements:

Ag Al Au As B Be Bi C Ca Cd Co Cr Cu Fe Mg Mn Nb

Ni P Pb Pt Se Si Sn Ti Zn Zr

Magnesium-based Alloys TCMG4: TCS Mg-based Alloys Database

Database name: TCS Mg-based Alloys Database Version: 4.0

Database acronym: TCMG4 Database Segment: Magnesium-based alloys

Elements: 24

Brief description: TCMG4 contains all the important Mg-based alloy phases within a 24-element framework. It can be used with Thermo-Calc and the add-on Diffusion Module (DICTRA) and/or Precipitation Module (TC-PRISMA) for a wide range of compositions from pure Mg to very complex commercial magnesium alloys.

Applications: Mg-based alloy design and engineering.

Included Elements:

Ag Al Ca Ce Cu Fe Gd K La Li Mg Mn Na Nd Ni Pt Sc

Si Sn Sr Th Y Zn Zr

Silicon-based Alloys TCSI1: TCS Si-based Alloys Database

Database name: TCS Si-based Alloys Database Version: 1.2

Database acronym: TCSI1 Database Segment: Silicon-based alloys

Elements: 34

Brief description: TCSI1 focuses on the impurity solubility in silicon with diamond structure within a 34-element framework. Besides the diamond phase, at least the liquid and the corresponding stable silicide phase with highest Si content are included in each Si-containing binary. The database can also be used with the add-on Diffusion Module (DICTRA) and/or Precipitation Module (TC-PRISMA).

Applications: Solar grade silicon materials.

Included Elements:

Ag Al As Au B Bi C Ca Co Cr Cu Fe Ga Ge In Li Mg

Mn Mo N Na Ni O P S Sb Si Sn Te Ti V W Zn Zr

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Solder Alloys TCSLD3: TCS Solder Alloy Solutions Database

Database name: TCS Solder Alloy Solutions Database Version: 3.1.1

Database acronym: TCSLD3 Database Segment: Solder alloys

Elements: 20

Brief description: TCSLD3 was developed for thermodynamic calculations of Sn-/Au-/Bi-/Zn-based solder systems (Pb-containing/Pb-free). It can be used with Thermo-Calc and the add-on Diffusion Module (DICTRA) and/or Precipitation Module (TC-PRISMA). TCSLD3 contains all the important solder alloy phases within a 20-element framework.

Applications: Solder alloys design and engineering.

Included Elements:

Ag Al Au Bi Cd Co Cu Ga Ge In Mg Mn Ni Pb Pd Pt Sb

Si Sn Zn

High Entropy Alloys TCHEA1: TCS High Entropy Alloy Database

Database name: TCS High Entropy Alloy Database Version: 1.0

Database acronym: TCHEA1 Database Segment: High Entropy alloys

Elements: 15

Brief description: TCHEA1 has been developed within a 15-element framework and contains nearly all the stable phases in the assessed systems. It can be employed to a wide range of compositions of multi-component systems.

Applications: High entropy alloys (aka. multi-principal element alloys) design and engineering

Included Elements:

Al Co Cr Cu Fe Hf Mn Mo Nb Ni Ta Ti V W Zr

General Alloys SSOL6: SGTE Solutions Database

Database name: SGTE Solutions Database Version: 6.0

Database acronym: SSOL6 Database Segment: Solutions

Elements: 79

Brief description: The SSOL6 Solutions Database is a sophisticated important thermochemical database for many non-ideal multicomponent solution phases. The database is designed for Thermo-Calc, the Software Development Kits (SDKs) and the add-on Diffusion Module (DICTRA) and/or Precipitation Module (TC-PRISMA).

Applications: Alloy design and engineering; Inorganic materials.

