Gaussian

Tags HPC

In order to run Gaussian, users should add one of the following to their login file, depending on the shell being used:

bash users:

~/.bash_profile:

    g16root="/opt/gaussian"
    GAUSS_SCRDIR="/local/$USER"
    export g16root GAUSS_SCRDIR
    . $g16root/g16/bsd/g16.profile

tcsh users:

~/.login:

    setenv g16root "/opt/gaussian"              
    setenv GAUSS_SCRDIR "/local/$USER"
    source $g16root/g16/bsd/g16.login     # sets up G16 run environment.

Return to High Performance Computing (HPC)

Print Article

Details

Article ID: 412
Created
Wed 11/30/22 1:15 PM
Modified
Thu 12/15/22 1:39 PM

Related Articles (2)

This article contains an overview of High Performance Computing, along with guidelines and training information.