[Wien] How to calculate Band structure and DOS by the onsite hybrid method

[Fecher, Gerhard]

Do you mean x_lapw or x lapw ? Sometimes an underscore makes a difference !
and what was the difference between x lapw1 -eece and x lapw1, when you tried it ?

Ciao
Gerhard

DEEP THOUGHT in D. Adams; Hitchhikers Guide to the Galaxy:
"I think the problem, to be quite honest with you,
is that you have never actually known what the question is."

====================================
Dr. Gerhard H. Fecher
Institut of Inorganic and Analytical Chemistry
Johannes Gutenberg - University
55099 Mainz
and
Max Planck Institute for Chemical Physics of Solids
01187 Dresden
________________________________________
Von: Wien [wien-bounces at zeus.theochem.tuwien.ac.at] im Auftrag von Abderrahmane Reggad [jazairdz at gmail.com]
Gesendet: Montag, 16. Januar 2017 13:40
An: wien at zeus.theochem.tuwien.ac.at
Betreff: Re: [Wien] How to calculate Band structure and DOS by the onsite hybrid method

Thanks Dr Gavin for your answer

- The the -eece flag exists for the script x lapw ( page 58 of the usetguide ( http://susi.theochem.tuwien.ac.at/reg_user/textbooks/usersguide.pdf ) and I tried it and it works well.

- Even for spaghetti I have executed the following command and it doesn't give error but i don't know if it's correct or no.

Best regards

--
Mr: A.Reggad
Laboratoire de Génie Physique
Université Ibn Khaldoun - Tiaret
Adresse: BP 144 AL ATTAF AIN DEFLA
Tel: +213(0)561861963
Algerie