Included Elements:

Ag Al Am As Au B Ba Be Bi C Ca Cd Ce Co Cr Cs Cu

Dy Er Eu Fe Ga Gd Ge H Hf Hg Ho In Ir K La Li Lu

Mg Mn Mo N Na Nb Nd Ni Np O Os P Pa Pb Pd Pr Pt

Pu Rb Re Rh Ru S Sb Sc Se Si Sm Sn Sr Ta Tb Tc Te

Th Ti Tl Tm U V W Y Yb Zn Zr

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Compounds SSUB5: SGTE Substances Database

Database name: SGTE Substances Database Version: 5.2

Database acronym: SSUB5 Database Segment: Substances & gaseous species

Elements: 101

Brief description: The SSUB5 Substances Database is a large thermochemical database containing 5580 pure condensed compounds or gaseous species. SSUB5 is designed for use with Thermo-Calc and the Software Development Kits (SDKs).

Applications: Alloy and process design and engineering; Inorganic materials; gas phase chemistry; Solid-melts-aqueous interactions.

Included Elements:

Ac Ag Al Am Ar As At Au B Ba Be Bi Br C Ca Cd Ce

Cf Cl Cm Co Cr Cs Cu Dy Er Es Eu F Fe Fm Fr Ga Gd

Ge H He Hf Hg Ho I In Ir K Kr La Li Lu Mg Mn Mo

N Na Nb Nd Ne Ni Np O Os P Pa Pb Pd Pm Po Pr Pt

Pu Ra Rb Re Rh Rn Ru S Sb Sc Se Si Sm Sn Sr Ta Tb

Tc Te Th Ti Tl Tm U V W Xe Y Yb Zn Zr D T

Specific Materials TCCC1: Cemented Carbides Database

Database name: TCS Cemented Carbides Database Version: 1.0

Database acronym: TCCC1 Database Segment: Cemented Carbides

Elements: 13

Brief description: TCCC1 is a cemented carbide -alloys database for Thermo-Calc. TCCC can also be used with the Software Development Kits (SDKs) and the add-on Diffusion Module (DICTRA) and/or Precipitation Module (TC-PRISMA).

Applications: Design, development and engineering of cemented carbides.

Included Elements:

C Co Cr Fe Mo N Nb Ni Ta Ti V W Zr

SEMC2: TCS Semiconductors Database

Database name: TCS Semiconductors Database Version: 2.0

Database acronym: SEMC2 Database Segment: Semiconductors

Elements: 10

Brief description: Database for semiconductor engineering.

Applications: Semi-conductors design and engineering, electronic components processing and utility.

Included Elements:

Al As C Ga H In P Pb Sb Sn

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STBC2: SGTE Thermal Barrier Coating Database

Database name: SGTE Thermal Barrier Coating Database Version: 2.2

Database acronym: STBC2 Database Segment: Thermal Barrier Coatings

Elements: 5

Brief description: STBC2 can be applied in many different fields of technology [for instance, yttria-stabilised-zirconia (YSZ), solid electrolyte (fluorite), thermal barrier coating (TBC using tetragonal oxides), and so forth], and most importantly the use of this database can further enhance such technologies.

Applications: Research, design and engineering of thermal barrier coatings.

Included Elements:

Al Gd O Y Zr

TCSC1: TCS Super Conductor Database

Database name: TCS Super Conductor Database Version: 1.0

Database acronym: TCSC1 Database Segment: Ionic Solutions

Elements: 6

Brief description: TCSC1 is intended for superconducting materials, but also for other oxide calculations.

Applications: Superconducting materials.

Included Elements:

Ag Bi Ca Cu O Sr

TCFC1: TCS Solid Oxide Fuel Cell Database

Database name: TCS Solid Oxide Fuel Cell Database Version: 1.0

Database acronym: TCFC1 Database Segment: Ionic Solutions

Elements: 6

Brief description: TCFC1 is intended for solid oxide fuel cell (SOFC) materials, but also for other oxide calculations.

Applications: Solid oxide fuel cells.

