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Quantum Chemistry

excited!

Chemsoft's GUIs for Quantum Chemistry

luceat 05th February 2010 compose and run a job with Firefly under Windows
Gameix 18th February 2009 compose and run a job with Gamess-US under Linux
Wingam 20th March 2009 compose and run a job with WinGamess/Gamess-Cygwin under Windows

The scripts have a graphical user interface (GUI) for easy input, and offer graphical visualization of results either within the scripts or by (transparently) calling external programs which can be downloaded for free from the Internet.
Gamess-US can be requested from Mark Gordon's group at the Ames Laboratory hosted by Iowa State University. It is normally downloaded as source (for compilation see left) but can be obtained in several precompiled varieties.

PC Gamess/Firefly is derived from Gamess-US but is now independent. It is developed by Alex A. Granovsky, Lomonosov State University, Moscow. This modern program runs on Windows, Linux/Unix, supercomputers; refer to here for request.