[Wien] Layer of BaF2

mourad boujnah boujnah.mourad at gmail.com
Tue Nov 4 23:26:56 CET 2014


Dear Wien2k users:

I want to build a layer of BaF2 and see the effect of surface on the gap.
Following the steps of creating the structure. and initialization
The calculation starts with Lapw0, lapw1 and error appears in lapw2
I have tried to solve the problem on the link:
http://www.wien2k.at/reg_user/faq/qtlb.html

Trying to change the Energy-parameters,or  RMt but nothing worked
Please i need a help
Best regards

-- 
Mourad BOUJNAH
PhD Student in laboratory of magnetism and physics of high energy
Faculty of Sciences in Rabat - Morocco
Tel: *+212 **677316706*
Email:
*boujnah.mourad at gmail.com <boujnah.mourad at gmail.com>**"Research is to see
what everybody else has seen, and to think what nobody else has thought"*
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