qmcpack workspace at Intel

Build and run on Borealis nodes

Set modules and paths

As 2023-05-05,

module use -a /home/nsdhaman/shared/modulefiles
module use -a /home/ftartagl/graphics-compute-runtime/modulefiles
module use -a /home/ftartagl/nightly
module load gcc
module unload oneapi
module load nightly-compiler/2023.04.10
module load nightly-mkl/2023.03.29
module load graphics-compute-runtime/ci-neo-master-026097
# cmake
export PATH="/home/jeongnim/share/hpcm/ninja-build/bin:/home/jeongnim/share/hpcm/cmake-3.26.3/bin:$PATH"

Do not use cmpilers later than 2023.04.10 until notified.

Build and run Aurora workload

These scrpts hpcm directory show how to use HPCM environments and oneAPI ENVs

• hpcm/build_aurora_node.sh
• hpcm/launch_interactive.sh
• hpcm/launch_pbs.sh
• hpcm/run_copy_eng_imm.sh

Build and run on ortce-pvc

Set modules and paths

As 2023-05-05,

module load intel-nightly/20230407
module load intel/mkl-nda/nightly-cev-20230405
module load intel-comp-rt/ci-neo-master/026093
module load intel/mpich/pvc51.2

Build and run Aurora workload

ortce-pvc directory has reference scripts similar to hpcm

• ortce-pvc/build_aurora_node.sh
• ortce-pvc/launch_interactive.sh
• ortce-pvc/run_copy_eng_imm.sh

Source and data repository

https://github.com/intel-innersource/applications.hpc.workloads.aurora.qmcpack.git

• aurora-main branch