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--- software:gaussian:caviness [2020-08-28 18:35] – [Gaussian on Caviness] anita
+++ software:gaussian:caviness [2020-08-28 18:37] – [Gaussian on Caviness] anita
@@ Line 1: / Line 1: @@
 ====== Gaussian on Caviness ======
-A Slurm job submission script template for batch Gaussian jobs is available at ''/opt/templates/slurm/applications/gaussian.qs''.  Copy and edit the template based on your job's resource needs; the comments in the template describe each Slurm option and environment variable present.  At the very least, the Gaussian input file variable must be altered accordingly:
+A Slurm job submission script template for batch Gaussian jobs is available at ''/opt/templates/slurm/applications/gaussian.qs''.  Copy and edit the template based on your job's resource needs; the comments in the template describe each Slurm option and environment variable present.
+<note tip>It is a good idea to periodically check ''/opt/templates/slurm/applications'' for changes in existing templates, or the addition of new templates, designed to provide the best performance for a particular version of Gaussian on that cluster.</note>
+At the very least, the Gaussian input file variable must be altered accordingly:
 <code>