Merge pull request #4699 from aannabe/perlmutter_gpu

Fix Nexus GPU jobs for NERSC/Perlmutter
QMCPACK · Aug 15, 2023 · b24ba10 · b24ba10
2 parents c72edd1 + 146e863
commit b24ba10
Showing 1 changed file with 1 addition and 1 deletion.
diff --git a/nexus/lib/machines.py b/nexus/lib/machines.py
@@ -2314,7 +2314,7 @@ def write_job_header(self,job):
 echo $SLURM_SUBMIT_DIR
 cd $SLURM_SUBMIT_DIR
 '''
-        if job.threads>1:
+        if (job.threads>1) and ('cpu' in job.constraint):
             c+='''
 export OMP_PROC_BIND=true
 export OMP_PLACES=threads