Gaussian 16 on Galileo and Marconi

Dear users,

Gaussian 16 is now available on Galileo and Marconi.

Use of the current generation of NVIDIA GPUs is supported for Hartree-Fock and DFT calculations (see release notes at: http://gaussian.com/relnotes/). We are currently testing a number of configurations in order to provide optimal speedups on GPU-enabled gaussian parallelization on Galileo cluster.

On Galileo cluster, you have to load only the Gaussian 16 module:
module load g16

On Marconi cluster, you have to load the chem profile before loading the Gaussian 16 module:
module load profile/chem
module load autoload g16

For more details about the software usage, you can type on both clusters:
module help g16

Best regards,
HPC User Support @ CINECA