Included Elements:

La Mn O Sr Y Zr

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Metallurgical & Materials Processing & Environmental Applications TCMP2: TCS Materials Processing Database

Database name: TCS Materials processing database Version: 2.5

Database acronym: TCMP2 Database Segment: Metals Processing

Elements: 35

Brief description: TCMP2 is a database for liquid slag, metallic liquid, various solid phases and gaseous species.

Applications: Materials processing and environmental controls in steel/alloy production and metallurgical engineering, environment-friendly recycling / re-melting / re-processing treatments of industrial, chemical and nuclear wastes, as well as sintering, incineration and combustion processes.

Included Elements:

Ag Al Ar B Bi C Ca Cd Cl Co Cr Cu F Fe H K Mg

Mn Mo N Na Nb Ni O P Pb S Sb Si Sn Ti U W V

Zn

TCES1: TCS Sintering/Incineration/Combustion Database

Database name: TCS Sintering/Incineration/Combustion Database Version: 1.1

Database acronym: TCES1 Database Segment: Metals Processing

Elements: 30

Brief description: TCES1 is a database for solid phases and gaseous species.

Applications: Environmental controls in steel and alloy production and metallurgical engineering, environment-friendly treatments of industrial waste and nuclear waste.

Included Elements:

Al As Br C Ca Cd Cl Cr Cu F Fe H Hg I K Mg Mn

N Na Ni O P Pb S Sb Si Sn Te Ti Zn

Slag, Molten Salts, Oxides and Ionic Solutions SLAG4: TCS Fe-containing Slag Database

Database name: TCS Fe-containing Slag Database Version: 4.0

Database acronym: SLAG4 Database Segment: Iron containing slag

Elements: 30

Brief description: SLAG4 is a database for liquid slag phase, Fe-rich liquid phase (dilute solution), pure FeO liquid phase, a large gaseous mixture phase, and many stoichiometric solids and solid solution phases (e.g., oxides, silicates, sulfides, phosphates, halites, etc.).

Applications: Metallurgy, alloy design and engineering.

Included Elements:

Ag Al Ar B C Ca Co Cr Cu F Fe H Mg Mn Mo N Na

Nb Ni O P Pb S Si Sn Ti U W V Zr

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TCOX6: TCS Metal Oxide Solutions Database

Database name: TCS Metal Oxide Solutions Database Version: 6.0

Database acronym: TCOX6 Database Segment: Ionic Solutions

Elements: 12

Brief description: TCOX6 contains critically assessed data for many multicomponent oxides, as well as all alloy phases needed to calculate the Me-O binary phase diagrams. The intended application is for solid and liquid oxide materials, such as development of ceramics, metallurgical processing and materials corrosion, but the database is of course not limited to this. TCOX6 can also be used with the Software Development Kits (SDKs) and the add-on Diffusion Module (DICTRA) and/or Precipitation Module (TC-PRISMA). The TCOX database was called ION prior to version 4.0.

Applications: Ceramics, metallurgical processing, corrosion, Thermal Barrier Coatings (TBC), Yttria-Stabilised-Zirconia (YSZ).

Included Elements:

Al C Ca Cr Fe Mg Mn Ni O Si Y Zr

SALT1: SGTE Molten Salts Database

Database name: SGTE Molten Salts Database Version: 1.2

Database acronym: SALT1 Database Segment: Corrosion and Salts

Elements: 17

Brief description: SALT1 is a database for molten salts.

Applications: Hot salt corrosion of alloys, high energy lamp design and more.

Included Elements:

Br C Ca Cl Cr Cs F H I K Li Mg Na O Rb S Zn

Aqueous Solutions TCAQ2: TCS Aqueous Solution Database

Database name: TCS Aqueous Solution Database Version: 2.6

Database acronym: TCAQ2 Database Segment: Aqueous Solutions

Elements: 75

Brief description: TCAQ2 is a database suitable for calculating thermodynamic properties of complex aqueous solution phases.

Applications: Materials corrosion processes; hydro-metallurgy, aqueous chemistry, geochemistry and environmental chemistry.

