UNIFAC model: Difference between revisions

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The {{src|models/thermodynamics.a4l}} ASCEND code provides for calculation of vapor-liquid equilibrium. Details of the [http://en.wikipedia.org/wiki/UNIFAC UNIFAC model] are on Wikipedia.
The {{src|models/thermodynamics.a4l}} ASCEND code provides methods for calculating vapor-liquid equilibria (VLE).
 
Details on various group-contribution methods can be found here:
 
UNIQUAC:
[https://en.wikipedia.org/wiki/UNIQUAC UNIQUAC model] on Wikipedia
 
UNIFAC:
[https://en.wikipedia.org/wiki/UNIFAC UNIFAC model] on Wikipedia
 
modified UNIFAC:
[http://pubs.acs.org/doi/abs/10.1021/ie00071a018 A modified UNIFAC group-contribution model for prediction of phase equilibria and heats of mixing]
 
The predictive Soave-Redlich-Kwong (PSRK) equation of state combines the Soave-Redlich-Kwong cubic equation of state with the Mathias-Copeman equation and the modified UNIFAC group-contribution method:
 
[https://en.wikipedia.org/wiki/PSRK PSRK model] on Wikipedia
 
The UNIFAC consortium manages the parameter database for the original UNIFAC, modified UNIFAC and PSRK model:
[http://www.ddbst.com/unifac-consortium.html The UNIFAC Consortium]





Revision as of 11:08, 23 December 2015

The models/thermodynamics.a4l ASCEND code provides methods for calculating vapor-liquid equilibria (VLE).

Details on various group-contribution methods can be found here:

UNIQUAC: UNIQUAC model on Wikipedia

UNIFAC: UNIFAC model on Wikipedia

modified UNIFAC: A modified UNIFAC group-contribution model for prediction of phase equilibria and heats of mixing

The predictive Soave-Redlich-Kwong (PSRK) equation of state combines the Soave-Redlich-Kwong cubic equation of state with the Mathias-Copeman equation and the modified UNIFAC group-contribution method:

PSRK model on Wikipedia

The UNIFAC consortium manages the parameter database for the original UNIFAC, modified UNIFAC and PSRK model: The UNIFAC Consortium


See also Thermodynamics with ASCEND.