Gaussian 16 on Galileo and Marconi

  1. Home
  2. /
  3. Newsletter
  4. /
  5. Gaussian 16 on Galileo...

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/chemmodule 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