Included Elements:

Ag Al Ar As Au B Ba Be Br C Ca Cd Ce Cl Co Cr Cs

Cu Dy Er Eu F Fe Ga Gd H He Hg Ho I In K Kr La

Li Lu Mg Mn Mo N Na Nd Ne Ni O Os P Pb Pd Pr Pt

Ra Rb Re Ru S Sb Sc Se Si Sm Sn Sr Tb Te Th Tl Tm

U W V Xe Y Yb Zn

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AQS2: TCS Aqueous Solution Database

Database name: TCS Aqueous Solution Database Version: 2.6

Database acronym: AQS2 Database Segment: Aqueous solutions

Elements: 82

Brief description: AQS2 is a database suitable for calculating thermodynamic properties of complex aqueous solution phases.

Applications: Materials corrosion processes; hydro-metallurgy, aqueous chemistry, geochemistry and environmental chemistry.

Included Elements:

Ag Al Ar As Au B Ba Be Bi Br C Ca Cd Ce Cl Co Cr

Cs Cu Dy Er Eu F Fe Fr Ga Gd H He Hf Hg Ho I In

K Kr La Li Lu Mg Mn Mo N Na Nb Nd Ne Ni O P Pb

Pd Pm Pr Pt Ra Rb Re Rh Rn Ru S Sb Sc Se Si Sm Sn

Sr Tb Tc Th Tl Tm U W V Xe Y Yb Zn Zr

Nuclear Materials MEPH11: IRSN Nuclear Fuels Database

Database name: Thermodata Nuclear Fuels Database Version: 11.2

Database acronym: MEPH11 Database Segment: Nuclear Fuels

Elements: 15

Brief description: MEPH11 is a database for nuclear fuels.

Applications: Multiphase equilibria calculations in nuclear fuels and development of new generation nuclear fuels.

Included Elements:

Ar Ba C Cs Fe H La Mo O Pu Ru Si Sr U Zr

NUCL10: IRSN Nuclear Alloys-Oxides Database

Database name: Thermodata Nuclear Alloy-Oxides Database Version: 10.2

Database acronym: NUCL10 Database Segment: Nuclear Applications

Elements: 20

Brief description: NUCL10 is a database for in- and ex-vessel applications.

Applications: This database covers the entire field from metal to oxide domains. It allows the user to calculate the thermochemical equilibrium state at any step of a severe accident and to use the results of the thermodynamic approach for improving the predictions of thermo-hydraulic or other accidents codes.

Included Elements:

Ag Al Ar B Ba C Ca Cr Fe H In La Mg Ni O Ru Si

Sr U Zr

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NUMT2: TCS/AEAT Pure Radionuclides Database

Database name: TCS/AEAT Pure Radionuclides Database Version: 2.1

Database acronym: NUMT2 Database Segment: Nuclear Materials

Elements: 44

Brief description: NUMT2 is a database for about 600 condensed and gas phase substances, including pure radio nuclides.

Applications: This database can be applied to a wide range of nuclear related applications, which can be modelled adequately, or to a first approximation, using pure substances. However, it can also be coupled with other pure substance databases (e.g. SSUB) or solution databases (e.g. NUOX, SSOL and TCFE) to increase the range of applications which can be studied.

Included Elements:

Ag Al Am B Ba Bi C Ca Cd Ce Cl Co Cr Cs Eu F Fe

H I In Kr La Mg Mn Mo Na Nb Nd Ni O Pd Pr Pu Rh

Ru Sb Si Sn Sr Tc Te U Xe Zr

NUOX4: TCS/AEAT Nuclear Oxides Database

Database name: TCS/AEAT Nuclear Oxides Database Version: 4.2

Database acronym: NUOX4 Database Segment: Nuclear Materials

Elements: 11

Brief description: NUOX4 is a database for nuclear oxide solution system, gas excluded.

Applications: This database has been developed primarily for studying molten core-concrete interactions. However, it can also be applied to any relevant system or application which comprises essentially the constituent oxides. It can also be coupled with pure substance databases (e.g. NUMT and SSUB) or solution databases (e.g. SSOL and TCFE) to increase the range of applications which can be studied.

