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

Abderrahmane Reggad jazairdz at gmail.com
Mon Jan 16 19:36:34 CET 2017


I am sorry I have made mistake

The main script  x_lapw has a flag " -eece " and the script x lapw1 doesn't

I don't know what's the difference between them

And about the difference between the x lapw1 and x lapw1 -eece commands
lies in the fact that the first is for standard method (gga or lda ) while
the latter is for the gga+eece or lda+eece.

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
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