⚛️ openCOSMO-RS Guide ⚛️#
This Jupiter Notebook serves as a comprehensive guide to using openCOSMO-RS on Windows for predicting solvation phenomena and thermodynamic properties of fluid systems. openCOSMO-RS is a powerful tool that uses computational chemistry to provide insight into molecular interactions and solvation behavior
The goal of this guide is to provide a step-by-step tutorial on how to set up and use openCOSMO-RS, covering the following key aspects:
Introduction to theoretical concepts
Software Requirements
Input File Preparation
Various examples and applications of the program
Result Analysis.