diff --git a/templates/qe/6.4/data.qe.container.config b/templates/qe/6.4/data.qe.container.config index a32e62f83745effa1fe8923426238d0109e7d802..4dfa94a74abe7b65cb2efff685b2d3e6254d61d5 100644 --- a/templates/qe/6.4/data.qe.container.config +++ b/templates/qe/6.4/data.qe.container.config @@ -39,10 +39,10 @@ make install make clean [RUN] -#container-run = mpirun --allow-run-as-root -x OMP_NUM_THREADS=1 -np 96 singularity exec xx.sif /hpcrunner/q-e-qe-6.4.1/bin pw.x -input /hpcrunner/workloads/QE/qe-test/test_3.in -run = mpirun --allow-run-as-root -x OMP_NUM_THREADS=1 -np 96 +#container-run = mpirun --allow-run-as-root -x OMP_NUM_THREADS=1 -np $(nproc) singularity exec xx.sif /hpcrunner/q-e-qe-6.4.1/bin pw.x -input /hpcrunner/workloads/QE/qe-test/test_3.in +run = mpirun --allow-run-as-root -x OMP_NUM_THREADS=1 -np $(nproc) binary = pw.x -input test_3.in nodes = 1 [PERF] -perf = \ No newline at end of file +perf =