mirror of https://github.com/QMCPACK/qmcpack.git
114 lines
2.3 KiB
Bash
Executable File
114 lines
2.3 KiB
Bash
Executable File
#!/bin/bash
|
|
#COBALT -q debug-cache-quad
|
|
#COBALT -A CSC249ADSE09
|
|
#COBALT -n 1
|
|
#COBALT -t 60
|
|
#COBALT -O nightly
|
|
#COBALT --attrs mcdram=cache:numa=quad
|
|
|
|
#
|
|
# Setup for theta.alcf.anl.gov
|
|
#
|
|
|
|
module unload cray-libsci
|
|
module load cray-hdf5-parallel
|
|
module load gcc
|
|
module load cmake/3.14.5
|
|
module load miniconda-3/latest
|
|
|
|
export TEST_SITE_NAME=theta.alcf.anl.gov
|
|
export N_PROCS=16
|
|
export N_PROCS_BUILD=16
|
|
export N_CONCURRENT_TESTS=1
|
|
|
|
#QE_BIN=/scratch/opt/qe-stable/qe-6.4.1/bin
|
|
QMC_DATA=/projects/catalyst/yeluo/benchmark/h5data
|
|
|
|
#Must be an absolute path
|
|
place=/projects/CSC249ADSE09/QMCPACK_CI_BUILDS_DO_NOT_REMOVE
|
|
|
|
#define and load compiler
|
|
compiler=Intel19.0.5
|
|
CC=cc
|
|
CXX=CC
|
|
|
|
if [ ! -e $place ]; then
|
|
mkdir $place
|
|
fi
|
|
|
|
if [ -e $place ]; then
|
|
cd $place
|
|
|
|
echo --- Hostname --- $HOSTNAME
|
|
echo --- Checkout for $sys `date`
|
|
|
|
branch=develop
|
|
entry=qmcpack-${branch}
|
|
|
|
if [ ! -e $entry ]; then
|
|
echo --- Cloning QMCPACK git `date`
|
|
git clone --depth 1 https://github.com/QMCPACK/qmcpack.git $entry
|
|
else
|
|
echo --- Updating local QMCPACK git `date`
|
|
cd $entry
|
|
git pull
|
|
cd ..
|
|
fi
|
|
|
|
if [ -e $entry/CMakeLists.txt ]; then
|
|
cd $entry
|
|
|
|
git checkout $branch
|
|
|
|
for sys in Real Complex # Real-Mixed Complex-Mixed
|
|
do
|
|
|
|
folder=build_$compiler_$sys
|
|
|
|
if [ -e $folder ]; then
|
|
rm -r $folder
|
|
fi
|
|
mkdir $folder
|
|
cd $folder
|
|
|
|
echo --- Building for $sys `date`
|
|
|
|
# create log file folder if not exist
|
|
mydate=`date +%y_%m_%d`
|
|
if [ ! -e $place/log/$entry/$mydate ];
|
|
then
|
|
mkdir -p $place/log/$entry/$mydate
|
|
fi
|
|
|
|
CTEST_FLAGS="-D CMAKE_C_COMPILER=$CC -D CMAKE_CXX_COMPILER=$CXX -D QMC_DATA=$QMC_DATA -D ENABLE_TIMERS=1
|
|
-DQMC_OPTIONS='-DMPIEXEC_EXECUTABLE=/bin/sh;-DMPIEXEC_NUMPROC_FLAG=$place/$entry/tests/scripts/aprunhelper.sh'"
|
|
|
|
if [[ $sys == *"Complex"* ]]; then
|
|
CTEST_FLAGS="$CTEST_FLAGS -D QMC_COMPLEX=1"
|
|
fi
|
|
|
|
if [[ $sys == *"-Mixed"* ]]; then
|
|
CTEST_FLAGS="$CTEST_FLAGS -D QMC_MIXED_PRECISION=1"
|
|
fi
|
|
|
|
export QMCPACK_TEST_SUBMIT_NAME=${compiler}-${sys}-Release
|
|
|
|
ctest $CTEST_FLAGS -S $PWD/../CMake/ctest_script.cmake,release \
|
|
-VV --stop-time $(date --date=now+28mins +%H:%M:%S) \
|
|
-R 'deterministic|performance-NiO-cpu-a128-e1536' \
|
|
--timeout 400 &> $place/log/$entry/$mydate/${QMCPACK_TEST_SUBMIT_NAME}.log
|
|
|
|
cd ..
|
|
echo --- Finished $sys `date`
|
|
done
|
|
|
|
else
|
|
echo "ERROR: No CMakeLists. Bad git clone."
|
|
exit 1
|
|
fi
|
|
|
|
else
|
|
echo "ERROR: No directory $place"
|
|
exit 1
|
|
fi
|