ctest ref val
authorCezary Czaplewski <czarek@chem.univ.gda.pl>
Sun, 5 Apr 2020 19:23:24 +0000 (21:23 +0200)
committerCezary Czaplewski <czarek@chem.univ.gda.pl>
Sun, 5 Apr 2020 19:23:24 +0000 (21:23 +0200)
ctest/newcorr/prota_unres_energy_check_mult.sh

index 7384c55..e415b57 100755 (executable)
@@ -243,7 +243,7 @@ elif [ "$1" ==  "Ts866_checkgrad_full" ] ; then
  fi
  
  
- if [ `echo "a=${diff};a>0.0020"|bc -l` != "0" ]; then
+ if [ `echo "a=${diff};a>0.0070"|bc -l` != "0" ]; then
     echo 'ERROR largest abs(1-numerical/analytical)' ${diff}
     echo ' greater than 0.0070'
     exit_error=1