[Pw_forum] projwfc.x

[Bertrand SITAMTZE]

Dear Taoufek,

I think the problem is with the namelist: In QE-5.0.1, one should use "&projwfc" instead of  "&inputpp". Follow the link for 
explanation on other input items and adjust yours.
 http://www.quantum-espresso.org/wp-content/uploads/Doc/INPUT_PROJWFC.html

HTH

 
***************************
Bertrand  SITAMTZEY.
Laboratory of Material Sciences
Department of Physics
Faculty of Sciences
University of Yaounde I-Cameroon
CURRENT ADDRESS
IMMM, Université du Maine
Le Mans, France
Tél: +33 6 67 61 52 15
****************************


________________________________
 De : Sakhrawi Taoufek <tsakhrawi at yahoo.com>
À : PWSCF Forum <Pw_forum at pwscf.org> 
Envoyé le : Vendredi 12 avril 2013 11h35
Objet : [Pw_forum] projwfc.x
 


Dear all,
i use the same for pdos calculation with projwfc.x, it works with espresso-4.3.2 but not with espresso-5.0.1 with the error message : 


     Error in routine projwfc (1):      reading projwfc namelist

my input is : 

  &inputpp
    prefix='fe',
    outdir='$outdir',
    degauss=0.01,
    Emin=2.0,  Emax=22.0, DeltaE=0.1, smoothing=0.3,
/
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