[Wien] How to apply the method of Madsen and Novak to generate the imput files of any compound

ABDERRAHMANE REGGAD jazairdz at gmail.com
Thu Apr 7 11:36:51 CEST 2016


Hello wien2k users

I have done successfully the calculation of the U parameter of the NiO
material using the method of Georg K. H. Madsen and Pavel Novak throw their
article (Article) .
<http://www.wien2k.at/reg_user/textbooks/Constraint_U.pdf>

Now I want to know to use this method to generate the imput files
(case.in1, case.in2,...) for any material.

For me I want to apply that for the NiS, and I will join the structure file.

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