Merge branch 'master' of gitlab.com:scemama/qp_plugins_scemama

devel/qmcchem/install

@@ -1,23 +0,0 @@
-#!/bin/bash
-
-# Check if the QP_ROOT environment variable is set.
-if [[ -z ${QP_ROOT} ]]
-then
-  print "The QP_ROOT environment variable is not set."
-  print "Please reload the quantum_package.rc file."
-  exit -1
-fi
-
-pkg-config --libs trexio > LIB
-
-scripts_list="qp_import_trexio.py"
-
-# Destroy ONLY the symbolic link for the scripts to be used in the
-# ${QP_ROOT}/scripts/ directory.
-for i in $scripts_list
-do
-  find ${QP_ROOT}/scripts/$i -type l -delete
-done
-
-# Create symlink in scripts
-ln --symbolic ${PWD}/qp_import_trexio.py $QP_ROOT/scripts

devel/qmcchem/save_for_qmcchem.irp.f

@@ -42,7 +42,7 @@ program save_for_qmc
   write(iunit,*) e_ref
   close(iunit)
 
-  call export_trexio
+  call export_trexio(.True.)
 end
 
 ! ---