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Starting ADFcrs

If you have installed the ADF package correctly, the adfinput command is located in $ADFBIN.

If $ADFBIN is included in your PATH environment variable, you can start the ADFcrs program with the following command:

adfcrs [filename filename2 ...]

The file names are optional. ADFinput handles files that were created by ADFinput before (which have a .crs or .crskf extension), use only one file name in these cases. One can add multiple files, which correspond to different compounds, if these files contain results of quantum mechanical calculations including COSMO on these compounds. these result files should have .t21, .coskf, or .cosmo extension.

An alternative method to start ADFcrs: select the COSMO-RS command from the SCM menu, or use ADFjobs to start ADFcrs.

If you are using a MacOS X, you can start ADFcrs from the GUILauncher.

Under windows you can start ADFcrs by double-clicking the icon on the desktop.

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