Included Elements:

Al Ba Ca Ce La Mg O Si Sr U Zr

Minerals GCE2: TCS Geochemical/Environmental Database

Database name: TCS Geochemical/Environmental Database Version: 2.3

Database acronym: GCE2 Database Segment: Geochemistry and Environment

Elements: 46

Brief description: GCE2 is a database for about 600 minerals.

Applications: Geochemistry, geophysics, hydro-metallurgy, aqueous chemistry and environmental chemistry.

Included Elements:

Ag Al Ar As Au B Ba Be Br C Ca Cd Cl Co Cr Cs Cu

F Fe Ga Gd H Hg I K Li Mg Mn Mo N Na Ni O P

Pb Rb S Se Si Sn Sr Ti U W V Zn

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Thermotech Ltd. Databases TTAL8: Thermotech Al-based Alloys Database

Database name: Thermotech Al-based Alloys Database Version: 8.1

Database acronym: TTAL8 Database Segment: Aluminum based alloys

Elements: 25

Brief description: A comprehensive database for Al-alloys that can be used for all major types of commercial Al-alloys ranging from commercial pure Al to complex alloys.

Applications: Al-based alloy design and engineering.

Included Elements:

Al B Bi C Ca Co Cr Cu Fe H La Li Mg Mn Mo Ni Pb

Sc Si Sn Sr Ti V Zn Zr

TTMG5: Thermotech Mg-based Alloys Database

Database name: Thermotech Mg-based Alloys Database Version: 5.1

Database acronym: TTMG5 Database Segment: Magnesium-based alloys

Elements: 17

Brief description: A comprehensive database for Mg-alloys that can be used for all major types of commercial Mg-alloys ranging from pure Mg to complex commercial alloys.

Applications: Mg-based alloy design and engineering.

Included Elements:

Al Ca Ce Cu Fe Gd La Mg Mn Nd Sc Si Sn Sr Y Zn Zr

TTNI8: Thermotech Ni-based Superalloys Database

Database name: Thermotech Ni-based Superalloys Database Version: 8.0

Database acronym: TTNI8 Database Segment: Nickel-based superalloys

Elements: 23

Brief description: Database for commercial Ni-based superalloys, high Fe-containing and single crystal Ni-based superalloys.

Applications: Ni-based superalloy design and engineering.

Included Elements:

Al B C Co Cr Cu Fe Hf Mn Mo N Nb Ni O Pt Re Ru

Si Ta Ti W V Zr

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TTTI3: Thermotech Ti-based Alloys Database

Database name: Thermotech Ti-based Alloys Database Version: 3.0

Database acronym: TTTI3 Database Segment: Titanium-based alloys

Elements: 21

Brief description: A comprehensive database for Ti-alloys that can be used for all major types of commercial Ti-alloys ranging from commercial pure Ti to complex alloys.

Applications: Ti- and TiAl-based alloy design and engineering.

Included Elements:

Al B C Cr Cu Fe H Mn Mo N Nb Ni O Re Ru Si Sn

Ta Ti V Zr

TTTIAL1: Thermotech TiAl-based Alloys Database

Database name: Thermotech TiAl-based Alloys Database Version: 1.0

Database acronym: TTTIAL1 Database Segment: High Al-containing Ti-alloys

Elements: 13

Brief description: To be used for the prediction of stable and metastable phase equilibria in multicomponent γ-TiAl based alloys.

Applications: TiAl-based alloy design and engineering.

Included Elements:

Al B Cr Mn Mo Nb O Si Ta Ti W V Zr

TTZR1: Thermotech Zr-based Alloys Database

Database name: Thermotech Zr-based Alloys Database Version: 1.0

Database acronym: TTZR1 Database Segment: Zirconium-based alloys

Elements: 12

Brief description: A comprehensive database for Zr-alloys that can be used for major types of commercial Zr-alloys.

