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Modeling Solid - Liquid - Vapor Equilibrium

2017-06-14
2017-06-14
  • Benjamin Mueller

    Hello all,

    I am trying to model wax precipitation from an alkane mixture. Is there any possibility in DWSIM to model an additional vapor phase in the SLE flash algorithm implemented in DWSIM? Or would it be necessary to write a new flash algorithm when solving this problem?

    Thanks for the info in advance!

    Best regards, Benjamin

     
  • Gregor Reichert

    Gregor Reichert - 2017-06-14

    Hi Benjamin,
    this is already possible.

    You need to select flash algorithm "NestedLoops SVLE - Eutectic". The other algorithm usually is not appilcable, depending on you system.

    Your component which is to be precipitaded needs a proper definition of the relevant pure component properties:
    Temperature of fusion
    Enthalpy of fusion
    * Heat capacity of solid and liquid

    Further details have a look into the code:
    https://github.com/DanWBR/dwsim4/blob/master/DWSIM.Thermodynamics/Flash%20Algorithms/NestedLoopsSLE.vb#L371

    If you don't have exact data of your wax you can adjust enthalpy of fusion to adapt the inclination of the solubility curve. With temperatur of fusion you may move the curve up and down. You will need to calculate a solubility curve of the complete temperature range to see what the curve looks like and to adjust to experimental data.

    As a first guess you can define both heat capacities to be identical. But if you own experimental data you may define them. In this case you will have to adjust the two other parameters again.

    Gregor

     

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