[Wien] No convergence during Volume Optimization

[Abderrahmane Reggad]

Thank you Prof Laurence for your answer

As I said in my answer to Dr Pieper I have resolved the problem by using
another cell parameters and with other points.

This problem happens usually when doing volume optimization and I my
procedure  to resolve the problem was to delete the points with convergence
problem or choosing the cell parameters leading to energy close to the
minmum energy with different points .

Best regards

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