feos-org / feos

FeOs - A Framework for Equations of State and Classical Density Functional Theory
Other
115 stars 22 forks source link

Group contribution method for binary interaction parameters #104

Closed prehner closed 1 year ago

prehner commented 1 year ago

While the core functionality, like the inclusion of binary segment records, were already part of FeOs, this PR fixes issues to make the feature actually usable.