Where I can find the binary interaction parameters
See original GitHub issueHi CalebBell,
Where is your binary interaction parameters databank, I just found this in your code, are they generated by the code? I know Aspen and ProII have a lot binary parameters, so just confused about this.
if kijs is None: kijs = [[0]*self.N for i in range(self.N)] self.kijs = kijs
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- Created 6 years ago
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Top GitHub Comments
Hello longcloud,
I appreciate the offer of help and the compliment. The following are all ways that you could contribute to thermo:
I would be very thankful if you looked into any of them.
Sincerely, Caleb
Hi all, There is a small sample database in the development version of thermo now, https://github.com/CalebBell/thermo/blob/master/thermo/interaction_parameters.py with data from ChemSep.
Interaction parameters won’t be loaded by default; it is left to the user to load them, or use their own, or a combination of the two. You can see the variant.
I don’t know much about bk10 but I suspect it is quite obsolete.
Sincerely, Caleb