[Wien] What does it mean the commment " Unmatched " during SCF cycle

[Abderrahmane Reggad]

Dear Wien2k Users

During the Volume optimization and after adding another point "-9 per cent
" to get a good curve , I got this comment "Unmatched "even the calculation
still running without error:

The following show part of the SCF cycle with the comment "Unmatched "

in cycle 5    ETEST: .0644580350000000   CTEST: .0057531
Unmatched ".
 MIXER END
 CORE  END
 CORE  END
 SUMPARA END
LAPWDM END
LAPWDM END
LAPWDM END
LAPWDM END
LAPWDM END
LAPWDM END
 SUMPARA END
 LAPW2 END
 LAPW2 END
 LAPW2 END
 LAPW2 END
 LAPW2 END
 LAPW2 END
LAPW2 - FERMI; weighs written
 LAPW1 END
 LAPW1 END
 LAPW1 END
 LAPW1 END
 LAPW1 END
 LAPW1 END
 ORB   END
 ORB   END
 LAPW0 END
in cycle 4    ETEST: .0356556300000000   CTEST: .0207127
Unmatched ".
 MIXER END

What does it mean that ? Is there any problem ?


Best regards


-- 
Mr: A.Reggad
Laboratoire de Génie Physique
Université Ibn Khaldoun - Tiaret
Algerie
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