changed version to 20200831

fdmnes.sh

@@ -211,8 +211,8 @@
 #
 # On SLURM, the two last parameters are determined from the SLURM environment.
 #
-FDMVERS=20200505
-#FDMHOME=/scisoft/users/wilcke/swdev/fdmnes/fdmnes_$FDMVERS/ubuntu20.04/bin
+FDMVERS=20200831
+FDMHOME=/scisoft/users/wilcke/swdev/fdmnes/fdmnes_$FDMVERS/ubuntu20.04/bin
 FDMINFIL=fdmfile.txt
 HOSTFILE=mpd.hosts
 NPERNODE=2

fdmnes_slurm.sh

@@ -159,7 +159,7 @@
 # command, and the variable FDMHOME stays empty. If a different version of
 # FDMNES is required, the corresponding "fdmnes.sh" script can be selected here.
 #
-FDMVERS=20200505
+FDMVERS=20200831
 #FDMHOME=/scisoft/users/wilcke/swdev/fdmnes/fdmnes_$FDMVERS/ubuntu20.04/bin
 
 if [ X$FDMHOME = X ]
@@ -257,3 +257,5 @@ fi
 #
 #export HOST_NUM_FOR_MUMPS=4; sbatch -p nice --nodes=3 --mincpus=28 --mem=0 \
 #   --exclusive --time=72:0:0 $EXECUT -np 6
+export HOST_NUM_FOR_MUMPS=4; sbatch -p nice --nodes=2 --mincpus=8  \
+   --time=1:0:0 $EXECUT -np 4