Changeset 1e66bf for src/lib

Timestamp:

Mar 6, 2016, 9:51:31 PM (10 years ago)

Author:

Frederik Heber <heber@…>

Children:

8b0cdc

Parents:

961fac

git-author:

Frederik Heber <heber@…> (03/02/16 23:51:51)

git-committer:

Frederik Heber <heber@…> (03/06/16 21:51:31)

Message:

Catching when accuracy is not reached and placing values into MPQCData.

File:

• src/lib/chemistry/qc/scf/clhf.cc (modified) (1 diff)

src/lib/chemistry/qc/scf/clhf.cc

@@ -280 +280 @@
     ec = lclc.ec;
     ex = lclc.ex;
-    scf_grp_->sum(&ec, 1, 0, 0);
-    scf_grp_->sum(&ex, 1, 0, 0);
   }
   else {