%Link1 %NProcShared=8 %LindaWorkers=node1,node2,node3 %Mem=16GB #P B3LYP/6-311+G(d,p) Opt Use code with caution.
cp /path/to/my_license_file /opt/gaussian/g16/license.file gaussian 16 linux
sudo chmod 750 -R /usr/local/g16
Gaussian's initialization scripts rely on the C shell. Install it using your package manager: RHEL/Rocky: sudo dnf install tcsh Ubuntu/Debian: sudo apt install tcsh Installation Steps %Link1 %NProcShared=8 %LindaWorkers=node1
Add the following to your .cshrc :
Then, source the file to apply the changes: node3 %Mem=16GB #P B3LYP/6-311+G(d
In a multi-user Linux environment, jobs should never be run directly in the terminal shell. Use a scheduler like Slurm to manage resource distribution. Below is a production-ready Slurm submission script ( submit_g16.sh ):