From a2702a8690f7814133ca42f4817d003cc1397b9e Mon Sep 17 00:00:00 2001 From: chn Date: Sun, 24 Mar 2024 14:39:07 +0800 Subject: [PATCH] localPackages.vasp: fix --- local/pkgs/vasp/intel/default.nix | 5 +---- 1 file changed, 1 insertion(+), 4 deletions(-) diff --git a/local/pkgs/vasp/intel/default.nix b/local/pkgs/vasp/intel/default.nix index 2269d865..693d7aef 100644 --- a/local/pkgs/vasp/intel/default.nix +++ b/local/pkgs/vasp/intel/default.nix @@ -76,11 +76,8 @@ let export I_MPI_PIN_DOMAIN=''${I_MPI_PIN_DOMAIN-omp} export I_MPI_DEBUG=''${I_MPI_DEBUG-4} - # do not respect slurm allocation - export I_MPI_JOB_RESPECT_PROCESS_PLACEMENT=no - # fork to bootstrap, do not use srun, causing it could not find proper ld - export I_MPI_HYDRA_BOOTSTRAP=fork + export I_MPI_HYDRA_BOOTSTRAP=''${I_MPI_HYDRA_BOOTSTRAP-fork} ${additionalCommands}