pyoomph.materials.UNIFAC.original module

class pyoomph.materials.UNIFAC.original.OriginalUNIFAC[source]

Bases: UNIFACLikeActivityModel

Original UNIFAC model for activity coefficient calculations.

The published parameters were obtained with kind permisson from the DDBST website (https://www.ddbst.com/published-parameters-unifac.html).

Please cite the relevant publications when publishing results based on this model (https://www.ddbst.com/published-parameters-unifac.html).

Note that these are the published parameters. The UNIFAC Consortium offers updated and revised parameters, which will lead to more accurate results. You can obtain these parameters at: https://www.ddbst.com/unifac-consortium.html

These updated parameters, however, are subject to the terms of use of the UNIFAC Consortium.

Furthermore, you must implement these revised parameters in the code yourself.