192 lines
3.7 KiB
Plaintext
192 lines
3.7 KiB
Plaintext
|
#!/bin/sh
|
||
|
|
#
|
||
|
|
# The exit status of this script is read by Mentat.
|
||
|
|
# Normal exit status is 0.
|
||
|
|
#
|
||
|
|
|
||
|
|
DIR=%INSTALLDIR%/marc2020
|
||
|
|
|
||
|
|
if test $MARCDIR1
|
||
|
|
then
|
||
|
|
DIR=$MARCDIR1
|
||
|
|
fi
|
||
|
|
|
||
|
|
if test -z "$DIR"; then
|
||
|
|
REALCOM="`ls -l $0 |awk '{ print $NF; }'`"
|
||
|
|
DIRSCRIPT=`dirname $REALCOM`
|
||
|
|
case $DIRSCRIPT in
|
||
|
|
\/*)
|
||
|
|
;;
|
||
|
|
*)
|
||
|
|
DIRSCRIPT=`pwd`/$DIRSCRIPT
|
||
|
|
;;
|
||
|
|
esac
|
||
|
|
. $DIRSCRIPT/getarch
|
||
|
|
|
||
|
|
DIR="$MENTAT_MARCDIR"
|
||
|
|
fi
|
||
|
|
|
||
|
|
SRCEXT=.f
|
||
|
|
SRCEXTC=.F
|
||
|
|
RSTEXT=.t08
|
||
|
|
PSTEXT=.t19
|
||
|
|
PSTEXTB=.t16
|
||
|
|
VWFCEXT=.vfs
|
||
|
|
|
||
|
|
slv=$1
|
||
|
|
version=$2
|
||
|
|
ndom_fea_solver=$3
|
||
|
|
ndom_preprocessor=$4
|
||
|
|
hostfile=$5
|
||
|
|
compat=$6
|
||
|
|
job=$7
|
||
|
|
srcfile=$8
|
||
|
|
srcmeth=$9
|
||
|
|
shift 9 # cannot use $10, $11, ...
|
||
|
|
restart=$1
|
||
|
|
postfile=$2
|
||
|
|
viewfactorsfile=$3
|
||
|
|
copy_datfile="-ci $4"
|
||
|
|
copy_postfile="-cr $5"
|
||
|
|
scr_dir=$6
|
||
|
|
dcoup=$7
|
||
|
|
assem_recov_nthread=$8
|
||
|
|
nthread=$9
|
||
|
|
shift 9 # cannot use $10, $11, ...
|
||
|
|
nsolver=$1
|
||
|
|
mode=$2
|
||
|
|
gpu=$3
|
||
|
|
|
||
|
|
if [ "$slv" != "" -a "$slv" != "marc" -a "$slv" != "datfit" ]; then
|
||
|
|
slv="-iam sfm"
|
||
|
|
fi
|
||
|
|
if [ "$slv" = "marc" ]; then
|
||
|
|
slv=""
|
||
|
|
fi
|
||
|
|
if [ "$slv" = "datfit" ]; then
|
||
|
|
slv="-iam datfit"
|
||
|
|
fi
|
||
|
|
|
||
|
|
if [ "$ndom_fea_solver" != "" -a "$ndom_fea_solver" != "1" ]; then
|
||
|
|
nprocds="-nprocds $ndom_fea_solver"
|
||
|
|
else
|
||
|
|
nprocd=""
|
||
|
|
if [ "$ndom_preprocessor" != "" -a "$ndom_preprocessor" != "1" ]; then
|
||
|
|
nprocd="-nprocd $ndom_preprocessor"
|
||
|
|
else
|
||
|
|
nprocd=""
|
||
|
|
fi
|
||
|
|
fi
|
||
|
|
|
||
|
|
if [ "$srcfile" != "" -a "$srcfile" != "-" ]; then
|
||
|
|
srcfile=`echo $srcfile | sed "s/$SRCEXT$//" | sed "s/$SRCEXTC$//"`
|
||
|
|
case "$srcmeth" in
|
||
|
|
-)
|
||
|
|
srcfile="-u $srcfile"
|
||
|
|
;;
|
||
|
|
compsave)
|
||
|
|
srcfile="-u $srcfile -save y"
|
||
|
|
;;
|
||
|
|
runsaved)
|
||
|
|
srcfile=${srcfile%.*}".marc"
|
||
|
|
srcfile="-prog $srcfile"
|
||
|
|
;;
|
||
|
|
esac
|
||
|
|
else
|
||
|
|
srcfile=""
|
||
|
|
fi
|
||
|
|
|
||
|
|
if [ "$restart" != "" -a "$restart" != "-" ]; then
|
||
|
|
restart=`echo $restart | sed "s/$RSTEXT$//"`
|
||
|
|
restart="-r $restart"
|
||
|
|
else
|
||
|
|
restart=""
|
||
|
|
fi