Applications: Zr-based alloy design and engineering.

Included Elements:

C Cr Fe H Hf N Nb Ni O Si Sn Zr

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Mobility Databases for Steels and Fe Alloys MOBFE3: TCS Steels/Fe-Alloys Mobility Database

Database name: TCS Steels/Fe-Alloys Mobility Database Version: 3.0

Database acronym: MOBFE3 Database Segment: Iron and Steel

Elements: 25

Brief description: MOBFE3 is a kinetic database containing mobility data limited to Fe-based alloys. Data is present in a format suitable for simulation of diffusion controlled phenomena using the Software Development Kits (SDKs) and the add-on Diffusion Module (DICTRA) and/or Precipitation Module (TC-PRISMA). MOBFE3 is compatible and recommended for use in combination with the TCFE8 (TCS Steels/Fe-Alloys Database) thermodynamic database.

Applications: Primarily for aiding alloy design and the optimization of manufacturing processes, through simulation of different diffusion controlled phenomena, such as e.g. microsegregation during solidification, homogenisation, kinetics of phase transformations, precipitate growth/dissolution kinetics, carburization, nitriding and much more.

Included Elements:

Al B C Ca Co Cr Cu Fe Mg Mn Mo N Nb Ni O P S

Si Ta Ti W V Y Zn Zr

MOB2: TCS Alloys Mobility database

Database name: TCS Alloys Mobility Database Version: 2.7

Database acronym: MOB2 Database Segment: Iron and Steel

Elements: 75

Brief description: MOB2 is a kinetic database containing mobility data primarily but not limited to Fe-based alloys. Data is present in a format suitable for simulation of diffusion controlled phenomena using the Software Development Kits (SDKs) and the add-on Diffusion Module (DICTRA) and/or Precipitation Module (TC-PRISMA). MOB2 is compatible and recommended for use in combination with the SSOL (SGTE Solution Database) thermodynamic database.

Applications: Primarily for aiding alloy design and the optimization of manufacturing processes, through simulation of different diffusion controlled phenomena, such as e.g. microsegregation during solidification, homogenisation, kinetics of phase transformations, precipitate growth/dissolution kinetics, carburization, nitriding and much more.

Included Elements:

Ag Al Am As Au B Ba Be Bi C Ca Cd Co Cr Cs Cu Dy

Er Fe Ga Gd Ge Hf Hg Ho In Ir K La Li Lu Mg Mn Mo

N Na Nb Nd Ni Np Os P Pa Pb Pd Pr Pt Pu Rb Re Rh

Ru S Sb Sc Se Si Sm Sn Sr Ta Tb Tc Te Th Ti Tl Tm

U V W Y Yb Zn Zr

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Mobility Databases for Ni Alloys MOBNI1: TCS Ni-alloys Mobility Database

Database name: TCS Ni-alloys Mobility Database Version: 1.0

Database acronym: MOBNI1 Database Segment: Nickel-based Superalloys

Elements: 22

Brief description: MOBNI1 is a kinetic database containing mobility data for Ni-based alloys present in a format suitable for simulation of diffusion controlled phenomena using the Software Development Kits (SDKs) and the add-on Diffusion Module (DICTRA) and/or Precipitation Module (TC-PRISMA).

Applications: Used together with the add-on modules and a thermodynamic database for Ni-based alloys (e.g. TTNI), then the MOBNI1 database can be used in order to study several different phenomena of interest to Ni-based superalloys design and manufacturing, such as e.g. microsegregation during solidification, homogenisation kinetics, precipitate growth/dissolution kinetics, interdiffusion in Ni-base superalloy coating/substrate compounds, and much more.

