Update hpc_tests.sh (#2629)

Quantum-Accelerators · Jan 22, 2025 · f38fc9f · f38fc9f
1 parent fd71547
commit f38fc9f
Showing 1 changed file with 2 additions and 2 deletions.
diff --git a/tests/jenkins/hpc_tests.sh b/tests/jenkins/hpc_tests.sh
@@ -31,9 +31,9 @@ pytest tests/core/recipes/orca_recipes --noconftest
 export QUACC_VASP_PARALLEL_CMD="srun -N 1 --ntasks-per-node 32"
 export VASP_PP_PATH=$SOFTWARE/vasp
 export ASE_VASP_VDW=$SOFTWARE/vasp/vdw_kernel.bindat
-export PATH=$SOFTWARE/vasp/vasp.6.4.3/bin:$PATH
+export PATH=$SOFTWARE/vasp/vasp.6.5.0/bin:$PATH
 module purge
-module load intel/2021.1.2 intel-mpi/intel/2021.3.1 hdf5/intel-2021.1/1.10.6
+module load intel/2021.1.2 intel-mpi/intel/2021.3.1 intel-mkl/2021.1.1
 pytest tests/core/recipes/vasp_recipes/jenkins --noconftest
 
 # Q-Chem