|
||
|
|
|
||
|
|
if [ "$postfile" != "" -a "$postfile" != "-" ]; then
|
||
|
|
postfile=`echo $postfile | sed "s/$PSTEXT$//"`
|
||
|
|
postfile=`echo $postfile | sed "s/$PSTEXTB$//"`
|
||
|
|
postfile="-pid $postfile"
|
||
|
|
else
|
||
|
|
postfile=""
|
||
|
|
fi
|
||
|
|
|
||
|
|
if [ "$viewfactorsfile" != "" -a "$viewfactorsfile" != "-" ]; then
|
||
|
|
viewfactorsfile=`echo $viewfactorsfile | sed "s/$VWFCEXT$//"`
|
||
|
|
viewfactorsfile="-vf $viewfactorsfile"
|
||
|
|
else
|
||
|
|
viewfactorsfile=""
|
||
|
|
fi
|
||
|
|
|
||
|
|
if [ "$hostfile" != "" -a "$hostfile" != "-" ]; then
|
||
|
|
hostfile="-ho $hostfile"
|
||
|
|
else
|
||
|
|
hostfile=""
|
||
|
|
fi
|
||
|
|
|
||
|
|
if [ "$compat" != "" -a "$compat" != "-" ]; then
|
||
|
|
compat="-co $compat"
|
||
|
|
else
|
||
|
|
compat=""
|
||
|
|
fi
|
||
|
|
|
||
|
|
if [ "$scr_dir" != "" -a "$scr_dir" != "-" ]; then
|
||
|
|
scr_dir="-sd $scr_dir"
|
||
|
|
else
|
||
|
|
scr_dir=""
|
||
|
|
fi
|
||
|
|
|
||
|
|
if [ "$dcoup" != "" -a "$dcoup" != "0" ]; then
|
||
|
|
dcoup="-dcoup $dcoup"
|
||
|
|
else
|
||
|
|
dcoup=""
|
||
|
|
fi
|
||
|
|
|
||
|
|
if [ "$assem_recov_nthread" != "" -a "$assem_recov_nthread" != "1" ]; then
|
||
|
|
assem_recov_nthread="-nthread_elem $assem_recov_nthread"
|
||
|
|
else
|
||
|
|
assem_recov_nthread=""
|
||
|
|
fi
|
||
|
|
|
||
|
|
if [ "$nthread" != "" -a "$nthread" != "0" -a "$nthread" != "1" ]; then
|
||
|
|
nthread="-nthread $nthread"
|
||
|
|
else
|
||
|
|
nthread=""
|
||
|
|
fi
|
||
|
|
|
||
|
|
if [ "$nsolver" != "" -a "$nsolver" != "0" ]; then
|
||
|
|
nsolver="-nsolver $nsolver"
|
||
|
|
else
|
||
|
|
nsolver=""
|
||
|
|
fi
|
||
|
|
|
||
|
|
case "$mode" in
|
||
|
|
4) mode="-mo i4" ;;
|
||
|
|
8) mode="-mo i8" ;;
|
||
|
|
*) mode= ;;
|
||
|
|
esac
|
||
|
|
|
||
|
|
if [ "$gpu" != "" -a "$gpu" != "-" ]; then
|
||
|
|
gpu="-gpu $gpu"
|
||
|
|
else
|
||
|
|
gpu=""
|
||
|
|
fi
|
||
|
|
|
||
|
|
rm -f $job.cnt
|
||
|
|
rm -f $job.sts
|
||
|
|
rm -f $job.out
|
||
|
|
rm -f $job.log
|
||
|
|
|
||
|
|
# To prevent a mismatch with the python version used by the solver
|
||
|
|
# do *not* prepend $MENTAT_INSTALL_DIR/python/bin to environment variable PATH
|
||
|
|
# unset environment variables PYTHONHOME and PYTHONPATH
|
||
|
|
unset PYTHONHOME
|
||
|
|
unset PYTHONPATH
|
||
|
|
|
||
|
|
"${DIR}/tools/run_damask_hmp" $slv -j $job -v n -b y $nprocds $nprocd \
|
||
|
|
$srcfile $restart $postfile $viewfactorsfile $hostfile \
|
||
|
|
$compat $copy_datfile $copy_postfile $scr_dir $dcoup \
|
||
|
|
$assem_recov_nthread $nthread $nsolver $mode $gpu > /dev/null 2>&1
|
||
|
|
sleep 1
|
||
|
|
exit 0
|