Included Elements:

Al B C Co Cr Cu Fe Hf Mn Mo N Nb Ni O Re Ru Si

Ta Ti W V Zr

MOBNI4: TCS Ni-alloys Mobility Database

Database name: TCS Ni-alloys Mobility Database Version: 4.0

Database acronym: MOBNI4 Database Segment: Nickel-based Superalloys

Elements: 25

Brief description: MOBNI4 is a kinetic database containing mobility data for Ni-based alloys presented in a format suitable for simulation of diffusion controlled phenomena using the Software Development Kits (SDKs) and the add-on Diffusion Module (DICTRA) and/or Precipitation Module (TC-PRISMA).

MOBNI4 is compatible and primarily recommended for use in combination with the TCNI8 thermodynamic database.

Applications: Used together with the add-on modules and a thermodynamic database for Ni-based alloys (e.g. TCNI8), then the MOBNI4 database can be used in order to study several different phenomena of interest to Ni-based superalloys design and manufacturing, such as e.g. microsegregation during solidification, homogenisation kinetics, precipitate growth/dissolution kinetics, interdiffusion in Ni-base superalloy coating/substrate compounds, and much more.

Included Elements:

Al B C Co Cr Cu Fe Hf Mo Mn N Nb Ni O Pd Pt Re

Ru Si Ta Ti V W Y Zr

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Mobility Databases for Al Alloys MOBAL1: TCS Al-alloys Mobility Database

Database name: TCS Al-alloys Mobility Database Version: 1.0

Database acronym: MOBAL1 Database Segment: Aluminium Alloys

Elements: 41

Brief description: MOBAL1 is a kinetic database containing mobility data for Al-based alloys present in a format suitable for simulation of diffusion controlled phenomena using the Software Development Kits (SDKs) and the add-on Diffusion Module (DICTRA) and/or Precipitation Module (TC-PRISMA).

Applications: Used together with the add-on modules and a thermodynamic database for Al-alloys (e.g. TTAL) the MOBAL1 database can be used in order to study several different phenomena of interest to aluminium alloys, such as e.g. microsegregation during solidification, homogenisation kinetics, growth/dissolution kinetics of precipitates, interdiffusion in Al-compounds, and much more.

Included Elements:

Ag Al Au B Be C Ca Cd Ce Co Cr Cs Cu Fe Ga Ge H

In La Li Mg Mn Mo Na Nb Nd Ni Pb Pd Pr Sb Sc Si Sm

Sn Sr Ti Tl V Zn Zr

MOBAL3: TCS Al-alloys Mobility Database

Database name: TCS Al-alloys Mobility Database Version: 3.0

Database acronym: MOBAL3 Database Segment: Aluminium Alloys

Elements: 34

Brief description: MOBAL3 is a kinetic database containing mobility data for Al-based alloys present in a format suitable for simulation of diffusion controlled phenomena using the Software Development Kits (SDKs) and the add-on Diffusion Module (DICTRA) and/or Precipitation Module (TC-PRISMA).

MOBAL3 is compatible and primarily recommended for use in combination with the TCAL4 thermodynamic database.

Applications: Used together with the add-on modules and a thermodynamic database for Al-alloys (e.g. TCAL4) the MOBAL3 database can be used in order to study several different phenomena of interest to aluminium alloys, such as e.g. microsegregation during solidification, homogenisation kinetics, growth/dissolution kinetics of precipitates, interdiffusion in Al-compounds, and much more.

Included Elements:

Ag Al B Be Bi C Ca Cd Ce Co Cr Cu Fe Ga Ge H Hf

In K La Li Mg Mn Na Ni Pb Sc Si Sn Sr Ti V Zn Zr

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Mobility Database for Mg Alloys MOBMG1: TCS Mg-alloys Mobility Database

Database name: TCS Mg-alloys Mobility Database Version: 1.0

Database acronym: MOBMG1 Database Segment: Magnesium Alloys

Elements: 24

Brief description: MOBMG1 is a CALPHAD-type kinetic database containing atomic mobility data for Mg-based alloys. MOBMG1 is compatible and primarily recommended for use in combination with the TCMG4 thermodynamic database.

