MOPAC

MOPAC2016 is a semiempirical quantum chemistry software package for the prediction of chemical properties and modeling of chemical reactions. It is used by chemists and biochemists or both research and teaching, and runs on Windows and Linux platforms.

Version: 2016 (MARCONI, G100)

Availability: GALILEO100, MARCONI

Target: academic

Official web site: http://openmopac.net/home.html

Help and Documentation:

You can load the software with the command

module load mopac


You can find documentation on the system, with the command

module help mopac