Dear, Dr Blaha CuO is supposed to a semiconductor which have a direct band
gap but,when I do the calcul  with GGA+U and MBJ the calcul show  that CuO
is a metallic element.how to solve this problem.
cordially

-- 
--------------------------------------------------------------------
Adil ES-SMAIRI
PhD Student at university of Sultan Moulay Slimane
Departement of physic-Beni Mellal
Tel: +212 673 445 992
---------------------------------
_______________________________________________
Wien mailing list
Wien@zeus.theochem.tuwien.ac.at
http://zeus.theochem.tuwien.ac.at/mailman/listinfo/wien
SEARCH the MAILING-LIST at:  
http://www.mail-archive.com/wien@zeus.theochem.tuwien.ac.at/index.html

Reply via email to