Applications: Coupled with a compatible thermodynamic database, MOBMG1 can be used to calculate various diffusivities in both solid and liquid solution phases, and most importantly to simulate diffusion-controlled phenomena, such as solidification, nucleation, growth / dissolution and coarsening of precipitates, in Mg-based alloys by using the add-on Diffusion Module (DICTRA) and/or Precipitation Module (TC-PRISMA).

Included Elements:

Ag Al Ca Ce Cu Fe Gd K La Li Mg Mn Na Nd Ni Pr Sc

Si Sn Sr Th Y Zn Zr

Mobility Database for Ti Alloys MOBTI1: TCS Ti-alloys Mobility Database

Database name: TCS Ti-alloys Mobility Database Version: 1.0

Database acronym: MOBTI1 Database Segment: Titanium Alloys

Elements: 9

Brief description: MOBTI1 is a kinetic database containing mobility data for Ti-based alloys present in a format suitable for simulation of diffusion controlled phenomena using the Software Development Kits (SDKs) and the add-on Diffusion Module (DICTRA) and/or Precipitation Module (TC-PRISMA). MOBTI1 is primarily intended for use in combination with the TTTI thermodynamic database, but is also compatible for use in combination with the SSOL thermodynamic databases.

Applications: Used together with the add-on modules and a thermodynamic database for Ti-alloys (e.g. TTTI) the MOBTI1 database can be used in order to study several different phenomena of interest to titanium alloys, such as solidification, growth/dissolution kinetics of alpha and minor precipitates, etc.

Included Elements:

Al Cr Mo Nb Sn Ta Ti V Zr

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Mobility Database for Si Alloys MOBSI1: TCS Si-alloys Mobility Database

Database name: TCS Si-alloys Mobility Database Version: 1.0

Database acronym: MOBSI1 Database Segment: Silicon-based Alloys

Elements: 28

Brief description: MOBSI1 is a kinetic database developed for calculating self and impurity diffusivities in both solid and liquid Si. Coupled together with TCSI1, diffusion phenomena can be simulated by using the add-on Diffusion Module (DICTRA) and/or Precipitation Module (TC-PRISMA) for the production of solar grade cell Si.

Applications: Solar grade silicon materials.

Included Elements:

Ag Al As Au B Bi C Co Cr Cu Fe Ga Ge In Li Mn N

Ni O P S Sb Si Sn Te Ti V Zn

Mobility Database for Cu Alloys MOBCU1: TCS Cu Alloys Mobility Database

Database name: TCS Cu Alloys Mobility Database Version: 1.0

Database acronym: MOBCU1 Database Segment: Copper Alloys

Elements: 27

Brief description: MOBCU1 is a kinetic database containing mobility data for Cu-based alloys. It is suitable for simulation of diffusion controlled phenomena using the add-on Diffusion Module (DICTRA) and/or Precipitation Module (TC-PRISMA). It can also be used with any Thermo-Calc programming interface (e.g. TQ-Interface or TC-API) in your own application programming needs. MOBCU1 is intended for use in combination with the TCCU thermodynamic database.

Applications: Together with the Diffusion Module (DICTRA) and a thermodynamic database for Cu-alloys (e.g. TCCU) use the MOBCU1 database to study diffusion-controlled phenomena in copper alloys, e.g. microsegregation during solidification, homogenisation kinetics, growth/dissolution kinetics of precipitates, interdiffusion, and so forth. You can also use it with the Precipitation Module (TC-PRISMA) to simulate concurrent nucleation, growth, and coarsening of precipitates in Cu-based alloys.

Included Elements:

Ag Al As Au B Be Bi C Ca Cd Co Cr Cu Fe Mg Mn Nb

Ni P Pb Pt Se Si Sn Ti Zn Zr

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Thermo-Calc Software AB

Norra Stationsgatan 93

SE-113 64 Stockholm

SWEDEN

[email protected]

Phone: +46 8 545 959 30

Fax: +46 8 673 37 18

www.thermocalc.com

Org.No: 556540-6138

VAT No: SE556540613801

Database information as of July 2016

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