Sökning: "compound energy formalism"

Visar resultat 1 - 5 av 7 avhandlingar innehållade orden compound energy formalism.

  1. 1. Thermodynamic description of the Fe-C-Cr-Mn-Ni-O system

    Författare :Lina Kjellqvist; Malin Selleby; Bengt Hallstedt; KTH; []
    Nyckelord :TEKNIK OCH TEKNOLOGIER; ENGINEERING AND TECHNOLOGY; thermodynamic modelling; thermodynamic assessment; Calphad; phase diagram; spinel; compound energy formalism; ionic two-sublattice liquid model; Materials science; Teknisk materialvetenskap;

    Sammanfattning : The Fe-C-Cr-Mn-Ni-O system is of fundamental importance when describing the influence of oxygen on high alloyed steels. Both solid and liquid phases are of great interest: The solid phases regarding oxidation processes like the formation of oxide layers, inner oxidation, sintering processes and high temperature corrosion. LÄS MER

  3. 2. Thermodynamic modelling and assessment of some alumino-silicate systems

    Författare :Huahai Mao; Bo Sundman; Gunnar Eriksson; KTH; []
    Nyckelord :TEKNIK OCH TEKNOLOGIER; ENGINEERING AND TECHNOLOGY; thermodynamic modelling; thermodynamic assessment; alumino-silicate system; slag; oxide system; CALPHAD; phase diagram; phase equilibrium; Thermo-Calc; compound energy formalism; ionic two sub-lattice liquid model; AlO2-1 species; Al2O3; CaO; MgO; SiO2; Y2O3; Materialvetenskap; Materials science; Teknisk materialvetenskap;

    Sammanfattning : Alumino-silicate systems are of great interest for materials scientists and geochemists. Thermodynamic knowledge of these systems is useful in steel and ceramic industries, and for understanding geochemical processes. A popular and efficient approach used to obtain a self-consistent thermodynamic dataset is called CALPHAD. LÄS MER

  4. 3. First step to a genomic CALPHAD database for cemented carbides : C-Co-Cr alloys

    Författare :Zhou Li; Malin Selleby; Jana Pavlu; KTH; []
    Nyckelord :TEKNIK OCH TEKNOLOGIER; ENGINEERING AND TECHNOLOGY; CALPHAD; Einstein model; two-state model; compound energy formalism; thermodynamic description; C-Co-Cr; Teknisk materialvetenskap; Materials Science and Engineering;

    Sammanfattning : CALPHAD (CALculation of PHAse Diagrams) denotes the methodology used to assess thermodynamic data based on experiments as well as on first principles calculations. Essential for this method is the coupling of phase diagram and thermodynamic properties. LÄS MER

  5. 4. Investigation of vanadium-containing oxide systems : CALPHAD and experiments

    Författare :Yang Yang; Malin Selleby; Caisa Samuelsson; KTH; []
    Nyckelord :TEKNIK OCH TEKNOLOGIER; ENGINEERING AND TECHNOLOGY; Calphad; thermodynamic modelling; compound energy formalism; evaporation kinetics; activation energy; TGA; activity;

    Sammanfattning : Fundamental studies on thermodynamic properties of vanadium-containing oxides systems are essential to understand practical vanadium metallurgical process. The CALPHAD technique is here applied to the thermodynamic modelling of the V-O, Ca-V-O and Ti-V-O systems. The compound energy formalism is used for all the solution phases. LÄS MER

  7. 5. Phase diagram evaluations and applications in light metal alloys

    Författare :Åke Jansson; KTH; []
    Nyckelord :;

    Sammanfattning : A thermodynamic database for light alloys have been assessedusing the CALPHAD method. The database contains a newevaluation of aluminium rich alloys containing Fe, Mn and Si,and it may be used also for alloys containing small amounts ofMg. LÄS MER