MOPAC-GUI tutorial

This section contains a tutorial showing you how to use MOPAC via the GUI. See also the AMS GUI tutorials

If you are not familiar with the ADF-GUI (or the MOPAC-GUI), please have a look at the Introduction and GUI Overview tutorials (for example, it will show you how to start the MOPAC-GUI).

MOPAC (Molecular Orbital PACkage) is a semiempirical quantum chemistry program based on Dewar and Thiel’s NDDO approximation. The MOPAC engine shares the core routines with the standalone MOPAC program and can be used via the AMS driver.

• Toluene charges, movies, frequencies and normal modes