Dataset of "COSMOSol: Efficient Solvent Screening for Polymer Additives with Open-Source COSMO-SAC"
Abstract
The dataset contains an archival version of COSMOSol - a computational tool for predicting thermodynamic properties and the solubility of solid organic substances in solvents, and for performing solvent screening using the COSMO-SAC model. It includes all COSMOSol source codes and input data, and reproduces the exact version used to generate the results presented in the associated manuscript (as of 2026-02-26; assuming that the COSMO-SAC package version 1.0.1 is used). COSMOSol repository at GitHub: https://github.com/AdamBouz/COSMOSol. Comprehensive documentation is included within the package and available on the GitHub page.
Fields of Study & Subjects
Phase Equilibria and Thermodynamics
Crystallization and Solubility Studies
Advanced Chemical Physics Studies
Publication details
- Journal / source
- Zenodo (CERN European Organization for Nuclear Research)
- Publication date
- 2 March 2026
- Language
- EN
- Document type
- Dataset