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ADF: Amsterdam Density Functional software - Functionality - The COSMO-RS GUI

With the Graphical User Interface for COSMO-RS (ADFcrs) you can import your molecule(s) that form the liquid (mixture), choose the desired options from menu's, start up your COSMO-RS calculation, and visualize the results. Step-by-step tutorials ensure that anyone can visualize results of basis COSMO-RS calculations. Some of the results from COSMO-RS and ADF calculations are depicted below.

The σ-profile shows the amount of surface area for a given COSMO charge density.

The calculated solubility of benzene in water for a range of temperatures.

The COSMO charge density on a COSMO surface.

To find more information about COSMO-RS GUI please visit SCM web page.