free_c=`grep energy\ without $cfile | tail -1 | awk '{ print $8 }'`
echo " Si correction: $free_si eV, C correction: $free_c eV"
-
+#echo "-> $energy | $total | $sicnt | $ccnt | $free_si | $free_c <-"
echo $energy $total | \
awk '{ print " total e: " $1 " eV, per atom: " $1/$2 " eV"}'
echo "$energy $sicnt $ccnt $free_si $free_c" | \