Add tests ton fail the test in case of failure

MUMPS/testcase_charge/validate.sh

@@ -13,12 +13,18 @@ operations_in_node_elimination_good=63980000000000
 
 operations_in_node_elimination=$(printf -- "%.25g" `grep 'Operations in node elimination' $file  | sort -u |  awk '{print $7}' | tr 'D' 'E'`)
 
-echo $operations_in_node_elimination_good $operations_in_node_elimination $max_allowed_diff| awk '{if (sqrt(($1 - $2)^2) > $3) print "ERROR Operations in node elimination differs more than "$3; else print "OK accurate Operations in node elimination"}'
+echo $operations_in_node_elimination_good $operations_in_node_elimination $max_allowed_diff| awk '{if (sqrt(($1 - $2)^2) > $3) print "ERROR Operations in node elimination differs more than "$3; else print "OK accurate Operations in node elimination"}' 
+echo $operations_in_node_elimination_good $operations_in_node_elimination $max_allowed_diff| awk '{if (sqrt(($1 - $2)^2) > $3) print "ERROR Operations in node elimination differs more than "$3; else print "OK accurate Operations in node elimination"}' >> exitornot
 
 max_allowed_diff=0.0
 flops_difference_good=0.0
 flops_difference=$(printf -- "%.25g" `grep "FLOPS_REFERENCE DIFFERENCE" results-mumps-charge/output_*.log  | awk '{print $4}' | sort -u | sort -n -k1 | tail -n 1`)
 echo $flops_difference_good $flops_difference $max_allowed_diff| awk '{if (sqrt(($1 - $2)^2) > $3) print "ERROR flops differs more than "$3; else print "OK accurate flops"}'
-message=`echo $flops_difference_good $flops_difference $max_allowed_diff| awk '{if (sqrt(($1 - $2)^2) > $3) print "ERROR flops differs more than "$3; else print "OK accurate flops"}'`
+echo $flops_difference_good $flops_difference $max_allowed_diff| awk '{if (sqrt(($1 - $2)^2) > $3) print "ERROR flops differs more than "$3; else print "OK accurate flops"}' >> exitornot
  
+# linked to set -e, if the grep doesn't work, the script will fail
+grep "OK accurate Operations in node elimination" exitornot
+grep "OK accurate flops" exitornot
+rm exitornot
+
 grep "BENCH: TIME" $file  | grep "simultaneous instances" | awk -F= '{print $2" instances time"$3}'

MUMPS/testcase_scale/validate.sh

@@ -14,10 +14,17 @@ operations_in_node_elimination_good=63980000000000
 operations_in_node_elimination=$(printf -- "%.25g" `grep 'Operations in node elimination' $file  | sort -u |  awk '{print $7}' | tr 'D' 'E'`)
 
 echo $operations_in_node_elimination_good $operations_in_node_elimination $max_allowed_diff| awk '{if (sqrt(($1 - $2)^2) > $3) print "ERROR Operations in node elimination differs more than "$3; else print "OK accurate Operations in node elimination"}'
+echo $operations_in_node_elimination_good $operations_in_node_elimination $max_allowed_diff| awk '{if (sqrt(($1 - $2)^2) > $3) print "ERROR Operations in node elimination differs more than "$3; else print "OK accurate Operations in node elimination"}' >> exitornot
 
 max_allowed_diff=0.0
 flops_difference_good=0.0
 flops_difference=$(printf -- "%.25g" `grep "FLOPS_REFERENCE DIFFERENCE" results-mumps-scale/output_*.log  | awk '{print $4}' | sort -u | sort -n -k1 | tail -n 1`)
 echo $flops_difference_good $flops_difference $max_allowed_diff| awk '{if (sqrt(($1 - $2)^2) > $3) print "ERROR flops differs more than "$3; else print "OK accurate flops"}'
+echo $flops_difference_good $flops_difference $max_allowed_diff| awk '{if (sqrt(($1 - $2)^2) > $3) print "ERROR flops differs more than "$3; else print "OK accurate flops"}' >> exitornot
+
+# linked to set -e, if the grep doesn't work, the script will fail
+grep "OK accurate Operations in node elimination" exitornot
+grep "OK accurate flops" exitornot
+rm exitornot
 
 grep "BENCH: TIME" $file  | grep "simultaneous instances" | awk -F= '{print $2" instances time"$3}'

VASP/testcase_small/validate.sh

@@ -4,19 +4,18 @@ set -x
 mkdir -p results-vasp
 cp -a OUTCAR* results-vasp/
 
-
 max_allowed_diff=00000.0001
 free_energy_good=-2139.27098853
 grep free energy OUTCAR | tail -n1 > filetail
 
 file=filetail
-
- 
-
 free_energy=$(grep 'free  energy   TOTEN' filetail| awk  {'print $6'})
 
 echo $free_energy
 
 echo $free_energy_good $free_energy $max_allowed_diff| awk '{if (sqrt(($1 - $2)^2) > $3) print "ERROR free energyTOTEN differs more than "$3; else print "OK accurate Total energy"}'
+echo $free_energy_good $free_energy $max_allowed_diff| awk '{if (sqrt(($1 - $2)^2) > $3) print "ERROR free energyTOTEN differs more than "$3; else print "OK accurate Total energy"}' >> exitornot
 
-
+# linked to set -e, if the grep doesn't work, the script will fail
+grep "OK accurate Total energy" exitornot
+rm exitornot