Versions Compared

Key

  • This line was added.
  • This line was removed.
  • Formatting was changed.

...

Column
width900px


Code Block
languagebash
themeDJango
titleTerminal 1. Install VASP with VASPsol using Spack
$ ls 
vasp.5.4.4.pl2.tgz

$ module load spack/0.19.0<VERSION>
Note: when this module is unloaded, the shell environment will NOT revert to its original state, and retain
some Spack settings. If you need the original shell environment, start a new shell session instead. 

$ spack install vasp@5.4.4.pl2 +scalapack +vaspsol +vtst
==> Installing vasp-5.4.4.pl2-7p4vkc6ncmxw7ceochhxbqla36fvecfe
==> No binary for vasp-5.4.4.pl2-7p4vkc6ncmxw7ceochhxbqla36fvecfe found: installing from source
[..]
==> vasp: Successfully installed vasp-5.4.4.pl2-7p4vkc6ncmxw7ceochhxbqla36fvecfe
  Fetch: 1.49s.  Build: 20m 50.73s.  Total: 20m 52.22s.
==> vasp: Successfully installed vasp-5.4.4.pl2-7p4vkc6ncmxw7ceochhxbqla36fvecfe
  Fetch: 9.56s.  Build: 12m 28.45s.  Total: 12m 38.01s.
[+] /software/projects/your_project/your_username/setonix/2023.08/software/linux-sles15-zen3/gcc-12.2.0/vasp-5.4.4.pl2-7p4vkc6ncmxw7ceochhxbqla36fvecfe

$ spack module lmod refresh -y vasp
==> Regenerating lmod module files


...