Tiny fix for QChem interface

JanosJiri · danielhollas · commit 2b2c3b4d39da · 2025-10-08T14:59:32.000+01:00
diff --git a/interfaces/QCHEM/r.qchem b/interfaces/QCHEM/r.qchem
@@ -25,7 +25,7 @@ echo '$end
 
 $rem'>>$input
 
-if [[ $timestep -ne 1 ]]; then
+if [[ $timestep -ne 0 ]]; then
   echo 'SCF_GUESS read'>>$input
 fi
 
