EaStCHEM RCF Homepage | Support Pages | Software Information
GAMESS-UK
GAMESS-UK is a general purpose molecular electronic code that supports a range of techniques including SCF, MCSCF and DFT. More information can be found at the Computing for Science Ltd. website.
Documentation
The GAMESS-UK manual is available online.
Running
A GAMESS-UK job is submitted to the cluster queuing system using the gamesssub command. For example:
> gamesssub -np 8 -q parallel-medium.q test
This would submit a GAMESS-UK job to the parallel-medium.q queue using 8 processors and the input in the file test.in. GAMESS-UK can run in serial or distributed memory form.
For more information on gamesssub see the EaStCHEM Submission System User Guide.