Activity coefficients - Githubissues

PCLAeroParams / TChem-atm

https://PCLAeroParams.github.io/TChem-atm/

BSD 2-Clause "Simplified" License

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Activity coefficients #15

Open mwest1066 opened 5 months ago

mwest1066 commented 5 months ago

Calculate activity coefficients in TChem.

Current plan:

[x] #22
[x] #24
[ ] Convert MTEM implementation to load data from JSON/YAML files
Longer-term, investigate learning approximations like MTEM using ML from detailed models
- [ ] Implement detailed models for activity coefficients. Which ones?
- [ ] Investigate ML learning

Where do Unifac and Pdfite fit into this?