Gaussian 09 revision D.01

Gaussian 09 is the latest in the Gaussian series of programs, providing state-of-the-art capabilities for electronic structure modelling.

Accessing the software

To load the module:

$ module load apps/gaussian/v09rd01

An example command to include in your job script:

g09 <input-file>

Accessing Previous Versions

Wherever possible, previous versions of this application will be retained for continuity, especially for research projects that require a consistent version of the software throughout the project. Such versions, however, may be unsupported by IT Services or the applications vendor, and may be withdrawn at short or no notice if they can no longer run on the cluster - for example, essential operating system upgrades may be incompatible with old versions.

At present there are no previous versions of this application on the BlueBEAR service.

Known Problems & Limitations

  • Due to the additional license required to enable distributed memory parallel runs, Gaussian on this service can only take advantage of the multiple cores on a node but cannot run across nodes.

Other Information

The Support Level for this application is An.

Visit the Gaussian website for more information regarding this application.

Last modified: 23 November 2017